data_9F0U
# 
_entry.id   9F0U 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9F0U         pdb_00009f0u 10.2210/pdb9f0u/pdb 
WWPDB D_1292134498 ?            ?                   
# 
_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       2025-04-30 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9F0U 
_pdbx_database_status.recvd_initial_deposition_date   2024-04-17 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 3 
_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   0000-0001-8611-4743 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Tooke, C.L.'    1 ? 
'Hinchliffe, P.' 2 ? 
'Spencer, J.'    3 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'Structure of KPC-2 complexed with benzoxaborole AK-425' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Tooke, C.L.'    1 ? 
primary 'Hinchliffe, P.' 2 ? 
primary 'Spencer, J.'    3 ? 
# 
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'                                       30806.631 1   3.5.2.6 ? ? ? 
2 non-polymer syn GLYCEROL                                                                          92.094    1   ?       ? ? ? 
3 non-polymer syn 'SULFATE ION'                                                                     96.063    4   ?       ? ? ? 
4 non-polymer syn '(9S)-7-oxidanyl-8-oxa-7-boranuidabicyclo[4.3.0]nona-1,3,5-triene-9-carbonitrile' 158.950   1   ?       ? ? ? 
5 non-polymer syn 'SODIUM ION'                                                                      22.990    1   ?       ? ? ? 
6 water       nat water                                                                             18.015    411 ?       ? ? ? 
# 
_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
QQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDR
WELELNSAIPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIRAAVPADWAVGDKTGTCGVYGTA
NDYAVVWPTGRAPIVLAVYTRAPNKDDKHSEAVIAAAARLALEGLGVNGQ
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MGSSHHHHHHSSGLVPRGSHMLTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSFKGFLAAAVLARS
QQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDR
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 'SULFATE ION'                                                                     SO4 
4 '(9S)-7-oxidanyl-8-oxa-7-boranuidabicyclo[4.3.0]nona-1,3,5-triene-9-carbonitrile' XR9 
5 'SODIUM ION'                                                                      NA  
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  GLY 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              Solu 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE                                                                           ? 'C3 H7 N O2'      
89.093  
ARG 'L-peptide linking' y ARGININE                                                                          ? 'C6 H15 N4 O2 1'  
175.209 
ASN 'L-peptide linking' y ASPARAGINE                                                                        ? 'C4 H8 N2 O3'     
132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'                                                                   ? 'C4 H7 N O4'      
133.103 
CYS 'L-peptide linking' y CYSTEINE                                                                          ? 'C3 H7 N O2 S'    
121.158 
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 
NA  non-polymer         . 'SODIUM ION'                                                                      ? 'Na 1'            
22.990  
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 
XR9 non-polymer         . '(9S)-7-oxidanyl-8-oxa-7-boranuidabicyclo[4.3.0]nona-1,3,5-triene-9-carbonitrile' ? 'C8 H6 B N O2 -1' 
158.950 
# 
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   5   ?   ?   ?   A . n 
A 1 2   GLY 2   6   ?   ?   ?   A . n 
A 1 3   SER 3   7   ?   ?   ?   A . n 
A 1 4   SER 4   8   ?   ?   ?   A . n 
A 1 5   HIS 5   9   ?   ?   ?   A . n 
A 1 6   HIS 6   10  ?   ?   ?   A . n 
A 1 7   HIS 7   11  ?   ?   ?   A . n 
A 1 8   HIS 8   12  ?   ?   ?   A . n 
A 1 9   HIS 9   13  ?   ?   ?   A . n 
A 1 10  HIS 10  14  ?   ?   ?   A . n 
A 1 11  SER 11  15  ?   ?   ?   A . n 
A 1 12  SER 12  16  ?   ?   ?   A . n 
A 1 13  GLY 13  17  ?   ?   ?   A . n 
A 1 14  LEU 14  18  ?   ?   ?   A . n 
A 1 15  VAL 15  19  ?   ?   ?   A . n 
A 1 16  PRO 16  20  ?   ?   ?   A . n 
A 1 17  ARG 17  21  ?   ?   ?   A . n 
A 1 18  GLY 18  22  ?   ?   ?   A . n 
A 1 19  SER 19  23  ?   ?   ?   A . n 
A 1 20  HIS 20  24  24  HIS HIS A . n 
A 1 21  MET 21  25  25  MET MET A . n 
A 1 22  LEU 22  26  26  LEU LEU A . n 
A 1 23  THR 23  27  27  THR THR A . n 
A 1 24  ASN 24  28  28  ASN ASN A . n 
A 1 25  LEU 25  29  29  LEU LEU A . n 
A 1 26  VAL 26  30  30  VAL VAL A . n 
A 1 27  ALA 27  31  31  ALA ALA A . n 
A 1 28  GLU 28  32  32  GLU GLU A . n 
A 1 29  PRO 29  33  33  PRO PRO A . n 
A 1 30  PHE 30  34  34  PHE PHE A . n 
A 1 31  ALA 31  35  35  ALA ALA A . n 
A 1 32  LYS 32  36  36  LYS LYS A . n 
A 1 33  LEU 33  37  37  LEU LEU A . n 
A 1 34  GLU 34  38  38  GLU GLU A . n 
A 1 35  GLN 35  39  39  GLN GLN A . n 
A 1 36  ASP 36  40  40  ASP ASP A . n 
A 1 37  PHE 37  41  41  PHE PHE A . n 
A 1 38  GLY 38  42  42  GLY GLY A . n 
A 1 39  GLY 39  43  43  GLY GLY A . n 
A 1 40  SER 40  44  44  SER SER A . n 
A 1 41  ILE 41  45  45  ILE ILE A . n 
A 1 42  GLY 42  46  46  GLY GLY A . n 
A 1 43  VAL 43  47  47  VAL VAL A . n 
A 1 44  TYR 44  48  48  TYR TYR A . n 
A 1 45  ALA 45  49  49  ALA ALA A . n 
A 1 46  MET 46  50  50  MET MET A . n 
A 1 47  ASP 47  51  51  ASP ASP A . n 
A 1 48  THR 48  52  52  THR THR A . n 
A 1 49  GLY 49  53  53  GLY GLY A . n 
A 1 50  SER 50  54  54  SER SER A . n 
A 1 51  GLY 51  55  55  GLY GLY A . n 
A 1 52  ALA 52  56  56  ALA ALA A . n 
A 1 53  THR 53  57  57  THR THR A . n 
A 1 54  VAL 54  58  58  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  GLY 85  89  89  GLY GLY 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 249 253 253 THR THR A . n 
A 1 250 GLY 250 254 254 GLY GLY A . n 
A 1 251 ARG 251 255 255 ARG ARG A . n 
A 1 252 ALA 252 256 256 ALA ALA A . n 
A 1 253 PRO 253 257 257 PRO PRO A . n 
A 1 254 ILE 254 258 258 ILE ILE A . n 
A 1 255 VAL 255 259 259 VAL VAL A . n 
A 1 256 LEU 256 260 260 LEU LEU A . n 
A 1 257 ALA 257 261 261 ALA ALA A . n 
A 1 258 VAL 258 262 262 VAL VAL A . n 
A 1 259 TYR 259 263 263 TYR TYR A . n 
A 1 260 THR 260 264 264 THR THR A . n 
A 1 261 ARG 261 265 265 ARG ARG A . n 
A 1 262 ALA 262 266 266 ALA ALA A . n 
A 1 263 PRO 263 267 267 PRO PRO A . n 
A 1 264 ASN 264 268 268 ASN ASN A . n 
A 1 265 LYS 265 269 269 LYS LYS A . n 
A 1 266 ASP 266 270 270 ASP ASP A . n 
A 1 267 ASP 267 271 271 ASP ASP A . n 
A 1 268 LYS 268 272 272 LYS LYS A . n 
A 1 269 HIS 269 273 273 HIS HIS A . n 
A 1 270 SER 270 274 274 SER SER A . n 
A 1 271 GLU 271 275 275 GLU GLU A . n 
A 1 272 ALA 272 276 276 ALA ALA A . n 
A 1 273 VAL 273 277 277 VAL VAL A . n 
A 1 274 ILE 274 278 278 ILE ILE A . n 
A 1 275 ALA 275 279 279 ALA ALA A . n 
A 1 276 ALA 276 280 280 ALA ALA A . n 
A 1 277 ALA 277 281 281 ALA ALA A . n 
A 1 278 ALA 278 282 282 ALA ALA A . n 
A 1 279 ARG 279 283 283 ARG ARG A . n 
A 1 280 LEU 280 284 284 LEU LEU A . n 
A 1 281 ALA 281 285 285 ALA ALA A . n 
A 1 282 LEU 282 286 286 LEU LEU A . n 
A 1 283 GLU 283 287 287 GLU GLU A . n 
A 1 284 GLY 284 288 288 GLY GLY A . n 
A 1 285 LEU 285 289 289 LEU LEU A . n 
A 1 286 GLY 286 290 290 GLY GLY A . n 
A 1 287 VAL 287 291 291 VAL VAL A . n 
A 1 288 ASN 288 292 292 ASN ASN A . n 
A 1 289 GLY 289 293 293 GLY GLY A . n 
A 1 290 GLN 290 294 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        XR9 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   XR9 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 GOL 1   301 400 GOL GOL A . 
C 3 SO4 1   302 402 SO4 SO4 A . 
D 3 SO4 1   303 403 SO4 SO4 A . 
E 4 XR9 1   304 888 XR9 AK1 A . 
F 3 SO4 1   305 1   SO4 SO4 A . 
G 3 SO4 1   306 3   SO4 SO4 A . 
H 5 NA  1   307 1   NA  NA  A . 
I 6 HOH 1   401 500 HOH HOH A . 
I 6 HOH 2   402 501 HOH HOH A . 
I 6 HOH 3   403 506 HOH HOH A . 
I 6 HOH 4   404 515 HOH HOH A . 
I 6 HOH 5   405 503 HOH HOH A . 
I 6 HOH 6   406 502 HOH HOH A . 
I 6 HOH 7   407 514 HOH HOH A . 
I 6 HOH 8   408 508 HOH HOH A . 
I 6 HOH 9   409 28  HOH HOH A . 
I 6 HOH 10  410 505 HOH HOH A . 
I 6 HOH 11  411 3   HOH HOH A . 
I 6 HOH 12  412 512 HOH HOH A . 
I 6 HOH 13  413 32  HOH HOH A . 
I 6 HOH 14  414 27  HOH HOH A . 
I 6 HOH 15  415 510 HOH HOH A . 
I 6 HOH 16  416 511 HOH HOH A . 
I 6 HOH 17  417 528 HOH HOH A . 
I 6 HOH 18  418 518 HOH HOH A . 
I 6 HOH 19  419 504 HOH HOH A . 
I 6 HOH 20  420 509 HOH HOH A . 
I 6 HOH 21  421 538 HOH HOH A . 
I 6 HOH 22  422 507 HOH HOH A . 
I 6 HOH 23  423 544 HOH HOH A . 
I 6 HOH 24  424 558 HOH HOH A . 
I 6 HOH 25  425 529 HOH HOH A . 
I 6 HOH 26  426 513 HOH HOH A . 
I 6 HOH 27  427 1   HOH HOH A . 
I 6 HOH 28  428 530 HOH HOH A . 
I 6 HOH 29  429 522 HOH HOH A . 
I 6 HOH 30  430 628 HOH HOH A . 
I 6 HOH 31  431 527 HOH HOH A . 
I 6 HOH 32  432 534 HOH HOH A . 
I 6 HOH 33  433 516 HOH HOH A . 
I 6 HOH 34  434 533 HOH HOH A . 
I 6 HOH 35  435 13  HOH HOH A . 
I 6 HOH 36  436 539 HOH HOH A . 
I 6 HOH 37  437 543 HOH HOH A . 
I 6 HOH 38  438 23  HOH HOH A . 
I 6 HOH 39  439 549 HOH HOH A . 
I 6 HOH 40  440 553 HOH HOH A . 
I 6 HOH 41  441 559 HOH HOH A . 
I 6 HOH 42  442 536 HOH HOH A . 
I 6 HOH 43  443 517 HOH HOH A . 
I 6 HOH 44  444 523 HOH HOH A . 
I 6 HOH 45  445 531 HOH HOH A . 
I 6 HOH 46  446 526 HOH HOH A . 
I 6 HOH 47  447 576 HOH HOH A . 
I 6 HOH 48  448 521 HOH HOH A . 
I 6 HOH 49  449 550 HOH HOH A . 
I 6 HOH 50  450 524 HOH HOH A . 
I 6 HOH 51  451 602 HOH HOH A . 
I 6 HOH 52  452 569 HOH HOH A . 
I 6 HOH 53  453 574 HOH HOH A . 
I 6 HOH 54  454 575 HOH HOH A . 
I 6 HOH 55  455 566 HOH HOH A . 
I 6 HOH 56  456 541 HOH HOH A . 
I 6 HOH 57  457 564 HOH HOH A . 
I 6 HOH 58  458 560 HOH HOH A . 
I 6 HOH 59  459 561 HOH HOH A . 
I 6 HOH 60  460 554 HOH HOH A . 
I 6 HOH 61  461 565 HOH HOH A . 
I 6 HOH 62  462 621 HOH HOH A . 
I 6 HOH 63  463 568 HOH HOH A . 
I 6 HOH 64  464 609 HOH HOH A . 
I 6 HOH 65  465 673 HOH HOH A . 
I 6 HOH 66  466 580 HOH HOH A . 
I 6 HOH 67  467 540 HOH HOH A . 
I 6 HOH 68  468 548 HOH HOH A . 
I 6 HOH 69  469 542 HOH HOH A . 
I 6 HOH 70  470 651 HOH HOH A . 
I 6 HOH 71  471 571 HOH HOH A . 
I 6 HOH 72  472 552 HOH HOH A . 
I 6 HOH 73  473 557 HOH HOH A . 
I 6 HOH 74  474 551 HOH HOH A . 
I 6 HOH 75  475 577 HOH HOH A . 
I 6 HOH 76  476 592 HOH HOH A . 
I 6 HOH 77  477 641 HOH HOH A . 
I 6 HOH 78  478 607 HOH HOH A . 
I 6 HOH 79  479 532 HOH HOH A . 
I 6 HOH 80  480 545 HOH HOH A . 
I 6 HOH 81  481 563 HOH HOH A . 
I 6 HOH 82  482 581 HOH HOH A . 
I 6 HOH 83  483 593 HOH HOH A . 
I 6 HOH 84  484 585 HOH HOH A . 
I 6 HOH 85  485 556 HOH HOH A . 
I 6 HOH 86  486 555 HOH HOH A . 
I 6 HOH 87  487 546 HOH HOH A . 
I 6 HOH 88  488 567 HOH HOH A . 
I 6 HOH 89  489 588 HOH HOH A . 
I 6 HOH 90  490 573 HOH HOH A . 
I 6 HOH 91  491 591 HOH HOH A . 
I 6 HOH 92  492 520 HOH HOH A . 
I 6 HOH 93  493 572 HOH HOH A . 
I 6 HOH 94  494 600 HOH HOH A . 
I 6 HOH 95  495 535 HOH HOH A . 
I 6 HOH 96  496 594 HOH HOH A . 
I 6 HOH 97  497 622 HOH HOH A . 
I 6 HOH 98  498 608 HOH HOH A . 
I 6 HOH 99  499 604 HOH HOH A . 
I 6 HOH 100 500 618 HOH HOH A . 
I 6 HOH 101 501 570 HOH HOH A . 
I 6 HOH 102 502 627 HOH HOH A . 
I 6 HOH 103 503 582 HOH HOH A . 
I 6 HOH 104 504 589 HOH HOH A . 
I 6 HOH 105 505 603 HOH HOH A . 
I 6 HOH 106 506 583 HOH HOH A . 
I 6 HOH 107 507 629 HOH HOH A . 
I 6 HOH 108 508 595 HOH HOH A . 
I 6 HOH 109 509 647 HOH HOH A . 
I 6 HOH 110 510 697 HOH HOH A . 
I 6 HOH 111 511 578 HOH HOH A . 
I 6 HOH 112 512 601 HOH HOH A . 
I 6 HOH 113 513 633 HOH HOH A . 
I 6 HOH 114 514 579 HOH HOH A . 
I 6 HOH 115 515 587 HOH HOH A . 
I 6 HOH 116 516 638 HOH HOH A . 
I 6 HOH 117 517 674 HOH HOH A . 
I 6 HOH 118 518 4   HOH HOH A . 
I 6 HOH 119 519 525 HOH HOH A . 
I 6 HOH 120 520 605 HOH HOH A . 
I 6 HOH 121 521 637 HOH HOH A . 
I 6 HOH 122 522 616 HOH HOH A . 
I 6 HOH 123 523 615 HOH HOH A . 
I 6 HOH 124 524 649 HOH HOH A . 
I 6 HOH 125 525 648 HOH HOH A . 
I 6 HOH 126 526 626 HOH HOH A . 
I 6 HOH 127 527 547 HOH HOH A . 
I 6 HOH 128 528 634 HOH HOH A . 
I 6 HOH 129 529 562 HOH HOH A . 
I 6 HOH 130 530 646 HOH HOH A . 
I 6 HOH 131 531 614 HOH HOH A . 
I 6 HOH 132 532 537 HOH HOH A . 
I 6 HOH 133 533 660 HOH HOH A . 
I 6 HOH 134 534 643 HOH HOH A . 
I 6 HOH 135 535 596 HOH HOH A . 
I 6 HOH 136 536 724 HOH HOH A . 
I 6 HOH 137 537 632 HOH HOH A . 
I 6 HOH 138 538 14  HOH HOH A . 
I 6 HOH 139 539 584 HOH HOH A . 
I 6 HOH 140 540 653 HOH HOH A . 
I 6 HOH 141 541 650 HOH HOH A . 
I 6 HOH 142 542 662 HOH HOH A . 
I 6 HOH 143 543 631 HOH HOH A . 
I 6 HOH 144 544 635 HOH HOH A . 
I 6 HOH 145 545 642 HOH HOH A . 
I 6 HOH 146 546 668 HOH HOH A . 
I 6 HOH 147 547 639 HOH HOH A . 
I 6 HOH 148 548 623 HOH HOH A . 
I 6 HOH 149 549 586 HOH HOH A . 
I 6 HOH 150 550 656 HOH HOH A . 
I 6 HOH 151 551 624 HOH HOH A . 
I 6 HOH 152 552 598 HOH HOH A . 
I 6 HOH 153 553 661 HOH HOH A . 
I 6 HOH 154 554 663 HOH HOH A . 
I 6 HOH 155 555 672 HOH HOH A . 
I 6 HOH 156 556 613 HOH HOH A . 
I 6 HOH 157 557 619 HOH HOH A . 
I 6 HOH 158 558 666 HOH HOH A . 
I 6 HOH 159 559 29  HOH HOH A . 
I 6 HOH 160 560 676 HOH HOH A . 
I 6 HOH 161 561 590 HOH HOH A . 
I 6 HOH 162 562 654 HOH HOH A . 
I 6 HOH 163 563 645 HOH HOH A . 
I 6 HOH 164 564 599 HOH HOH A . 
I 6 HOH 165 565 597 HOH HOH A . 
I 6 HOH 166 566 617 HOH HOH A . 
I 6 HOH 167 567 682 HOH HOH A . 
I 6 HOH 168 568 10  HOH HOH A . 
I 6 HOH 169 569 691 HOH HOH A . 
I 6 HOH 170 570 695 HOH HOH A . 
I 6 HOH 171 571 667 HOH HOH A . 
I 6 HOH 172 572 720 HOH HOH A . 
I 6 HOH 173 573 684 HOH HOH A . 
I 6 HOH 174 574 644 HOH HOH A . 
I 6 HOH 175 575 625 HOH HOH A . 
I 6 HOH 176 576 655 HOH HOH A . 
I 6 HOH 177 577 652 HOH HOH A . 
I 6 HOH 178 578 640 HOH HOH A . 
I 6 HOH 179 579 685 HOH HOH A . 
I 6 HOH 180 580 612 HOH HOH A . 
I 6 HOH 181 581 706 HOH HOH A . 
I 6 HOH 182 582 679 HOH HOH A . 
I 6 HOH 183 583 670 HOH HOH A . 
I 6 HOH 184 584 620 HOH HOH A . 
I 6 HOH 185 585 702 HOH HOH A . 
I 6 HOH 186 586 636 HOH HOH A . 
I 6 HOH 187 587 664 HOH HOH A . 
I 6 HOH 188 588 5   HOH HOH A . 
I 6 HOH 189 589 671 HOH HOH A . 
I 6 HOH 190 590 699 HOH HOH A . 
I 6 HOH 191 591 683 HOH HOH A . 
I 6 HOH 192 592 692 HOH HOH A . 
I 6 HOH 193 593 696 HOH HOH A . 
I 6 HOH 194 594 26  HOH HOH A . 
I 6 HOH 195 595 717 HOH HOH A . 
I 6 HOH 196 596 658 HOH HOH A . 
I 6 HOH 197 597 610 HOH HOH A . 
I 6 HOH 198 598 681 HOH HOH A . 
I 6 HOH 199 599 675 HOH HOH A . 
I 6 HOH 200 600 705 HOH HOH A . 
I 6 HOH 201 601 611 HOH HOH A . 
I 6 HOH 202 602 688 HOH HOH A . 
I 6 HOH 203 603 710 HOH HOH A . 
I 6 HOH 204 604 700 HOH HOH A . 
I 6 HOH 205 605 686 HOH HOH A . 
I 6 HOH 206 606 687 HOH HOH A . 
I 6 HOH 207 607 689 HOH HOH A . 
I 6 HOH 208 608 740 HOH HOH A . 
I 6 HOH 209 609 734 HOH HOH A . 
I 6 HOH 210 610 704 HOH HOH A . 
I 6 HOH 211 611 665 HOH HOH A . 
I 6 HOH 212 612 739 HOH HOH A . 
I 6 HOH 213 613 708 HOH HOH A . 
I 6 HOH 214 614 698 HOH HOH A . 
I 6 HOH 215 615 718 HOH HOH A . 
I 6 HOH 216 616 719 HOH HOH A . 
I 6 HOH 217 617 694 HOH HOH A . 
I 6 HOH 218 618 693 HOH HOH A . 
I 6 HOH 219 619 716 HOH HOH A . 
I 6 HOH 220 620 690 HOH HOH A . 
I 6 HOH 221 621 2   HOH HOH A . 
I 6 HOH 222 622 677 HOH HOH A . 
I 6 HOH 223 623 744 HOH HOH A . 
I 6 HOH 224 624 707 HOH HOH A . 
I 6 HOH 225 625 24  HOH HOH A . 
I 6 HOH 226 626 746 HOH HOH A . 
I 6 HOH 227 627 701 HOH HOH A . 
I 6 HOH 228 628 723 HOH HOH A . 
I 6 HOH 229 629 713 HOH HOH A . 
I 6 HOH 230 630 703 HOH HOH A . 
I 6 HOH 231 631 669 HOH HOH A . 
I 6 HOH 232 632 657 HOH HOH A . 
I 6 HOH 233 633 788 HOH HOH A . 
I 6 HOH 234 634 725 HOH HOH A . 
I 6 HOH 235 635 659 HOH HOH A . 
I 6 HOH 236 636 711 HOH HOH A . 
I 6 HOH 237 637 729 HOH HOH A . 
I 6 HOH 238 638 721 HOH HOH A . 
I 6 HOH 239 639 745 HOH HOH A . 
I 6 HOH 240 640 727 HOH HOH A . 
I 6 HOH 241 641 735 HOH HOH A . 
I 6 HOH 242 642 733 HOH HOH A . 
I 6 HOH 243 643 743 HOH HOH A . 
I 6 HOH 244 644 731 HOH HOH A . 
I 6 HOH 245 645 709 HOH HOH A . 
I 6 HOH 246 646 714 HOH HOH A . 
I 6 HOH 247 647 630 HOH HOH A . 
I 6 HOH 248 648 726 HOH HOH A . 
I 6 HOH 249 649 728 HOH HOH A . 
I 6 HOH 250 650 730 HOH HOH A . 
I 6 HOH 251 651 749 HOH HOH A . 
I 6 HOH 252 652 741 HOH HOH A . 
I 6 HOH 253 653 715 HOH HOH A . 
I 6 HOH 254 654 680 HOH HOH A . 
I 6 HOH 255 655 722 HOH HOH A . 
I 6 HOH 256 656 738 HOH HOH A . 
I 6 HOH 257 657 33  HOH HOH A . 
I 6 HOH 258 658 21  HOH HOH A . 
I 6 HOH 259 659 742 HOH HOH A . 
I 6 HOH 260 660 17  HOH HOH A . 
I 6 HOH 261 661 753 HOH HOH A . 
I 6 HOH 262 662 751 HOH HOH A . 
I 6 HOH 263 663 747 HOH HOH A . 
I 6 HOH 264 664 750 HOH HOH A . 
I 6 HOH 265 665 752 HOH HOH A . 
I 6 HOH 266 666 793 HOH HOH A . 
I 6 HOH 267 667 736 HOH HOH A . 
I 6 HOH 268 668 754 HOH HOH A . 
I 6 HOH 269 669 737 HOH HOH A . 
I 6 HOH 270 670 757 HOH HOH A . 
I 6 HOH 271 671 767 HOH HOH A . 
I 6 HOH 272 672 766 HOH HOH A . 
I 6 HOH 273 673 22  HOH HOH A . 
I 6 HOH 274 674 762 HOH HOH A . 
I 6 HOH 275 675 732 HOH HOH A . 
I 6 HOH 276 676 768 HOH HOH A . 
I 6 HOH 277 677 763 HOH HOH A . 
I 6 HOH 278 678 712 HOH HOH A . 
I 6 HOH 279 679 761 HOH HOH A . 
I 6 HOH 280 680 756 HOH HOH A . 
I 6 HOH 281 681 16  HOH HOH A . 
I 6 HOH 282 682 748 HOH HOH A . 
I 6 HOH 283 683 769 HOH HOH A . 
I 6 HOH 284 684 765 HOH HOH A . 
I 6 HOH 285 685 764 HOH HOH A . 
I 6 HOH 286 686 758 HOH HOH A . 
I 6 HOH 287 687 759 HOH HOH A . 
I 6 HOH 288 688 755 HOH HOH A . 
I 6 HOH 289 689 775 HOH HOH A . 
I 6 HOH 290 690 772 HOH HOH A . 
I 6 HOH 291 691 6   HOH HOH A . 
I 6 HOH 292 692 770 HOH HOH A . 
I 6 HOH 293 693 773 HOH HOH A . 
I 6 HOH 294 694 783 HOH HOH A . 
I 6 HOH 295 695 776 HOH HOH A . 
I 6 HOH 296 696 771 HOH HOH A . 
I 6 HOH 297 697 15  HOH HOH A . 
I 6 HOH 298 698 794 HOH HOH A . 
I 6 HOH 299 699 782 HOH HOH A . 
I 6 HOH 300 700 790 HOH HOH A . 
I 6 HOH 301 701 779 HOH HOH A . 
I 6 HOH 302 702 781 HOH HOH A . 
I 6 HOH 303 703 780 HOH HOH A . 
I 6 HOH 304 704 787 HOH HOH A . 
I 6 HOH 305 705 786 HOH HOH A . 
I 6 HOH 306 706 801 HOH HOH A . 
I 6 HOH 307 707 774 HOH HOH A . 
I 6 HOH 308 708 777 HOH HOH A . 
I 6 HOH 309 709 606 HOH HOH A . 
I 6 HOH 310 710 789 HOH HOH A . 
I 6 HOH 311 711 785 HOH HOH A . 
I 6 HOH 312 712 25  HOH HOH A . 
I 6 HOH 313 713 795 HOH HOH A . 
I 6 HOH 314 714 797 HOH HOH A . 
I 6 HOH 315 715 805 HOH HOH A . 
I 6 HOH 316 716 807 HOH HOH A . 
I 6 HOH 317 717 9   HOH HOH A . 
I 6 HOH 318 718 796 HOH HOH A . 
I 6 HOH 319 719 804 HOH HOH A . 
I 6 HOH 320 720 823 HOH HOH A . 
I 6 HOH 321 721 800 HOH HOH A . 
I 6 HOH 322 722 778 HOH HOH A . 
I 6 HOH 323 723 816 HOH HOH A . 
I 6 HOH 324 724 803 HOH HOH A . 
I 6 HOH 325 725 11  HOH HOH A . 
I 6 HOH 326 726 808 HOH HOH A . 
I 6 HOH 327 727 806 HOH HOH A . 
I 6 HOH 328 728 818 HOH HOH A . 
I 6 HOH 329 729 832 HOH HOH A . 
I 6 HOH 330 730 802 HOH HOH A . 
I 6 HOH 331 731 798 HOH HOH A . 
I 6 HOH 332 732 20  HOH HOH A . 
I 6 HOH 333 733 813 HOH HOH A . 
I 6 HOH 334 734 828 HOH HOH A . 
I 6 HOH 335 735 810 HOH HOH A . 
I 6 HOH 336 736 820 HOH HOH A . 
I 6 HOH 337 737 819 HOH HOH A . 
I 6 HOH 338 738 822 HOH HOH A . 
I 6 HOH 339 739 811 HOH HOH A . 
I 6 HOH 340 740 799 HOH HOH A . 
I 6 HOH 341 741 814 HOH HOH A . 
I 6 HOH 342 742 817 HOH HOH A . 
I 6 HOH 343 743 812 HOH HOH A . 
I 6 HOH 344 744 825 HOH HOH A . 
I 6 HOH 345 745 815 HOH HOH A . 
I 6 HOH 346 746 824 HOH HOH A . 
I 6 HOH 347 747 842 HOH HOH A . 
I 6 HOH 348 748 821 HOH HOH A . 
I 6 HOH 349 749 829 HOH HOH A . 
I 6 HOH 350 750 830 HOH HOH A . 
I 6 HOH 351 751 826 HOH HOH A . 
I 6 HOH 352 752 834 HOH HOH A . 
I 6 HOH 353 753 833 HOH HOH A . 
I 6 HOH 354 754 840 HOH HOH A . 
I 6 HOH 355 755 841 HOH HOH A . 
I 6 HOH 356 756 836 HOH HOH A . 
I 6 HOH 357 757 831 HOH HOH A . 
I 6 HOH 358 758 852 HOH HOH A . 
I 6 HOH 359 759 838 HOH HOH A . 
I 6 HOH 360 760 827 HOH HOH A . 
I 6 HOH 361 761 837 HOH HOH A . 
I 6 HOH 362 762 844 HOH HOH A . 
I 6 HOH 363 763 843 HOH HOH A . 
I 6 HOH 364 764 865 HOH HOH A . 
I 6 HOH 365 765 845 HOH HOH A . 
I 6 HOH 366 766 835 HOH HOH A . 
I 6 HOH 367 767 851 HOH HOH A . 
I 6 HOH 368 768 847 HOH HOH A . 
I 6 HOH 369 769 850 HOH HOH A . 
I 6 HOH 370 770 839 HOH HOH A . 
I 6 HOH 371 771 855 HOH HOH A . 
I 6 HOH 372 772 854 HOH HOH A . 
I 6 HOH 373 773 849 HOH HOH A . 
I 6 HOH 374 774 853 HOH HOH A . 
I 6 HOH 375 775 846 HOH HOH A . 
I 6 HOH 376 776 859 HOH HOH A . 
I 6 HOH 377 777 857 HOH HOH A . 
I 6 HOH 378 778 856 HOH HOH A . 
I 6 HOH 379 779 861 HOH HOH A . 
I 6 HOH 380 780 862 HOH HOH A . 
I 6 HOH 381 781 872 HOH HOH A . 
I 6 HOH 382 782 858 HOH HOH A . 
I 6 HOH 383 783 873 HOH HOH A . 
I 6 HOH 384 784 868 HOH HOH A . 
I 6 HOH 385 785 866 HOH HOH A . 
I 6 HOH 386 786 870 HOH HOH A . 
I 6 HOH 387 787 8   HOH HOH A . 
I 6 HOH 388 788 864 HOH HOH A . 
I 6 HOH 389 789 860 HOH HOH A . 
I 6 HOH 390 790 30  HOH HOH A . 
I 6 HOH 391 791 863 HOH HOH A . 
I 6 HOH 392 792 12  HOH HOH A . 
I 6 HOH 393 793 869 HOH HOH A . 
I 6 HOH 394 794 867 HOH HOH A . 
I 6 HOH 395 795 874 HOH HOH A . 
I 6 HOH 396 796 877 HOH HOH A . 
I 6 HOH 397 797 875 HOH HOH A . 
I 6 HOH 398 798 876 HOH HOH A . 
I 6 HOH 399 799 879 HOH HOH A . 
I 6 HOH 400 800 878 HOH HOH A . 
I 6 HOH 401 801 880 HOH HOH A . 
I 6 HOH 402 802 881 HOH HOH A . 
I 6 HOH 403 803 7   HOH HOH A . 
I 6 HOH 404 804 882 HOH HOH A . 
I 6 HOH 405 805 883 HOH HOH A . 
I 6 HOH 406 806 884 HOH HOH A . 
I 6 HOH 407 807 19  HOH HOH A . 
I 6 HOH 408 808 18  HOH HOH A . 
I 6 HOH 409 809 885 HOH HOH A . 
I 6 HOH 410 810 886 HOH HOH A . 
I 6 HOH 411 811 887 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' ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .           2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .           3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? .           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                     9F0U 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     60.190 
_cell.length_a_esd                 ? 
_cell.length_b                     79.110 
_cell.length_b_esd                 ? 
_cell.length_c                     55.910 
_cell.length_c_esd                 ? 
_cell.volume                       266222.784 
_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                         9F0U 
_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                   9F0U 
_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             2.16 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          43.07 
_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            294.15 
# 
_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         2022-07-30 
_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   0.7746 
_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        0.7746 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I03 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate                          14.16 
_reflns.entry_id                                       9F0U 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.11 
_reflns.d_resolution_low                               36.38 
_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                                     105821 
_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                           99.9 
_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                          10.3 
_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                                0.028 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   1.00 
_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                                    1.11 
_reflns_shell.d_res_low                                     1.13 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           0.6 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             5230 
_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                               13.1 
_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                               0.907 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.365 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          99.4 
_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                               21.28 
_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                                 9F0U 
_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                            1.11 
_refine.ls_d_res_low                             32.29 
_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                     105695 
_refine.ls_number_reflns_R_free                  5491 
_refine.ls_number_reflns_R_work                  100204 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.78 
_refine.ls_percent_reflns_R_free                 5.20 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1359 
_refine.ls_R_factor_R_free                       0.1576 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1347 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.34 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'FOURIER SYNTHESIS' 
_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                 18.9685 
_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                            0.1548 
_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                       1.11 
_refine_hist.d_res_low                        32.29 
_refine_hist.number_atoms_solvent             411 
_refine_hist.number_atoms_total               2466 
_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        2016 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         39 
_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' ? 0.0070  ? 2306 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.0005  ? 3170 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0754  ? 349  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0128  ? 424  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 11.6060 ? 848  ? 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' 1.11 1.12  . . 171 3271 98.31  . . . . 0.4254 . . . . . . . . . . . 0.4257 
'X-RAY DIFFRACTION' 1.12 1.14  . . 179 3288 98.97  . . . . 0.3830 . . . . . . . . . . . 0.3987 
'X-RAY DIFFRACTION' 1.14 1.15  . . 206 3252 99.88  . . . . 0.3467 . . . . . . . . . . . 0.3447 
'X-RAY DIFFRACTION' 1.15 1.16  . . 171 3324 99.21  . . . . 0.3205 . . . . . . . . . . . 0.3373 
'X-RAY DIFFRACTION' 1.16 1.18  . . 174 3296 99.54  . . . . 0.2938 . . . . . . . . . . . 0.2968 
'X-RAY DIFFRACTION' 1.18 1.20  . . 171 3302 99.86  . . . . 0.2688 . . . . . . . . . . . 0.2934 
'X-RAY DIFFRACTION' 1.20 1.21  . . 200 3303 99.55  . . . . 0.2608 . . . . . . . . . . . 0.2596 
'X-RAY DIFFRACTION' 1.21 1.23  . . 189 3266 99.65  . . . . 0.2463 . . . . . . . . . . . 0.2489 
'X-RAY DIFFRACTION' 1.23 1.25  . . 177 3313 99.97  . . . . 0.2329 . . . . . . . . . . . 0.2343 
'X-RAY DIFFRACTION' 1.25 1.27  . . 174 3324 99.69  . . . . 0.2184 . . . . . . . . . . . 0.2520 
'X-RAY DIFFRACTION' 1.27 1.29  . . 185 3306 99.77  . . . . 0.1993 . . . . . . . . . . . 0.2140 
'X-RAY DIFFRACTION' 1.29 1.32  . . 175 3307 99.77  . . . . 0.1937 . . . . . . . . . . . 0.2190 
'X-RAY DIFFRACTION' 1.32 1.34  . . 176 3357 99.89  . . . . 0.1798 . . . . . . . . . . . 0.2178 
'X-RAY DIFFRACTION' 1.34 1.37  . . 159 3344 99.91  . . . . 0.1692 . . . . . . . . . . . 0.1982 
'X-RAY DIFFRACTION' 1.37 1.40  . . 172 3335 100.00 . . . . 0.1515 . . . . . . . . . . . 0.1811 
'X-RAY DIFFRACTION' 1.40 1.43  . . 166 3319 99.94  . . . . 0.1412 . . . . . . . . . . . 0.1756 
'X-RAY DIFFRACTION' 1.43 1.47  . . 175 3355 99.97  . . . . 0.1308 . . . . . . . . . . . 0.1781 
'X-RAY DIFFRACTION' 1.47 1.51  . . 216 3284 100.00 . . . . 0.1165 . . . . . . . . . . . 0.1697 
'X-RAY DIFFRACTION' 1.51 1.55  . . 206 3328 99.94  . . . . 0.1066 . . . . . . . . . . . 0.1534 
'X-RAY DIFFRACTION' 1.55 1.60  . . 175 3343 100.00 . . . . 0.1046 . . . . . . . . . . . 0.1304 
'X-RAY DIFFRACTION' 1.60 1.66  . . 168 3345 99.91  . . . . 0.0953 . . . . . . . . . . . 0.1376 
'X-RAY DIFFRACTION' 1.66 1.72  . . 192 3329 99.97  . . . . 0.0961 . . . . . . . . . . . 0.1522 
'X-RAY DIFFRACTION' 1.72 1.80  . . 164 3385 100.00 . . . . 0.1032 . . . . . . . . . . . 0.1353 
'X-RAY DIFFRACTION' 1.80 1.90  . . 170 3380 99.97  . . . . 0.1055 . . . . . . . . . . . 0.1077 
'X-RAY DIFFRACTION' 1.90 2.02  . . 161 3390 99.97  . . . . 0.1064 . . . . . . . . . . . 0.1363 
'X-RAY DIFFRACTION' 2.02 2.17  . . 210 3348 100.00 . . . . 0.1062 . . . . . . . . . . . 0.1380 
'X-RAY DIFFRACTION' 2.17 2.39  . . 202 3359 100.00 . . . . 0.1073 . . . . . . . . . . . 0.1316 
'X-RAY DIFFRACTION' 2.39 2.74  . . 211 3412 100.00 . . . . 0.1089 . . . . . . . . . . . 0.1277 
'X-RAY DIFFRACTION' 2.74 3.45  . . 174 3468 100.00 . . . . 0.1186 . . . . . . . . . . . 0.1411 
'X-RAY DIFFRACTION' 3.45 32.29 . . 222 3571 99.92  . . . . 0.1394 . . . . . . . . . . . 0.1512 
# 
_struct.entry_id                     9F0U 
_struct.title                        'Structure of KPC-2 complexed with benzoxaborole AK-425' 
_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        9F0U 
_struct_keywords.text            'Inhibitor, beta-lactamase, SBL, antibiotic resistance, boronate, 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 3 ? 
E N N 4 ? 
F N N 3 ? 
G N N 3 ? 
H N N 5 ? 
I 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           25 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9F0U 
_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       26 
_struct_ref_seq.pdbx_auth_seq_align_end       294 
# 
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 9F0U MET A 1  ? UNP Q9F663 ? ? 'initiating methionine' 5  1  
1 9F0U GLY A 2  ? UNP Q9F663 ? ? 'expression tag'        6  2  
1 9F0U SER A 3  ? UNP Q9F663 ? ? 'expression tag'        7  3  
1 9F0U SER A 4  ? UNP Q9F663 ? ? 'expression tag'        8  4  
1 9F0U HIS A 5  ? UNP Q9F663 ? ? 'expression tag'        9  5  
1 9F0U HIS A 6  ? UNP Q9F663 ? ? 'expression tag'        10 6  
1 9F0U HIS A 7  ? UNP Q9F663 ? ? 'expression tag'        11 7  
1 9F0U HIS A 8  ? UNP Q9F663 ? ? 'expression tag'        12 8  
1 9F0U HIS A 9  ? UNP Q9F663 ? ? 'expression tag'        13 9  
1 9F0U HIS A 10 ? UNP Q9F663 ? ? 'expression tag'        14 10 
1 9F0U SER A 11 ? UNP Q9F663 ? ? 'expression tag'        15 11 
1 9F0U SER A 12 ? UNP Q9F663 ? ? 'expression tag'        16 12 
1 9F0U GLY A 13 ? UNP Q9F663 ? ? 'expression tag'        17 13 
1 9F0U LEU A 14 ? UNP Q9F663 ? ? 'expression tag'        18 14 
1 9F0U VAL A 15 ? UNP Q9F663 ? ? 'expression tag'        19 15 
1 9F0U PRO A 16 ? UNP Q9F663 ? ? 'expression tag'        20 16 
1 9F0U ARG A 17 ? UNP Q9F663 ? ? 'expression tag'        21 17 
1 9F0U GLY A 18 ? UNP Q9F663 ? ? 'expression tag'        22 18 
1 9F0U SER A 19 ? UNP Q9F663 ? ? 'expression tag'        23 19 
1 9F0U HIS A 20 ? UNP Q9F663 ? ? 'expression tag'        24 20 
1 9F0U MET A 21 ? UNP Q9F663 ? ? 'expression tag'        25 21 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 930   ? 
1 MORE         -52   ? 
1 'SSA (A^2)'  11160 ? 
# 
_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,H,I 
# 
_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 33  GLY A 42  1 ? 10 
HELX_P HELX_P2  AA2 SER A 67  ? GLN A 83  ? SER A 71  GLN A 87  1 ? 17 
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 274 LEU A 289 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 ? ? ? ? ? ? ? 2.041 ? ? 
covale1 covale none ? A SER 66  OG  ? ? ? 1_555 E XR9 .   B2 A ? A SER 70  A XR9 304 1_555 ? ? ? ? ? ? ? 1.443 ? ? 
metalc1 metalc ?    ? A THR 231 OG1 ? ? ? 1_555 H NA  .   NA A ? A THR 235 A NA  307 1_555 ? ? ? ? ? ? ? 2.812 ? ? 
metalc2 metalc ?    ? E XR9 .   O3  A ? ? 1_555 H NA  .   NA A ? A XR9 304 A NA  307 1_555 ? ? ? ? ? ? ? 2.697 ? ? 
metalc3 metalc ?    ? H NA  .   NA  A ? ? 1_555 I HOH .   O  A ? A NA  307 A HOH 427 1_555 ? ? ? ? ? ? ? 2.839 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1 OG1 ? A THR 231 ? A THR 235 ? 1_555 NA A H NA . ? A NA 307 ? 1_555 O3 A E XR9 . ? A XR9 304 ? 1_555 148.0 ? 
2 OG1 ? A THR 231 ? A THR 235 ? 1_555 NA A H NA . ? A NA 307 ? 1_555 O  A I HOH . ? A HOH 427 ? 1_555 89.3  ? 
3 O3  A E XR9 .   ? A XR9 304 ? 1_555 NA A H NA . ? A NA 307 ? 1_555 O  A I HOH . ? A HOH 427 ? 1_555 110.6 ? 
# 
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 XR9 E .  A SER A 66  ? XR9 A 304 ? 1_555 SER A 70  ? 1_555 B2 OG SER 1 XR9 None 'Covalent chemical modification' 
2 CYS A 65 ? CYS A 234 ? CYS A 69  ? 1_555 CYS A 238 ? 1_555 SG SG .   . .   None 'Disulfide bridge'               
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 GLU 162 A . ? GLU 166 A LEU 163 A ? LEU 167 A 1 6.93 
2 GLU 162 A . ? GLU 166 A LEU 163 A ? LEU 167 A 1 7.64 
# 
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 57  TYR A 60  
AA1 2 SER A 40  ? ASP A 47  ? SER A 44  ASP A 51  
AA1 3 ILE A 254 ? ARG A 261 ? ILE A 258 ARG A 265 
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 47  
AA1 2 3 N MET A 46  ? N MET A 50  O VAL A 255 ? O VAL A 259 
AA1 3 4 O ILE A 254 ? O ILE A 258 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                   9F0U 
_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 448 ? ? O A HOH 485 ? ? 1.67 
2  1 O  A HOH 423 ? ? O A HOH 702 ? ? 1.90 
3  1 O  A HOH 693 ? ? O A HOH 709 ? ? 1.97 
4  1 O  A HOH 710 ? ? O A HOH 769 ? ? 2.07 
5  1 O  A HOH 401 ? ? O A HOH 651 ? ? 2.09 
6  1 O  A HOH 688 ? ? O A HOH 766 ? ? 2.10 
7  1 O  A HOH 436 ? ? O A HOH 536 ? ? 2.11 
8  1 O  A HOH 795 ? ? O A HOH 809 ? ? 2.13 
9  1 O  A HOH 496 ? ? O A HOH 536 ? ? 2.14 
10 1 O  A HOH 568 ? ? O A HOH 725 ? ? 2.14 
11 1 OH A TYR 48  ? A O A HOH 401 ? ? 2.16 
12 1 O  A HOH 498 ? ? O A HOH 536 ? ? 2.19 
13 1 O  A HOH 682 ? ? O A HOH 762 ? ? 2.19 
# 
_pdbx_validate_symm_contact.id                1 
_pdbx_validate_symm_contact.PDB_model_num     1 
_pdbx_validate_symm_contact.auth_atom_id_1    O 
_pdbx_validate_symm_contact.auth_asym_id_1    A 
_pdbx_validate_symm_contact.auth_comp_id_1    HOH 
_pdbx_validate_symm_contact.auth_seq_id_1     417 
_pdbx_validate_symm_contact.PDB_ins_code_1    ? 
_pdbx_validate_symm_contact.label_alt_id_1    ? 
_pdbx_validate_symm_contact.site_symmetry_1   1_555 
_pdbx_validate_symm_contact.auth_atom_id_2    O 
_pdbx_validate_symm_contact.auth_asym_id_2    A 
_pdbx_validate_symm_contact.auth_comp_id_2    HOH 
_pdbx_validate_symm_contact.auth_seq_id_2     531 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   4_556 
_pdbx_validate_symm_contact.dist              2.12 
# 
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  ? ? 51.94   -144.02 
2 1 TRP A 105 ? ? 62.92   65.96   
3 1 ARG A 220 ? ? -113.28 -125.31 
# 
_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            0.089 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     505 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   I 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z           
2 x+1/2,-y+1/2,-z 
3 -x+1/2,y+1/2,-z 
4 -x,-y,z         
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 808 ? 5.94 .    
2 1 O ? A HOH 809 ? 6.09 .    
3 1 O ? A HOH 810 ? .    6.13 
4 1 O ? A HOH 811 ? 7.29 .    
# 
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 5   ? A MET 1   
2  1 Y 1 A GLY 6   ? A GLY 2   
3  1 Y 1 A SER 7   ? A SER 3   
4  1 Y 1 A SER 8   ? A SER 4   
5  1 Y 1 A HIS 9   ? A HIS 5   
6  1 Y 1 A HIS 10  ? A HIS 6   
7  1 Y 1 A HIS 11  ? A HIS 7   
8  1 Y 1 A HIS 12  ? A HIS 8   
9  1 Y 1 A HIS 13  ? A HIS 9   
10 1 Y 1 A HIS 14  ? A HIS 10  
11 1 Y 1 A SER 15  ? A SER 11  
12 1 Y 1 A SER 16  ? A SER 12  
13 1 Y 1 A GLY 17  ? A GLY 13  
14 1 Y 1 A LEU 18  ? A LEU 14  
15 1 Y 1 A VAL 19  ? A VAL 15  
16 1 Y 1 A PRO 20  ? A PRO 16  
17 1 Y 1 A ARG 21  ? A ARG 17  
18 1 Y 1 A GLY 22  ? A GLY 18  
19 1 Y 1 A SER 23  ? A SER 19  
20 1 Y 1 A GLN 294 ? 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 
ALA N    N  N N 1   
ALA CA   C  N S 2   
ALA C    C  N N 3   
ALA O    O  N N 4   
ALA CB   C  N N 5   
ALA OXT  O  N N 6   
ALA H    H  N N 7   
ALA H2   H  N N 8   
ALA HA   H  N N 9   
ALA HB1  H  N N 10  
ALA HB2  H  N N 11  
ALA HB3  H  N N 12  
ALA HXT  H  N N 13  
ARG N    N  N N 14  
ARG CA   C  N S 15  
ARG C    C  N N 16  
ARG O    O  N N 17  
ARG CB   C  N N 18  
ARG CG   C  N N 19  
ARG CD   C  N N 20  
ARG NE   N  N N 21  
ARG CZ   C  N N 22  
ARG NH1  N  N N 23  
ARG NH2  N  N N 24  
ARG OXT  O  N N 25  
ARG H    H  N N 26  
ARG H2   H  N N 27  
ARG HA   H  N N 28  
ARG HB2  H  N N 29  
ARG HB3  H  N N 30  
ARG HG2  H  N N 31  
ARG HG3  H  N N 32  
ARG HD2  H  N N 33  
ARG HD3  H  N N 34  
ARG HE   H  N N 35  
ARG HH11 H  N N 36  
ARG HH12 H  N N 37  
ARG HH21 H  N N 38  
ARG HH22 H  N N 39  
ARG HXT  H  N N 40  
ASN N    N  N N 41  
ASN CA   C  N S 42  
ASN C    C  N N 43  
ASN O    O  N N 44  
ASN CB   C  N N 45  
ASN CG   C  N N 46  
ASN OD1  O  N N 47  
ASN ND2  N  N N 48  
ASN OXT  O  N N 49  
ASN H    H  N N 50  
ASN H2   H  N N 51  
ASN HA   H  N N 52  
ASN HB2  H  N N 53  
ASN HB3  H  N N 54  
ASN HD21 H  N N 55  
ASN HD22 H  N N 56  
ASN HXT  H  N N 57  
ASP N    N  N N 58  
ASP CA   C  N S 59  
ASP C    C  N N 60  
ASP O    O  N N 61  
ASP CB   C  N N 62  
ASP CG   C  N N 63  
ASP OD1  O  N N 64  
ASP OD2  O  N N 65  
ASP OXT  O  N N 66  
ASP H    H  N N 67  
ASP H2   H  N N 68  
ASP HA   H  N N 69  
ASP HB2  H  N N 70  
ASP HB3  H  N N 71  
ASP HD2  H  N N 72  
ASP HXT  H  N N 73  
CYS N    N  N N 74  
CYS CA   C  N R 75  
CYS C    C  N N 76  
CYS O    O  N N 77  
CYS CB   C  N N 78  
CYS SG   S  N N 79  
CYS OXT  O  N N 80  
CYS H    H  N N 81  
CYS H2   H  N N 82  
CYS HA   H  N N 83  
CYS HB2  H  N N 84  
CYS HB3  H  N N 85  
CYS HG   H  N N 86  
CYS HXT  H  N N 87  
GLN N    N  N N 88  
GLN CA   C  N S 89  
GLN C    C  N N 90  
GLN O    O  N N 91  
GLN CB   C  N N 92  
GLN CG   C  N N 93  
GLN CD   C  N N 94  
GLN OE1  O  N N 95  
GLN NE2  N  N N 96  
GLN OXT  O  N N 97  
GLN H    H  N N 98  
GLN H2   H  N N 99  
GLN HA   H  N N 100 
GLN HB2  H  N N 101 
GLN HB3  H  N N 102 
GLN HG2  H  N N 103 
GLN HG3  H  N N 104 
GLN HE21 H  N N 105 
GLN HE22 H  N N 106 
GLN HXT  H  N N 107 
GLU N    N  N N 108 
GLU CA   C  N S 109 
GLU C    C  N N 110 
GLU O    O  N N 111 
GLU CB   C  N N 112 
GLU CG   C  N N 113 
GLU CD   C  N N 114 
GLU OE1  O  N N 115 
GLU OE2  O  N N 116 
GLU OXT  O  N N 117 
GLU H    H  N N 118 
GLU H2   H  N N 119 
GLU HA   H  N N 120 
GLU HB2  H  N N 121 
GLU HB3  H  N N 122 
GLU HG2  H  N N 123 
GLU HG3  H  N N 124 
GLU HE2  H  N N 125 
GLU HXT  H  N N 126 
GLY N    N  N N 127 
GLY CA   C  N N 128 
GLY C    C  N N 129 
GLY O    O  N N 130 
GLY OXT  O  N N 131 
GLY H    H  N N 132 
GLY H2   H  N N 133 
GLY HA2  H  N N 134 
GLY HA3  H  N N 135 
GLY HXT  H  N N 136 
GOL C1   C  N N 137 
GOL O1   O  N N 138 
GOL C2   C  N N 139 
GOL O2   O  N N 140 
GOL C3   C  N N 141 
GOL O3   O  N N 142 
GOL H11  H  N N 143 
GOL H12  H  N N 144 
GOL HO1  H  N N 145 
GOL H2   H  N N 146 
GOL HO2  H  N N 147 
GOL H31  H  N N 148 
GOL H32  H  N N 149 
GOL HO3  H  N N 150 
HIS N    N  N N 151 
HIS CA   C  N S 152 
HIS C    C  N N 153 
HIS O    O  N N 154 
HIS CB   C  N N 155 
HIS CG   C  Y N 156 
HIS ND1  N  Y N 157 
HIS CD2  C  Y N 158 
HIS CE1  C  Y N 159 
HIS NE2  N  Y N 160 
HIS OXT  O  N N 161 
HIS H    H  N N 162 
HIS H2   H  N N 163 
HIS HA   H  N N 164 
HIS HB2  H  N N 165 
HIS HB3  H  N N 166 
HIS HD1  H  N N 167 
HIS HD2  H  N N 168 
HIS HE1  H  N N 169 
HIS HE2  H  N N 170 
HIS HXT  H  N N 171 
HOH O    O  N N 172 
HOH H1   H  N N 173 
HOH H2   H  N N 174 
ILE N    N  N N 175 
ILE CA   C  N S 176 
ILE C    C  N N 177 
ILE O    O  N N 178 
ILE CB   C  N S 179 
ILE CG1  C  N N 180 
ILE CG2  C  N N 181 
ILE CD1  C  N N 182 
ILE OXT  O  N N 183 
ILE H    H  N N 184 
ILE H2   H  N N 185 
ILE HA   H  N N 186 
ILE HB   H  N N 187 
ILE HG12 H  N N 188 
ILE HG13 H  N N 189 
ILE HG21 H  N N 190 
ILE HG22 H  N N 191 
ILE HG23 H  N N 192 
ILE HD11 H  N N 193 
ILE HD12 H  N N 194 
ILE HD13 H  N N 195 
ILE HXT  H  N N 196 
LEU N    N  N N 197 
LEU CA   C  N S 198 
LEU C    C  N N 199 
LEU O    O  N N 200 
LEU CB   C  N N 201 
LEU CG   C  N N 202 
LEU CD1  C  N N 203 
LEU CD2  C  N N 204 
LEU OXT  O  N N 205 
LEU H    H  N N 206 
LEU H2   H  N N 207 
LEU HA   H  N N 208 
LEU HB2  H  N N 209 
LEU HB3  H  N N 210 
LEU HG   H  N N 211 
LEU HD11 H  N N 212 
LEU HD12 H  N N 213 
LEU HD13 H  N N 214 
LEU HD21 H  N N 215 
LEU HD22 H  N N 216 
LEU HD23 H  N N 217 
LEU HXT  H  N N 218 
LYS N    N  N N 219 
LYS CA   C  N S 220 
LYS C    C  N N 221 
LYS O    O  N N 222 
LYS CB   C  N N 223 
LYS CG   C  N N 224 
LYS CD   C  N N 225 
LYS CE   C  N N 226 
LYS NZ   N  N N 227 
LYS OXT  O  N N 228 
LYS H    H  N N 229 
LYS H2   H  N N 230 
LYS HA   H  N N 231 
LYS HB2  H  N N 232 
LYS HB3  H  N N 233 
LYS HG2  H  N N 234 
LYS HG3  H  N N 235 
LYS HD2  H  N N 236 
LYS HD3  H  N N 237 
LYS HE2  H  N N 238 
LYS HE3  H  N N 239 
LYS HZ1  H  N N 240 
LYS HZ2  H  N N 241 
LYS HZ3  H  N N 242 
LYS HXT  H  N N 243 
MET N    N  N N 244 
MET CA   C  N S 245 
MET C    C  N N 246 
MET O    O  N N 247 
MET CB   C  N N 248 
MET CG   C  N N 249 
MET SD   S  N N 250 
MET CE   C  N N 251 
MET OXT  O  N N 252 
MET H    H  N N 253 
MET H2   H  N N 254 
MET HA   H  N N 255 
MET HB2  H  N N 256 
MET HB3  H  N N 257 
MET HG2  H  N N 258 
MET HG3  H  N N 259 
MET HE1  H  N N 260 
MET HE2  H  N N 261 
MET HE3  H  N N 262 
MET HXT  H  N N 263 
NA  NA   NA N N 264 
PHE N    N  N N 265 
PHE CA   C  N S 266 
PHE C    C  N N 267 
PHE O    O  N N 268 
PHE CB   C  N N 269 
PHE CG   C  Y N 270 
PHE CD1  C  Y N 271 
PHE CD2  C  Y N 272 
PHE CE1  C  Y N 273 
PHE CE2  C  Y N 274 
PHE CZ   C  Y N 275 
PHE OXT  O  N N 276 
PHE H    H  N N 277 
PHE H2   H  N N 278 
PHE HA   H  N N 279 
PHE HB2  H  N N 280 
PHE HB3  H  N N 281 
PHE HD1  H  N N 282 
PHE HD2  H  N N 283 
PHE HE1  H  N N 284 
PHE HE2  H  N N 285 
PHE HZ   H  N N 286 
PHE HXT  H  N N 287 
PRO N    N  N N 288 
PRO CA   C  N S 289 
PRO C    C  N N 290 
PRO O    O  N N 291 
PRO CB   C  N N 292 
PRO CG   C  N N 293 
PRO CD   C  N N 294 
PRO OXT  O  N N 295 
PRO H    H  N N 296 
PRO HA   H  N N 297 
PRO HB2  H  N N 298 
PRO HB3  H  N N 299 
PRO HG2  H  N N 300 
PRO HG3  H  N N 301 
PRO HD2  H  N N 302 
PRO HD3  H  N N 303 
PRO HXT  H  N N 304 
SER N    N  N N 305 
SER CA   C  N S 306 
SER C    C  N N 307 
SER O    O  N N 308 
SER CB   C  N N 309 
SER OG   O  N N 310 
SER OXT  O  N N 311 
SER H    H  N N 312 
SER H2   H  N N 313 
SER HA   H  N N 314 
SER HB2  H  N N 315 
SER HB3  H  N N 316 
SER HG   H  N N 317 
SER HXT  H  N N 318 
SO4 S    S  N N 319 
SO4 O1   O  N N 320 
SO4 O2   O  N N 321 
SO4 O3   O  N N 322 
SO4 O4   O  N N 323 
THR N    N  N N 324 
THR CA   C  N S 325 
THR C    C  N N 326 
THR O    O  N N 327 
THR CB   C  N R 328 
THR OG1  O  N N 329 
THR CG2  C  N N 330 
THR OXT  O  N N 331 
THR H    H  N N 332 
THR H2   H  N N 333 
THR HA   H  N N 334 
THR HB   H  N N 335 
THR HG1  H  N N 336 
THR HG21 H  N N 337 
THR HG22 H  N N 338 
THR HG23 H  N N 339 
THR HXT  H  N N 340 
TRP N    N  N N 341 
TRP CA   C  N S 342 
TRP C    C  N N 343 
TRP O    O  N N 344 
TRP CB   C  N N 345 
TRP CG   C  Y N 346 
TRP CD1  C  Y N 347 
TRP CD2  C  Y N 348 
TRP NE1  N  Y N 349 
TRP CE2  C  Y N 350 
TRP CE3  C  Y N 351 
TRP CZ2  C  Y N 352 
TRP CZ3  C  Y N 353 
TRP CH2  C  Y N 354 
TRP OXT  O  N N 355 
TRP H    H  N N 356 
TRP H2   H  N N 357 
TRP HA   H  N N 358 
TRP HB2  H  N N 359 
TRP HB3  H  N N 360 
TRP HD1  H  N N 361 
TRP HE1  H  N N 362 
TRP HE3  H  N N 363 
TRP HZ2  H  N N 364 
TRP HZ3  H  N N 365 
TRP HH2  H  N N 366 
TRP HXT  H  N N 367 
TYR N    N  N N 368 
TYR CA   C  N S 369 
TYR C    C  N N 370 
TYR O    O  N N 371 
TYR CB   C  N N 372 
TYR CG   C  Y N 373 
TYR CD1  C  Y N 374 
TYR CD2  C  Y N 375 
TYR CE1  C  Y N 376 
TYR CE2  C  Y N 377 
TYR CZ   C  Y N 378 
TYR OH   O  N N 379 
TYR OXT  O  N N 380 
TYR H    H  N N 381 
TYR H2   H  N N 382 
TYR HA   H  N N 383 
TYR HB2  H  N N 384 
TYR HB3  H  N N 385 
TYR HD1  H  N N 386 
TYR HD2  H  N N 387 
TYR HE1  H  N N 388 
TYR HE2  H  N N 389 
TYR HH   H  N N 390 
TYR HXT  H  N N 391 
VAL N    N  N N 392 
VAL CA   C  N S 393 
VAL C    C  N N 394 
VAL O    O  N N 395 
VAL CB   C  N N 396 
VAL CG1  C  N N 397 
VAL CG2  C  N N 398 
VAL OXT  O  N N 399 
VAL H    H  N N 400 
VAL H2   H  N N 401 
VAL HA   H  N N 402 
VAL HB   H  N N 403 
VAL HG11 H  N N 404 
VAL HG12 H  N N 405 
VAL HG13 H  N N 406 
VAL HG21 H  N N 407 
VAL HG22 H  N N 408 
VAL HG23 H  N N 409 
VAL HXT  H  N N 410 
XR9 C12  C  Y N 411 
XR9 C11  C  Y N 412 
XR9 C9   C  Y N 413 
XR9 C7   C  Y N 414 
XR9 C4   C  N S 415 
XR9 N6   N  N N 416 
XR9 B2   B  N N 417 
XR9 C10  C  Y N 418 
XR9 C5   C  N N 419 
XR9 C8   C  Y N 420 
XR9 O1   O  N N 421 
XR9 O3   O  N N 422 
XR9 H11  H  N N 423 
XR9 H9   H  N N 424 
XR9 H4   H  N N 425 
XR9 H10  H  N N 426 
XR9 H8   H  N N 427 
XR9 H1   H  N N 428 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
GOL C1  O1   sing N N 129 
GOL C1  C2   sing N N 130 
GOL C1  H11  sing N N 131 
GOL C1  H12  sing N N 132 
GOL O1  HO1  sing N N 133 
GOL C2  O2   sing N N 134 
GOL C2  C3   sing N N 135 
GOL C2  H2   sing N N 136 
GOL O2  HO2  sing N N 137 
GOL C3  O3   sing N N 138 
GOL C3  H31  sing N N 139 
GOL C3  H32  sing N N 140 
GOL O3  HO3  sing N N 141 
HIS N   CA   sing N N 142 
HIS N   H    sing N N 143 
HIS N   H2   sing N N 144 
HIS CA  C    sing N N 145 
HIS CA  CB   sing N N 146 
HIS CA  HA   sing N N 147 
HIS C   O    doub N N 148 
HIS C   OXT  sing N N 149 
HIS CB  CG   sing N N 150 
HIS CB  HB2  sing N N 151 
HIS CB  HB3  sing N N 152 
HIS CG  ND1  sing Y N 153 
HIS CG  CD2  doub Y N 154 
HIS ND1 CE1  doub Y N 155 
HIS ND1 HD1  sing N N 156 
HIS CD2 NE2  sing Y N 157 
HIS CD2 HD2  sing N N 158 
HIS CE1 NE2  sing Y N 159 
HIS CE1 HE1  sing N N 160 
HIS NE2 HE2  sing N N 161 
HIS OXT HXT  sing N N 162 
HOH O   H1   sing N N 163 
HOH O   H2   sing N N 164 
ILE N   CA   sing N N 165 
ILE N   H    sing N N 166 
ILE N   H2   sing N N 167 
ILE CA  C    sing N N 168 
ILE CA  CB   sing N N 169 
ILE CA  HA   sing N N 170 
ILE C   O    doub N N 171 
ILE C   OXT  sing N N 172 
ILE CB  CG1  sing N N 173 
ILE CB  CG2  sing N N 174 
ILE CB  HB   sing N N 175 
ILE CG1 CD1  sing N N 176 
ILE CG1 HG12 sing N N 177 
ILE CG1 HG13 sing N N 178 
ILE CG2 HG21 sing N N 179 
ILE CG2 HG22 sing N N 180 
ILE CG2 HG23 sing N N 181 
ILE CD1 HD11 sing N N 182 
ILE CD1 HD12 sing N N 183 
ILE CD1 HD13 sing N N 184 
ILE OXT HXT  sing N N 185 
LEU N   CA   sing N N 186 
LEU N   H    sing N N 187 
LEU N   H2   sing N N 188 
LEU CA  C    sing N N 189 
LEU CA  CB   sing N N 190 
LEU CA  HA   sing N N 191 
LEU C   O    doub N N 192 
LEU C   OXT  sing N N 193 
LEU CB  CG   sing N N 194 
LEU CB  HB2  sing N N 195 
LEU CB  HB3  sing N N 196 
LEU CG  CD1  sing N N 197 
LEU CG  CD2  sing N N 198 
LEU CG  HG   sing N N 199 
LEU CD1 HD11 sing N N 200 
LEU CD1 HD12 sing N N 201 
LEU CD1 HD13 sing N N 202 
LEU CD2 HD21 sing N N 203 
LEU CD2 HD22 sing N N 204 
LEU CD2 HD23 sing N N 205 
LEU OXT HXT  sing N N 206 
LYS N   CA   sing N N 207 
LYS N   H    sing N N 208 
LYS N   H2   sing N N 209 
LYS CA  C    sing N N 210 
LYS CA  CB   sing N N 211 
LYS CA  HA   sing N N 212 
LYS C   O    doub N N 213 
LYS C   OXT  sing N N 214 
LYS CB  CG   sing N N 215 
LYS CB  HB2  sing N N 216 
LYS CB  HB3  sing N N 217 
LYS CG  CD   sing N N 218 
LYS CG  HG2  sing N N 219 
LYS CG  HG3  sing N N 220 
LYS CD  CE   sing N N 221 
LYS CD  HD2  sing N N 222 
LYS CD  HD3  sing N N 223 
LYS CE  NZ   sing N N 224 
LYS CE  HE2  sing N N 225 
LYS CE  HE3  sing N N 226 
LYS NZ  HZ1  sing N N 227 
LYS NZ  HZ2  sing N N 228 
LYS NZ  HZ3  sing N N 229 
LYS OXT HXT  sing N N 230 
MET N   CA   sing N N 231 
MET N   H    sing N N 232 
MET N   H2   sing N N 233 
MET CA  C    sing N N 234 
MET CA  CB   sing N N 235 
MET CA  HA   sing N N 236 
MET C   O    doub N N 237 
MET C   OXT  sing N N 238 
MET CB  CG   sing N N 239 
MET CB  HB2  sing N N 240 
MET CB  HB3  sing N N 241 
MET CG  SD   sing N N 242 
MET CG  HG2  sing N N 243 
MET CG  HG3  sing N N 244 
MET SD  CE   sing N N 245 
MET CE  HE1  sing N N 246 
MET CE  HE2  sing N N 247 
MET CE  HE3  sing N N 248 
MET OXT HXT  sing N N 249 
PHE N   CA   sing N N 250 
PHE N   H    sing N N 251 
PHE N   H2   sing N N 252 
PHE CA  C    sing N N 253 
PHE CA  CB   sing N N 254 
PHE CA  HA   sing N N 255 
PHE C   O    doub N N 256 
PHE C   OXT  sing N N 257 
PHE CB  CG   sing N N 258 
PHE CB  HB2  sing N N 259 
PHE CB  HB3  sing N N 260 
PHE CG  CD1  doub Y N 261 
PHE CG  CD2  sing Y N 262 
PHE CD1 CE1  sing Y N 263 
PHE CD1 HD1  sing N N 264 
PHE CD2 CE2  doub Y N 265 
PHE CD2 HD2  sing N N 266 
PHE CE1 CZ   doub Y N 267 
PHE CE1 HE1  sing N N 268 
PHE CE2 CZ   sing Y N 269 
PHE CE2 HE2  sing N N 270 
PHE CZ  HZ   sing N N 271 
PHE OXT HXT  sing N N 272 
PRO N   CA   sing N N 273 
PRO N   CD   sing N N 274 
PRO N   H    sing N N 275 
PRO CA  C    sing N N 276 
PRO CA  CB   sing N N 277 
PRO CA  HA   sing N N 278 
PRO C   O    doub N N 279 
PRO C   OXT  sing N N 280 
PRO CB  CG   sing N N 281 
PRO CB  HB2  sing N N 282 
PRO CB  HB3  sing N N 283 
PRO CG  CD   sing N N 284 
PRO CG  HG2  sing N N 285 
PRO CG  HG3  sing N N 286 
PRO CD  HD2  sing N N 287 
PRO CD  HD3  sing N N 288 
PRO OXT HXT  sing N N 289 
SER N   CA   sing N N 290 
SER N   H    sing N N 291 
SER N   H2   sing N N 292 
SER CA  C    sing N N 293 
SER CA  CB   sing N N 294 
SER CA  HA   sing N N 295 
SER C   O    doub N N 296 
SER C   OXT  sing N N 297 
SER CB  OG   sing N N 298 
SER CB  HB2  sing N N 299 
SER CB  HB3  sing N N 300 
SER OG  HG   sing N N 301 
SER OXT HXT  sing N N 302 
SO4 S   O1   doub N N 303 
SO4 S   O2   doub N N 304 
SO4 S   O3   sing N N 305 
SO4 S   O4   sing N N 306 
THR N   CA   sing N N 307 
THR N   H    sing N N 308 
THR N   H2   sing N N 309 
THR CA  C    sing N N 310 
THR CA  CB   sing N N 311 
THR CA  HA   sing N N 312 
THR C   O    doub N N 313 
THR C   OXT  sing N N 314 
THR CB  OG1  sing N N 315 
THR CB  CG2  sing N N 316 
THR CB  HB   sing N N 317 
THR OG1 HG1  sing N N 318 
THR CG2 HG21 sing N N 319 
THR CG2 HG22 sing N N 320 
THR CG2 HG23 sing N N 321 
THR OXT HXT  sing N N 322 
TRP N   CA   sing N N 323 
TRP N   H    sing N N 324 
TRP N   H2   sing N N 325 
TRP CA  C    sing N N 326 
TRP CA  CB   sing N N 327 
TRP CA  HA   sing N N 328 
TRP C   O    doub N N 329 
TRP C   OXT  sing N N 330 
TRP CB  CG   sing N N 331 
TRP CB  HB2  sing N N 332 
TRP CB  HB3  sing N N 333 
TRP CG  CD1  doub Y N 334 
TRP CG  CD2  sing Y N 335 
TRP CD1 NE1  sing Y N 336 
TRP CD1 HD1  sing N N 337 
TRP CD2 CE2  doub Y N 338 
TRP CD2 CE3  sing Y N 339 
TRP NE1 CE2  sing Y N 340 
TRP NE1 HE1  sing N N 341 
TRP CE2 CZ2  sing Y N 342 
TRP CE3 CZ3  doub Y N 343 
TRP CE3 HE3  sing N N 344 
TRP CZ2 CH2  doub Y N 345 
TRP CZ2 HZ2  sing N N 346 
TRP CZ3 CH2  sing Y N 347 
TRP CZ3 HZ3  sing N N 348 
TRP CH2 HH2  sing N N 349 
TRP OXT HXT  sing N N 350 
TYR N   CA   sing N N 351 
TYR N   H    sing N N 352 
TYR N   H2   sing N N 353 
TYR CA  C    sing N N 354 
TYR CA  CB   sing N N 355 
TYR CA  HA   sing N N 356 
TYR C   O    doub N N 357 
TYR C   OXT  sing N N 358 
TYR CB  CG   sing N N 359 
TYR CB  HB2  sing N N 360 
TYR CB  HB3  sing N N 361 
TYR CG  CD1  doub Y N 362 
TYR CG  CD2  sing Y N 363 
TYR CD1 CE1  sing Y N 364 
TYR CD1 HD1  sing N N 365 
TYR CD2 CE2  doub Y N 366 
TYR CD2 HD2  sing N N 367 
TYR CE1 CZ   doub Y N 368 
TYR CE1 HE1  sing N N 369 
TYR CE2 CZ   sing Y N 370 
TYR CE2 HE2  sing N N 371 
TYR CZ  OH   sing N N 372 
TYR OH  HH   sing N N 373 
TYR OXT HXT  sing N N 374 
VAL N   CA   sing N N 375 
VAL N   H    sing N N 376 
VAL N   H2   sing N N 377 
VAL CA  C    sing N N 378 
VAL CA  CB   sing N N 379 
VAL CA  HA   sing N N 380 
VAL C   O    doub N N 381 
VAL C   OXT  sing N N 382 
VAL CB  CG1  sing N N 383 
VAL CB  CG2  sing N N 384 
VAL CB  HB   sing N N 385 
VAL CG1 HG11 sing N N 386 
VAL CG1 HG12 sing N N 387 
VAL CG1 HG13 sing N N 388 
VAL CG2 HG21 sing N N 389 
VAL CG2 HG22 sing N N 390 
VAL CG2 HG23 sing N N 391 
VAL OXT HXT  sing N N 392 
XR9 O1  B2   sing N N 393 
XR9 B2  O3   sing N N 394 
XR9 O3  C4   sing N N 395 
XR9 C4  C5   sing N N 396 
XR9 C5  N6   trip N N 397 
XR9 C4  C7   sing N N 398 
XR9 C7  C8   doub Y N 399 
XR9 C8  C9   sing Y N 400 
XR9 C9  C10  doub Y N 401 
XR9 C10 C11  sing Y N 402 
XR9 C11 C12  doub Y N 403 
XR9 C12 B2   sing N N 404 
XR9 C12 C7   sing Y N 405 
XR9 C11 H11  sing N N 406 
XR9 C9  H9   sing N N 407 
XR9 C4  H4   sing N N 408 
XR9 C10 H10  sing N N 409 
XR9 C8  H8   sing N N 410 
XR9 O1  H1   sing N N 411 
# 
_pdbx_audit_support.funding_organization   'Medical Research Council (MRC, United Kingdom)' 
_pdbx_audit_support.country                'United Kingdom' 
_pdbx_audit_support.grant_number           MR/T016035/1 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   6qw9 
_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                    9F0U 
_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]   0.016614 
_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]   0.012641 
_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]   0.017886 
_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 
B   ? ? 2.40390 1.74082 0.84097 ? 40.64930 0.64934  12.24639 ? 0.0 
;3-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
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.
;
? 
NA  ? ? 6.63511 3.01293 1.30238 ? 5.54423  0.54580  90.85902 ? 0.0 
;3-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  ? 3.87300  26.84200  -6.65800  1.000 47.95575 ?  24  HIS A N    1 
ATOM   2    C  CA   . HIS A 1 20  ? 3.83700  25.56400  -7.35600  1.000 47.76889 ?  24  HIS A CA   1 
ATOM   3    C  C    . HIS A 1 20  ? 4.89600  25.50800  -8.44500  1.000 45.26595 ?  24  HIS A C    1 
ATOM   4    O  O    . HIS A 1 20  ? 5.53100  24.47300  -8.65900  1.000 44.43427 ?  24  HIS A O    1 
ATOM   5    C  CB   . HIS A 1 20  ? 2.47900  25.35200  -8.03100  1.000 49.30328 ?  24  HIS A CB   1 
ATOM   6    C  CG   . HIS A 1 20  ? 1.37500  25.01900  -7.08800  1.000 50.60344 ?  24  HIS A CG   1 
ATOM   7    N  ND1  . HIS A 1 20  ? 0.32900  24.18600  -7.42400  1.000 51.12981 ?  24  HIS A ND1  1 
ATOM   8    C  CD2  . HIS A 1 20  ? 1.14500  25.41700  -5.82000  1.000 51.11402 ?  24  HIS A CD2  1 
ATOM   9    C  CE1  . HIS A 1 20  ? -0.49400 24.07800  -6.39600  1.000 51.35616 ?  24  HIS A CE1  1 
ATOM   10   N  NE2  . HIS A 1 20  ? -0.01500 24.80700  -5.40400  1.000 51.12455 ?  24  HIS A NE2  1 
ATOM   11   H  HA   . HIS A 1 20  ? 3.99200  24.86300  -6.70400  1.000 57.32000 ?  24  HIS A HA   1 
ATOM   12   H  HB2  . HIS A 1 20  ? 2.23300  26.16800  -8.49500  1.000 59.16000 ?  24  HIS A HB2  1 
ATOM   13   H  HB3  . HIS A 1 20  ? 2.55700  24.62100  -8.66300  1.000 59.16000 ?  24  HIS A HB3  1 
ATOM   14   H  HD2  . HIS A 1 20  ? 1.67300  25.99700  -5.32100  1.000 61.33000 ?  24  HIS A HD2  1 
ATOM   15   H  HE1  . HIS A 1 20  ? -1.27500 23.57500  -6.37500  1.000 61.62000 ?  24  HIS A HE1  1 
ATOM   16   H  HE2  . HIS A 1 20  ? -0.37000 24.88600  -4.62500  1.000 61.35000 ?  24  HIS A HE2  1 
ATOM   17   N  N    . MET A 1 21  ? 5.03900  26.63600  -9.14300  1.000 43.56049 ?  25  MET A N    1 
ATOM   18   C  CA   . MET A 1 21  ? 5.93100  26.72300  -10.29400 1.000 42.80776 ?  25  MET A CA   1 
ATOM   19   C  C    . MET A 1 21  ? 7.35700  26.32000  -9.95200  1.000 38.07825 ?  25  MET A C    1 
ATOM   20   O  O    . MET A 1 21  ? 8.08300  25.83000  -10.82500 1.000 38.75201 ?  25  MET A O    1 
ATOM   21   C  CB   . MET A 1 21  ? 5.89200  28.15900  -10.82700 1.000 47.05827 ?  25  MET A CB   1 
ATOM   22   C  CG   . MET A 1 21  ? 6.88900  28.48700  -11.92300 1.000 50.98769 ?  25  MET A CG   1 
ATOM   23   S  SD   . MET A 1 21  ? 6.78100  30.22800  -12.42400 1.000 54.30914 ?  25  MET A SD   1 
ATOM   24   C  CE   . MET A 1 21  ? 7.26400  31.05800  -10.90500 1.000 54.56970 ?  25  MET A CE   1 
ATOM   25   H  H    . MET A 1 21  ? 4.62800  27.37100  -8.96800  1.000 52.27000 ?  25  MET A H    1 
ATOM   26   H  HA   . MET A 1 21  ? 5.61700  26.12000  -10.98600 1.000 51.36000 ?  25  MET A HA   1 
ATOM   27   H  HB2  . MET A 1 21  ? 5.00600  28.32600  -11.18600 1.000 56.47000 ?  25  MET A HB2  1 
ATOM   28   H  HB3  . MET A 1 21  ? 6.06900  28.76200  -10.08800 1.000 56.47000 ?  25  MET A HB3  1 
ATOM   29   H  HG2  . MET A 1 21  ? 7.78800  28.31800  -11.59900 1.000 61.18000 ?  25  MET A HG2  1 
ATOM   30   H  HG3  . MET A 1 21  ? 6.70600  27.93500  -12.69900 1.000 61.18000 ?  25  MET A HG3  1 
ATOM   31   H  HE1  . MET A 1 21  ? 7.42700  31.99500  -11.09500 1.000 65.48000 ?  25  MET A HE1  1 
ATOM   32   H  HE2  . MET A 1 21  ? 6.54800  30.97200  -10.25600 1.000 65.48000 ?  25  MET A HE2  1 
ATOM   33   H  HE3  . MET A 1 21  ? 8.07200  30.64500  -10.56300 1.000 65.48000 ?  25  MET A HE3  1 
ATOM   34   N  N    . LEU A 1 22  ? 7.77900  26.51300  -8.70500  1.000 33.22504 ?  26  LEU A N    1 
ATOM   35   C  CA   . LEU A 1 22  ? 9.14800  26.21100  -8.30800  1.000 29.09296 ?  26  LEU A CA   1 
ATOM   36   C  C    . LEU A 1 22  ? 9.24500  24.96200  -7.44800  1.000 25.24776 ?  26  LEU A C    1 
ATOM   37   O  O    . LEU A 1 22  ? 10.31800 24.68500  -6.89500  1.000 23.61599 ?  26  LEU A O    1 
ATOM   38   C  CB   . LEU A 1 22  ? 9.74200  27.40600  -7.57300  1.000 29.98517 ?  26  LEU A CB   1 
ATOM   39   C  CG   . LEU A 1 22  ? 9.84700  28.70800  -8.35400  1.000 31.12478 ?  26  LEU A CG   1 
ATOM   40   C  CD1  . LEU A 1 22  ? 10.38100 29.77900  -7.42000  1.000 32.06963 ?  26  LEU A CD1  1 
ATOM   41   C  CD2  . LEU A 1 22  ? 10.72900 28.55200  -9.58500  1.000 31.86171 ?  26  LEU A CD2  1 
ATOM   42   H  H    . LEU A 1 22  ? 7.28700  26.81900  -8.06900  1.000 39.87000 ?  26  LEU A H    1 
ATOM   43   H  HA   . LEU A 1 22  ? 9.67700  26.05200  -9.10600  1.000 34.91000 ?  26  LEU A HA   1 
ATOM   44   H  HB2  . LEU A 1 22  ? 9.18900  27.58500  -6.79700  1.000 35.98000 ?  26  LEU A HB2  1 
ATOM   45   H  HB3  . LEU A 1 22  ? 10.64000 27.17000  -7.29400  1.000 35.98000 ?  26  LEU A HB3  1 
ATOM   46   H  HG   . LEU A 1 22  ? 8.97400  28.97300  -8.68400  1.000 37.35000 ?  26  LEU A HG   1 
ATOM   47   H  HD11 . LEU A 1 22  ? 10.45200 30.61500  -7.90500  1.000 38.48000 ?  26  LEU A HD11 1 
ATOM   48   H  HD12 . LEU A 1 22  ? 9.77000  29.88000  -6.67300  1.000 38.48000 ?  26  LEU A HD12 1 
ATOM   49   H  HD13 . LEU A 1 22  ? 11.25600 29.50900  -7.09700  1.000 38.48000 ?  26  LEU A HD13 1 
ATOM   50   H  HD21 . LEU A 1 22  ? 10.84900 29.42000  -9.99900  1.000 38.23000 ?  26  LEU A HD21 1 
ATOM   51   H  HD22 . LEU A 1 22  ? 11.58800 28.19300  -9.31300  1.000 38.23000 ?  26  LEU A HD22 1 
ATOM   52   H  HD23 . LEU A 1 22  ? 10.29900 27.94500  -10.20700 1.000 38.23000 ?  26  LEU A HD23 1 
ATOM   53   N  N    . THR A 1 23  ? 8.15000  24.21400  -7.30100  1.000 23.57651 ?  27  THR A N    1 
ATOM   54   C  CA   . THR A 1 23  ? 8.16000  22.97700  -6.53700  1.000 21.96316 ?  27  THR A CA   1 
ATOM   55   C  C    . THR A 1 23  ? 8.45300  21.80900  -7.46600  1.000 20.94988 ?  27  THR A C    1 
ATOM   56   O  O    . THR A 1 23  ? 7.79900  21.64400  -8.49800  1.000 21.77103 ?  27  THR A O    1 
ATOM   57   C  CB   . THR A 1 23  ? 6.81200  22.75000  -5.86100  1.000 23.36859 ?  27  THR A CB   1 
ATOM   58   O  OG1  . THR A 1 23  ? 6.49600  23.85600  -5.01200  1.000 25.28987 ?  27  THR A OG1  1 
ATOM   59   C  CG2  . THR A 1 23  ? 6.86200  21.47300  -5.02200  1.000 23.26858 ?  27  THR A CG2  1 
ATOM   60   H  H    . THR A 1 23  ? 7.38400  24.40800  -7.64000  1.000 28.29000 ?  27  THR A H    1 
ATOM   61   H  HA   . THR A 1 23  ? 8.84900  23.02900  -5.85600  1.000 26.35000 ?  27  THR A HA   1 
ATOM   62   H  HB   . THR A 1 23  ? 6.12000  22.66100  -6.53500  1.000 28.04000 ?  27  THR A HB   1 
ATOM   63   H  HG1  . THR A 1 23  ? 7.05100  23.90400  -4.38300  1.000 30.35000 ?  27  THR A HG1  1 
ATOM   64   H  HG21 . THR A 1 23  ? 6.13600  21.46900  -4.37900  1.000 27.92000 ?  27  THR A HG21 1 
ATOM   65   H  HG22 . THR A 1 23  ? 6.77900  20.69500  -5.59600  1.000 27.92000 ?  27  THR A HG22 1 
ATOM   66   H  HG23 . THR A 1 23  ? 7.70500  21.42200  -4.54500  1.000 27.92000 ?  27  THR A HG23 1 
ATOM   67   N  N    . ASN A 1 24  ? 9.40500  20.97800  -7.07200  1.000 19.76026 ?  28  ASN A N    1 
ATOM   68   C  CA   . ASN A 1 24  ? 9.73600  19.76300  -7.80800  1.000 19.64709 ?  28  ASN A CA   1 
ATOM   69   C  C    . ASN A 1 24  ? 9.98200  20.04700  -9.29000  1.000 21.48942 ?  28  ASN A C    1 
ATOM   70   O  O    . ASN A 1 24  ? 9.44600  19.38200  -10.17700 1.000 22.34215 ?  28  ASN A O    1 
ATOM   71   C  CB   . ASN A 1 24  ? 8.65500  18.69800  -7.61300  1.000 19.59182 ?  28  ASN A CB   1 
ATOM   72   C  CG   . ASN A 1 24  ? 8.55900  18.23500  -6.17900  1.000 18.72593 ?  28  ASN A CG   1 
ATOM   73   O  OD1  . ASN A 1 24  ? 9.56500  18.16700  -5.47800  1.000 18.62592 ?  28  ASN A OD1  1 
ATOM   74   N  ND2  . ASN A 1 24  ? 7.35500  17.92800  -5.73600  1.000 18.78909 ?  28  ASN A ND2  1 
ATOM   75   H  H    . ASN A 1 24  ? 9.88400  21.09600  -6.36700  1.000 23.71000 ?  28  ASN A H    1 
ATOM   76   H  HA   . ASN A 1 24  ? 10.56800 19.41400  -7.45200  1.000 23.57000 ?  28  ASN A HA   1 
ATOM   77   H  HB2  . ASN A 1 24  ? 7.79500  19.06700  -7.86900  1.000 23.51000 ?  28  ASN A HB2  1 
ATOM   78   H  HB3  . ASN A 1 24  ? 8.86300  17.92800  -8.16500  1.000 23.51000 ?  28  ASN A HB3  1 
ATOM   79   H  HD21 . ASN A 1 24  ? 7.25000  17.65900  -4.92600  1.000 22.54000 ?  28  ASN A HD21 1 
ATOM   80   H  HD22 . ASN A 1 24  ? 6.67400  17.99600  -6.25800  1.000 22.54000 ?  28  ASN A HD22 1 
ATOM   81   N  N    . LEU A 1 25  ? 10.83900 21.03600  -9.55500  1.000 21.81577 ?  29  LEU A N    1 
ATOM   82   C  CA   . LEU A 1 25  ? 11.27700 21.27500  -10.93000 1.000 23.14751 ?  29  LEU A CA   1 
ATOM   83   C  C    . LEU A 1 25  ? 11.94400 20.04100  -11.52500 1.000 22.95275 ?  29  LEU A C    1 
ATOM   84   O  O    . LEU A 1 25  ? 11.83300 19.79300  -12.73300 1.000 25.44779 ?  29  LEU A O    1 
ATOM   85   C  CB   . LEU A 1 25  ? 12.23400 22.46600  -10.96700 1.000 24.98457 ?  29  LEU A CB   1 
ATOM   86   C  CG   . LEU A 1 25  ? 11.61600 23.83600  -10.66200 1.000 27.34538 ?  29  LEU A CG   1 
ATOM   87   C  CD1  . LEU A 1 25  ? 12.68500 24.87700  -10.33800 1.000 29.11139 ?  29  LEU A CD1  1 
ATOM   88   C  CD2  . LEU A 1 25  ? 10.74900 24.29800  -11.82400 1.000 28.64028 ?  29  LEU A CD2  1 
ATOM   89   H  H    . LEU A 1 25  ? 11.17500 21.56900  -8.97100  1.000 26.18000 ?  29  LEU A H    1 
ATOM   90   H  HA   . LEU A 1 25  ? 10.50400 21.48900  -11.47500 1.000 27.77000 ?  29  LEU A HA   1 
ATOM   91   H  HB2  . LEU A 1 25  ? 12.93100 22.31300  -10.31000 1.000 29.98000 ?  29  LEU A HB2  1 
ATOM   92   H  HB3  . LEU A 1 25  ? 12.61900 22.51600  -11.85500 1.000 29.98000 ?  29  LEU A HB3  1 
ATOM   93   H  HG   . LEU A 1 25  ? 11.05500 23.74900  -9.87600  1.000 32.81000 ?  29  LEU A HG   1 
ATOM   94   H  HD11 . LEU A 1 25  ? 12.25300 25.72400  -10.14800 1.000 34.93000 ?  29  LEU A HD11 1 
ATOM   95   H  HD12 . LEU A 1 25  ? 13.18900 24.58100  -9.56300  1.000 34.93000 ?  29  LEU A HD12 1 
ATOM   96   H  HD13 . LEU A 1 25  ? 13.27700 24.97000  -11.10100 1.000 34.93000 ?  29  LEU A HD13 1 
ATOM   97   H  HD21 . LEU A 1 25  ? 10.43300 25.19700  -11.64400 1.000 34.37000 ?  29  LEU A HD21 1 
ATOM   98   H  HD22 . LEU A 1 25  ? 11.27900 24.29000  -12.63700 1.000 34.37000 ?  29  LEU A HD22 1 
ATOM   99   H  HD23 . LEU A 1 25  ? 9.99500  23.69400  -11.91600 1.000 34.37000 ?  29  LEU A HD23 1 
ATOM   100  N  N    . VAL A 1 26  ? 12.65600 19.27800  -10.69900 1.000 22.52375 ?  30  VAL A N    1 
ATOM   101  C  CA   . VAL A 1 26  ? 13.37800 18.06800  -11.08600 1.000 22.14476 ?  30  VAL A CA   1 
ATOM   102  C  C    . VAL A 1 26  ? 12.86700 16.93100  -10.20500 1.000 22.10528 ?  30  VAL A C    1 
ATOM   103  O  O    . VAL A 1 26  ? 12.99500 16.99300  -8.97600  1.000 23.11067 ?  30  VAL A O    1 
ATOM   104  C  CB   . VAL A 1 26  ? 14.89600 18.26000  -10.91200 1.000 23.70811 ?  30  VAL A CB   1 
ATOM   105  C  CG1  . VAL A 1 26  ? 15.63900 16.95500  -11.14200 1.000 24.24501 ?  30  VAL A CG1  1 
ATOM   106  C  CG2  . VAL A 1 26  ? 15.40800 19.35900  -11.83900 1.000 24.75560 ?  30  VAL A CG2  1 
ATOM   107  H  H    . VAL A 1 26  ? 12.74100 19.45200  -9.86100  1.000 27.03000 ?  30  VAL A H    1 
ATOM   108  H  HA   . VAL A 1 26  ? 13.19300 17.84400  -12.01100 1.000 26.57000 ?  30  VAL A HA   1 
ATOM   109  H  HB   . VAL A 1 26  ? 15.07200 18.53700  -9.99900  1.000 28.45000 ?  30  VAL A HB   1 
ATOM   110  H  HG11 . VAL A 1 26  ? 16.58500 17.14400  -11.24000 1.000 29.09000 ?  30  VAL A HG11 1 
ATOM   111  H  HG12 . VAL A 1 26  ? 15.49500 16.37100  -10.38100 1.000 29.09000 ?  30  VAL A HG12 1 
ATOM   112  H  HG13 . VAL A 1 26  ? 15.30000 16.53700  -11.94900 1.000 29.09000 ?  30  VAL A HG13 1 
ATOM   113  H  HG21 . VAL A 1 26  ? 16.37400 19.40800  -11.76800 1.000 29.70000 ?  30  VAL A HG21 1 
ATOM   114  H  HG22 . VAL A 1 26  ? 15.15300 19.14700  -12.75100 1.000 29.70000 ?  30  VAL A HG22 1 
ATOM   115  H  HG23 . VAL A 1 26  ? 15.01400 20.20500  -11.57400 1.000 29.70000 ?  30  VAL A HG23 1 
ATOM   116  N  N    . ALA A 1 27  ? 12.27000 15.91100  -10.82600 1.000 21.77630 ?  31  ALA A N    1 
ATOM   117  C  CA   . ALA A 1 27  ? 11.75300 14.77200  -10.08300 1.000 21.66839 ?  31  ALA A CA   1 
ATOM   118  C  C    . ALA A 1 27  ? 12.89400 13.90700  -9.56800  1.000 20.56826 ?  31  ALA A C    1 
ATOM   119  O  O    . ALA A 1 27  ? 13.93600 13.78500  -10.20900 1.000 22.24214 ?  31  ALA A O    1 
ATOM   120  C  CB   . ALA A 1 27  ? 10.85300 13.92600  -10.98100 1.000 23.29227 ?  31  ALA A CB   1 
ATOM   121  H  H    . ALA A 1 27  ? 12.15300 15.85900  -11.67700 1.000 26.13000 ?  31  ALA A H    1 
ATOM   122  H  HA   . ALA A 1 27  ? 11.23600 15.08900  -9.32600  1.000 26.00000 ?  31  ALA A HA   1 
ATOM   123  H  HB1  . ALA A 1 27  ? 10.52300 13.16800  -10.47400 1.000 27.95000 ?  31  ALA A HB1  1 
ATOM   124  H  HB2  . ALA A 1 27  ? 10.10900 14.47000  -11.28500 1.000 27.95000 ?  31  ALA A HB2  1 
ATOM   125  H  HB3  . ALA A 1 27  ? 11.36800 13.61600  -11.74300 1.000 27.95000 ?  31  ALA A HB3  1 
ATOM   126  N  N    . GLU A 1 28  ? 12.68400 13.30400  -8.40000  1.000 19.21283 ?  32  GLU A N    1 
ATOM   127  C  CA   . GLU A 1 28  ? 13.63900 12.42700  -7.74700  1.000 18.93648 ?  32  GLU A CA   1 
ATOM   128  C  C    . GLU A 1 28  ? 12.94400 11.15700  -7.28100  1.000 18.50485 ?  32  GLU A C    1 
ATOM   129  O  O    . GLU A 1 28  ? 11.75200 11.17900  -6.95600  1.000 19.28389 ?  32  GLU A O    1 
ATOM   130  C  CB   . GLU A 1 28  ? 14.27400 13.12700  -6.54200  1.000 20.03398 ?  32  GLU A CB   1 
ATOM   131  C  CG   . GLU A 1 28  ? 15.02600 14.40500  -6.87900  1.000 20.83408 ?  32  GLU A CG   1 
ATOM   132  C  CD   . GLU A 1 28  ? 16.25500 14.17100  -7.72500  1.000 22.49217 ?  32  GLU A CD   1 
ATOM   133  O  OE1  . GLU A 1 28  ? 16.73900 13.01500  -7.78000  1.000 24.26080 ?  32  GLU A OE1  1 
ATOM   134  O  OE2  . GLU A 1 28  ? 16.75600 15.15200  -8.33100  1.000 22.80010 -1 32  GLU A OE2  1 
ATOM   135  H  H    . GLU A 1 28  ? 11.95800 13.39500  -7.94700  1.000 23.05000 ?  32  GLU A H    1 
ATOM   136  H  HA   . GLU A 1 28  ? 14.34000 12.18000  -8.37100  1.000 22.72000 ?  32  GLU A HA   1 
ATOM   137  H  HB2  . GLU A 1 28  ? 13.57200 13.35700  -5.91300  1.000 24.04000 ?  32  GLU A HB2  1 
ATOM   138  H  HB3  . GLU A 1 28  ? 14.90400 12.51700  -6.12700  1.000 24.04000 ?  32  GLU A HB3  1 
ATOM   139  H  HG2  . GLU A 1 28  ? 14.43500 14.99600  -7.37100  1.000 25.00000 ?  32  GLU A HG2  1 
ATOM   140  H  HG3  . GLU A 1 28  ? 15.30900 14.82900  -6.05400  1.000 25.00000 ?  32  GLU A HG3  1 
ATOM   141  N  N    . PRO A 1 29  ? 13.67100 10.03700  -7.20700  1.000 18.32851 ?  33  PRO A N    1 
ATOM   142  C  CA   . PRO A 1 29  ? 13.02900 8.72200   -6.96400  1.000 18.69961 ?  33  PRO A CA   1 
ATOM   143  C  C    . PRO A 1 29  ? 12.75800 8.42200   -5.48800  1.000 18.23903 ?  33  PRO A C    1 
ATOM   144  O  O    . PRO A 1 29  ? 13.22600 7.42100   -4.93100  1.000 18.72330 ?  33  PRO A O    1 
ATOM   145  C  CB   . PRO A 1 29  ? 14.03900 7.74300   -7.59200  1.000 19.80764 ?  33  PRO A CB   1 
ATOM   146  C  CG   . PRO A 1 29  ? 15.35100 8.42400   -7.39400  1.000 19.97082 ?  33  PRO A CG   1 
ATOM   147  C  CD   . PRO A 1 29  ? 15.07100 9.87800   -7.66400  1.000 19.01807 ?  33  PRO A CD   1 
ATOM   148  H  HA   . PRO A 1 29  ? 12.18700 8.68700   -7.44500  1.000 22.44000 ?  33  PRO A HA   1 
ATOM   149  H  HB2  . PRO A 1 29  ? 14.01100 6.89000   -7.13100  1.000 23.76000 ?  33  PRO A HB2  1 
ATOM   150  H  HB3  . PRO A 1 29  ? 13.84500 7.61700   -8.53400  1.000 23.76000 ?  33  PRO A HB3  1 
ATOM   151  H  HG2  . PRO A 1 29  ? 15.65900 8.29300   -6.48400  1.000 23.96000 ?  33  PRO A HG2  1 
ATOM   152  H  HG3  . PRO A 1 29  ? 16.00400 8.07400   -8.01900  1.000 23.96000 ?  33  PRO A HG3  1 
ATOM   153  H  HD2  . PRO A 1 29  ? 15.66900 10.44600  -7.15300  1.000 22.81000 ?  33  PRO A HD2  1 
ATOM   154  H  HD3  . PRO A 1 29  ? 15.15200 10.07600  -8.61000  1.000 22.81000 ?  33  PRO A HD3  1 
ATOM   155  N  N    . PHE A 1 30  ? 11.94500 9.27300   -4.85400  1.000 17.24944 ?  34  PHE A N    1 
ATOM   156  C  CA   . PHE A 1 30  ? 11.57700 9.05100   -3.45400  1.000 16.75464 ?  34  PHE A CA   1 
ATOM   157  C  C    . PHE A 1 30  ? 10.72300 7.80200   -3.28100  1.000 16.64410 ?  34  PHE A C    1 
ATOM   158  O  O    . PHE A 1 30  ? 10.82800 7.12000   -2.25500  1.000 17.45736 ?  34  PHE A O    1 
ATOM   159  C  CB   . PHE A 1 30  ? 10.83700 10.26800  -2.87800  1.000 16.62568 ?  34  PHE A CB   1 
ATOM   160  C  CG   . PHE A 1 30  ? 11.70200 11.49300  -2.71300  1.000 16.02824 ?  34  PHE A CG   1 
ATOM   161  C  CD1  . PHE A 1 30  ? 12.67400 11.53800  -1.72700  1.000 16.44671 ?  34  PHE A CD1  1 
ATOM   162  C  CD2  . PHE A 1 30  ? 11.52700 12.59600  -3.51800  1.000 16.85728 ?  34  PHE A CD2  1 
ATOM   163  C  CE1  . PHE A 1 30  ? 13.47000 12.65100  -1.57500  1.000 16.25195 ?  34  PHE A CE1  1 
ATOM   164  C  CE2  . PHE A 1 30  ? 12.31300 13.72900  -3.36200  1.000 16.84939 ?  34  PHE A CE2  1 
ATOM   165  C  CZ   . PHE A 1 30  ? 13.29700 13.74600  -2.39100  1.000 16.28880 ?  34  PHE A CZ   1 
ATOM   166  H  H    . PHE A 1 30  ? 11.59700 9.97600   -5.20700  1.000 20.70000 ?  34  PHE A H    1 
ATOM   167  H  HA   . PHE A 1 30  ? 12.40100 8.93400   -2.95500  1.000 20.10000 ?  34  PHE A HA   1 
ATOM   168  H  HB2  . PHE A 1 30  ? 10.10900 10.50000  -3.47500  1.000 19.95000 ?  34  PHE A HB2  1 
ATOM   169  H  HB3  . PHE A 1 30  ? 10.48800 10.03400  -2.00400  1.000 19.95000 ?  34  PHE A HB3  1 
ATOM   170  H  HD1  . PHE A 1 30  ? 12.78900 10.80800  -1.16200  1.000 19.73000 ?  34  PHE A HD1  1 
ATOM   171  H  HD2  . PHE A 1 30  ? 10.87100 12.58100  -4.17700  1.000 20.22000 ?  34  PHE A HD2  1 
ATOM   172  H  HE1  . PHE A 1 30  ? 14.12800 12.66200  -0.91800  1.000 19.50000 ?  34  PHE A HE1  1 
ATOM   173  H  HE2  . PHE A 1 30  ? 12.17800 14.47100  -3.90600  1.000 20.21000 ?  34  PHE A HE2  1 
ATOM   174  H  HZ   . PHE A 1 30  ? 13.84000 14.49400  -2.29000  1.000 19.54000 ?  34  PHE A HZ   1 
ATOM   175  N  N    . ALA A 1 31  ? 9.83200  7.51500   -4.24100  1.000 17.76792 ?  35  ALA A N    1 
ATOM   176  C  CA   . ALA A 1 31  ? 8.94100  6.36600   -4.10100  1.000 17.88109 ?  35  ALA A CA   1 
ATOM   177  C  C    . ALA A 1 31  ? 9.73100  5.06600   -4.02500  1.000 17.78897 ?  35  ALA A C    1 
ATOM   178  O  O    . ALA A 1 31  ? 9.48400  4.21700   -3.15900  1.000 18.32325 ?  35  ALA A O    1 
ATOM   179  C  CB   . ALA A 1 31  ? 7.91700  6.33200   -5.24500  1.000 19.39443 ?  35  ALA A CB   1 
ATOM   180  H  H    . ALA A 1 31  ? 9.72900  7.96400   -4.96700  1.000 21.32000 ?  35  ALA A H    1 
ATOM   181  H  HA   . ALA A 1 31  ? 8.44200  6.45900   -3.27400  1.000 21.45000 ?  35  ALA A HA   1 
ATOM   182  H  HB1  . ALA A 1 31  ? 7.34500  5.55700   -5.13300  1.000 23.27000 ?  35  ALA A HB1  1 
ATOM   183  H  HB2  . ALA A 1 31  ? 7.38600  7.14200   -5.21700  1.000 23.27000 ?  35  ALA A HB2  1 
ATOM   184  H  HB3  . ALA A 1 31  ? 8.39000  6.27500   -6.09000  1.000 23.27000 ?  35  ALA A HB3  1 
ATOM   185  N  N    . LYS A 1 32  ? 10.71400 4.90300   -4.90300  1.000 18.80752 ?  36  LYS A N    1 
ATOM   186  C  CA   . LYS A 1 32  ? 11.53300 3.70000   -4.84600  1.000 19.93134 ?  36  LYS A CA   1 
ATOM   187  C  C    . LYS A 1 32  ? 12.27800 3.61700   -3.52100  1.000 19.28652 ?  36  LYS A C    1 
ATOM   188  O  O    . LYS A 1 32  ? 12.39800 2.54000   -2.93000  1.000 20.11557 ?  36  LYS A O    1 
ATOM   189  C  CB   . LYS A 1 32  ? 12.51400 3.69000   -6.01500  1.000 22.50533 ?  36  LYS A CB   1 
ATOM   190  C  CG   . LYS A 1 32  ? 13.44500 2.48100   -6.03800  1.000 26.30315 ?  36  LYS A CG   1 
ATOM   191  C  CD   . LYS A 1 32  ? 12.64900 1.18400   -6.08500  1.000 29.55618 ?  36  LYS A CD   1 
ATOM   192  C  CE   . LYS A 1 32  ? 13.42600 0.03300   -6.71300  1.000 32.68023 ?  36  LYS A CE   1 
ATOM   193  N  NZ   . LYS A 1 32  ? 14.21400 -0.77500  -5.74100  1.000 34.16725 ?  36  LYS A NZ   1 
ATOM   194  H  H    . LYS A 1 32  ? 10.92200 5.45900   -5.52500  1.000 22.56000 ?  36  LYS A H    1 
ATOM   195  H  HA   . LYS A 1 32  ? 10.96400 2.91900   -4.92300  1.000 23.91000 ?  36  LYS A HA   1 
ATOM   196  H  HB2  . LYS A 1 32  ? 12.01000 3.68900   -6.84400  1.000 27.00000 ?  36  LYS A HB2  1 
ATOM   197  H  HB3  . LYS A 1 32  ? 13.06700 4.48600   -5.96400  1.000 27.00000 ?  36  LYS A HB3  1 
ATOM   198  H  HG2  . LYS A 1 32  ? 14.01100 2.52300   -6.82500  1.000 31.56000 ?  36  LYS A HG2  1 
ATOM   199  H  HG3  . LYS A 1 32  ? 13.99200 2.47800   -5.23700  1.000 31.56000 ?  36  LYS A HG3  1 
ATOM   200  H  HD2  . LYS A 1 32  ? 12.41200 0.92600   -5.18000  1.000 35.46000 ?  36  LYS A HD2  1 
ATOM   201  H  HD3  . LYS A 1 32  ? 11.84600 1.32400   -6.61000  1.000 35.46000 ?  36  LYS A HD3  1 
ATOM   202  H  HE2  . LYS A 1 32  ? 12.79900 -0.56300  -7.15100  1.000 39.22000 ?  36  LYS A HE2  1 
ATOM   203  H  HE3  . LYS A 1 32  ? 14.04700 0.39700   -7.36400  1.000 39.22000 ?  36  LYS A HE3  1 
ATOM   204  H  HZ1  . LYS A 1 32  ? 14.66000 -1.41500  -6.16800  1.000 41.00000 ?  36  LYS A HZ1  1 
ATOM   205  H  HZ2  . LYS A 1 32  ? 14.79500 -0.25400  -5.31200  1.000 41.00000 ?  36  LYS A HZ2  1 
ATOM   206  H  HZ3  . LYS A 1 32  ? 13.66900 -1.15000  -5.14500  1.000 41.00000 ?  36  LYS A HZ3  1 
ATOM   207  N  N    . LEU A 1 33  ? 12.78400 4.74800   -3.04300  1.000 17.97321 ?  37  LEU A N    1 
ATOM   208  C  CA   . LEU A 1 33  ? 13.49100 4.75700   -1.76700  1.000 17.20206 ?  37  LEU A CA   1 
ATOM   209  C  C    . LEU A 1 33  ? 12.59600 4.27700   -0.62200  1.000 16.61778 ?  37  LEU A C    1 
ATOM   210  O  O    . LEU A 1 33  ? 13.01800 3.46600   0.21100   1.000 16.96782 ?  37  LEU A O    1 
ATOM   211  C  CB   . LEU A 1 33  ? 14.03100 6.16000   -1.50900  1.000 18.15744 ?  37  LEU A CB   1 
ATOM   212  C  CG   . LEU A 1 33  ? 14.93400 6.33400   -0.29600  1.000 19.16019 ?  37  LEU A CG   1 
ATOM   213  C  CD1  . LEU A 1 33  ? 16.23500 5.59000   -0.52300  1.000 21.71313 ?  37  LEU A CD1  1 
ATOM   214  C  CD2  . LEU A 1 33  ? 15.19300 7.81100   -0.05500  1.000 19.33916 ?  37  LEU A CD2  1 
ATOM   215  H  H    . LEU A 1 33  ? 12.73400 5.51300   -3.43200  1.000 21.57000 ?  37  LEU A H    1 
ATOM   216  H  HA   . LEU A 1 33  ? 14.24100 4.14400   -1.81000  1.000 20.64000 ?  37  LEU A HA   1 
ATOM   217  H  HB2  . LEU A 1 33  ? 14.54400 6.43100   -2.28600  1.000 21.79000 ?  37  LEU A HB2  1 
ATOM   218  H  HB3  . LEU A 1 33  ? 13.27400 6.75400   -1.38700  1.000 21.79000 ?  37  LEU A HB3  1 
ATOM   219  H  HG   . LEU A 1 33  ? 14.50600 5.97000   0.49500   1.000 22.99000 ?  37  LEU A HG   1 
ATOM   220  H  HD11 . LEU A 1 33  ? 16.82500 5.74700   0.23200   1.000 26.05000 ?  37  LEU A HD11 1 
ATOM   221  H  HD12 . LEU A 1 33  ? 16.04700 4.64200   -0.60400  1.000 26.05000 ?  37  LEU A HD12 1 
ATOM   222  H  HD13 . LEU A 1 33  ? 16.64800 5.91700   -1.33800  1.000 26.05000 ?  37  LEU A HD13 1 
ATOM   223  H  HD21 . LEU A 1 33  ? 15.78200 7.90700   0.71000   1.000 23.20000 ?  37  LEU A HD21 1 
ATOM   224  H  HD22 . LEU A 1 33  ? 15.61000 8.19100   -0.84400  1.000 23.20000 ?  37  LEU A HD22 1 
ATOM   225  H  HD23 . LEU A 1 33  ? 14.34900 8.25500   0.12000   1.000 23.20000 ?  37  LEU A HD23 1 
ATOM   226  N  N    . GLU A 1 34  ? 11.35900 4.78200   -0.54300  1.000 16.20457 ?  38  GLU A N    1 
ATOM   227  C  CA   . GLU A 1 34  ? 10.51300 4.39200   0.59100   1.000 16.19668 ?  38  GLU A CA   1 
ATOM   228  C  C    . GLU A 1 34  ? 10.03200 2.95500   0.43700   1.000 16.69147 ?  38  GLU A C    1 
ATOM   229  O  O    . GLU A 1 34  ? 9.84300  2.25500   1.44100   1.000 17.71002 ?  38  GLU A O    1 
ATOM   230  C  CB   . GLU A 1 34  ? 9.34200  5.36800   0.79900   1.000 16.25458 ?  38  GLU A CB   1 
ATOM   231  C  CG   . GLU A 1 34  ? 8.21500  5.19500   -0.17200  1.000 15.58082 ?  38  GLU A CG   1 
ATOM   232  C  CD   . GLU A 1 34  ? 7.16600  6.30200   -0.10100  1.000 15.09391 ?  38  GLU A CD   1 
ATOM   233  O  OE1  . GLU A 1 34  ? 7.10600  7.07900   0.87700   1.000 14.49647 ?  38  GLU A OE1  1 
ATOM   234  O  OE2  . GLU A 1 34  ? 6.36100  6.35900   -1.05100  1.000 15.37816 -1 38  GLU A OE2  1 
ATOM   235  H  H    . GLU A 1 34  ? 11.00100 5.32500   -1.10600  1.000 19.44000 ?  38  GLU A H    1 
ATOM   236  H  HA   . GLU A 1 34  ? 11.04000 4.45200   1.40300   1.000 19.43000 ?  38  GLU A HA   1 
ATOM   237  H  HB2  . GLU A 1 34  ? 8.98400  5.23600   1.69100   1.000 19.50000 ?  38  GLU A HB2  1 
ATOM   238  H  HB3  . GLU A 1 34  ? 9.67400  6.27400   0.70600   1.000 19.50000 ?  38  GLU A HB3  1 
ATOM   239  H  HG2  . GLU A 1 34  ? 8.57600  5.18700   -1.07200  1.000 18.69000 ?  38  GLU A HG2  1 
ATOM   240  H  HG3  . GLU A 1 34  ? 7.76900  4.35300   0.01300   1.000 18.69000 ?  38  GLU A HG3  1 
ATOM   241  N  N    . GLN A 1 35  ? 9.86800  2.49000   -0.80200  1.000 17.37050 ?  39  GLN A N    1 
ATOM   242  C  CA   . GLN A 1 35  ? 9.47100  1.10600   -1.01400  1.000 19.01544 ?  39  GLN A CA   1 
ATOM   243  C  C    . GLN A 1 35  ? 10.56900 0.14900   -0.57400  1.000 19.86554 ?  39  GLN A C    1 
ATOM   244  O  O    . GLN A 1 35  ? 10.28700 -0.87500  0.06100   1.000 20.55773 ?  39  GLN A O    1 
ATOM   245  C  CB   . GLN A 1 35  ? 9.12800  0.89700   -2.48200  1.000 20.55510 ?  39  GLN A CB   1 
ATOM   246  C  CG   . GLN A 1 35  ? 7.80700  1.54600   -2.84200  1.000 21.78419 ?  39  GLN A CG   1 
ATOM   247  C  CD   . GLN A 1 35  ? 7.65100  1.75500   -4.32100  1.000 23.31332 ?  39  GLN A CD   1 
ATOM   248  O  OE1  . GLN A 1 35  ? 8.30600  1.11200   -5.13900  1.000 24.38450 ?  39  GLN A OE1  1 
ATOM   249  N  NE2  . GLN A 1 35  ? 6.77300  2.69400   -4.67500  1.000 23.78443 ?  39  GLN A NE2  1 
ATOM   250  H  H    . GLN A 1 35  ? 9.97900  2.94900   -1.52100  1.000 20.84000 ?  39  GLN A H    1 
ATOM   251  H  HA   . GLN A 1 35  ? 8.68000  0.91200   -0.48600  1.000 22.82000 ?  39  GLN A HA   1 
ATOM   252  H  HB2  . GLN A 1 35  ? 9.82300  1.29100   -3.03200  1.000 24.66000 ?  39  GLN A HB2  1 
ATOM   253  H  HB3  . GLN A 1 35  ? 9.06100  -0.05400  -2.66300  1.000 24.66000 ?  39  GLN A HB3  1 
ATOM   254  H  HG2  . GLN A 1 35  ? 7.08200  0.97600   -2.54000  1.000 26.14000 ?  39  GLN A HG2  1 
ATOM   255  H  HG3  . GLN A 1 35  ? 7.75100  2.41200   -2.40800  1.000 26.14000 ?  39  GLN A HG3  1 
ATOM   256  H  HE21 . GLN A 1 35  ? 6.34300  3.13000   -4.07100  1.000 28.54000 ?  39  GLN A HE21 1 
ATOM   257  H  HE22 . GLN A 1 35  ? 6.63600  2.86300   -5.50700  1.000 28.54000 ?  39  GLN A HE22 1 
ATOM   258  N  N    . ASP A 1 36  ? 11.82700 0.47000   -0.89700  1.000 19.64972 ?  40  ASP A N    1 
ATOM   259  C  CA   . ASP A 1 36  ? 12.93400 -0.35400  -0.42800  1.000 20.42613 ?  40  ASP A CA   1 
ATOM   260  C  C    . ASP A 1 36  ? 13.03000 -0.32400  1.09500   1.000 20.14715 ?  40  ASP A C    1 
ATOM   261  O  O    . ASP A 1 36  ? 13.39200 -1.32700  1.71900   1.000 22.83432 ?  40  ASP A O    1 
ATOM   262  C  CB   . ASP A 1 36  ? 14.23500 0.13700   -1.04700  1.000 22.39216 ?  40  ASP A CB   1 
ATOM   263  C  CG   . ASP A 1 36  ? 14.35800 -0.22100  -2.51900  1.000 26.50844 ?  40  ASP A CG   1 
ATOM   264  O  OD1  . ASP A 1 36  ? 13.61800 -1.11100  -3.00000  1.000 28.15601 ?  40  ASP A OD1  1 
ATOM   265  O  OD2  . ASP A 1 36  ? 15.20400 0.38900   -3.19300  1.000 28.09811 -1 40  ASP A OD2  1 
ATOM   266  H  H    . ASP A 1 36  ? 12.05800 1.14500   -1.37700  1.000 23.58000 ?  40  ASP A H    1 
ATOM   267  H  HA   . ASP A 1 36  ? 12.78700 -1.27200  -0.70500  1.000 24.51000 ?  40  ASP A HA   1 
ATOM   268  H  HB2  . ASP A 1 36  ? 14.27700 1.10300   -0.96900  1.000 26.87000 ?  40  ASP A HB2  1 
ATOM   269  H  HB3  . ASP A 1 36  ? 14.98100 -0.26700  -0.57700  1.000 26.87000 ?  40  ASP A HB3  1 
ATOM   270  N  N    . PHE A 1 37  ? 12.72300 0.82700   1.70500   1.000 18.55486 ?  41  PHE A N    1 
ATOM   271  C  CA   . PHE A 1 37  ? 12.70400 0.95200   3.16100   1.000 17.49420 ?  41  PHE A CA   1 
ATOM   272  C  C    . PHE A 1 37  ? 11.56100 0.16400   3.79000   1.000 18.09691 ?  41  PHE A C    1 
ATOM   273  O  O    . PHE A 1 37  ? 11.68900 -0.29600  4.92900   1.000 20.04188 ?  41  PHE A O    1 
ATOM   274  C  CB   . PHE A 1 37  ? 12.60400 2.45400   3.49400   1.000 16.79149 ?  41  PHE A CB   1 
ATOM   275  C  CG   . PHE A 1 37  ? 12.28800 2.77000   4.92700   1.000 16.90466 ?  41  PHE A CG   1 
ATOM   276  C  CD1  . PHE A 1 37  ? 13.15200 2.40400   5.95400   1.000 17.62053 ?  41  PHE A CD1  1 
ATOM   277  C  CD2  . PHE A 1 37  ? 11.12500 3.44400   5.25800   1.000 17.18364 ?  41  PHE A CD2  1 
ATOM   278  C  CE1  . PHE A 1 37  ? 12.85300 2.69000   7.27500   1.000 17.40735 ?  41  PHE A CE1  1 
ATOM   279  C  CE2  . PHE A 1 37  ? 10.82400 3.73600   6.57700   1.000 17.00467 ?  41  PHE A CE2  1 
ATOM   280  C  CZ   . PHE A 1 37  ? 11.68400 3.34100   7.58600   1.000 17.41788 ?  41  PHE A CZ   1 
ATOM   281  H  H    . PHE A 1 37  ? 12.51900 1.55400   1.29400   1.000 22.26000 ?  41  PHE A H    1 
ATOM   282  H  HA   . PHE A 1 37  ? 13.52000 0.59400   3.54500   1.000 20.99000 ?  41  PHE A HA   1 
ATOM   283  H  HB2  . PHE A 1 37  ? 13.45500 2.87200   3.28600   1.000 20.15000 ?  41  PHE A HB2  1 
ATOM   284  H  HB3  . PHE A 1 37  ? 11.90200 2.84300   2.95000   1.000 20.15000 ?  41  PHE A HB3  1 
ATOM   285  H  HD1  . PHE A 1 37  ? 13.94300 1.96100   5.75000   1.000 21.14000 ?  41  PHE A HD1  1 
ATOM   286  H  HD2  . PHE A 1 37  ? 10.53800 3.70300   4.58500   1.000 20.62000 ?  41  PHE A HD2  1 
ATOM   287  H  HE1  . PHE A 1 37  ? 13.44200 2.44100   7.95100   1.000 20.88000 ?  41  PHE A HE1  1 
ATOM   288  H  HE2  . PHE A 1 37  ? 10.04400 4.19800   6.78500   1.000 20.40000 ?  41  PHE A HE2  1 
ATOM   289  H  HZ   . PHE A 1 37  ? 11.47100 3.51600   8.47400   1.000 20.90000 ?  41  PHE A HZ   1 
ATOM   290  N  N    . GLY A 1 38  ? 10.45300 -0.00900  3.07400   1.000 18.21534 ?  42  GLY A N    1 
ATOM   291  C  CA   . GLY A 1 38  ? 9.30000  -0.68000  3.62100   1.000 17.94426 ?  42  GLY A CA   1 
ATOM   292  C  C    . GLY A 1 38  ? 8.34300  0.21900   4.36900   1.000 17.30734 ?  42  GLY A C    1 
ATOM   293  O  O    . GLY A 1 38  ? 7.63600  -0.25400  5.26000   1.000 19.30758 ?  42  GLY A O    1 
ATOM   294  H  H    . GLY A 1 38  ? 10.35100 0.25900   2.26400   1.000 21.85000 ?  42  GLY A H    1 
ATOM   295  H  HA2  . GLY A 1 38  ? 8.81000  -1.09800  2.89600   1.000 21.53000 ?  42  GLY A HA2  1 
ATOM   296  H  HA3  . GLY A 1 38  ? 9.60300  -1.36700  4.23500   1.000 21.53000 ?  42  GLY A HA3  1 
ATOM   297  N  N    . GLY A 1 39  ? 8.28600  1.49000   4.03900   1.000 15.11760 ?  43  GLY A N    1 
ATOM   298  C  CA   . GLY A 1 39  ? 7.42400  2.41500   4.74500   1.000 14.83336 ?  43  GLY A CA   1 
ATOM   299  C  C    . GLY A 1 39  ? 7.19300  3.66300   3.95100   1.000 14.27803 ?  43  GLY A C    1 
ATOM   300  O  O    . GLY A 1 39  ? 7.10500  3.62800   2.71700   1.000 15.93875 ?  43  GLY A O    1 
ATOM   301  H  H    . GLY A 1 39  ? 8.74100  1.84800   3.40300   1.000 18.14000 ?  43  GLY A H    1 
ATOM   302  H  HA2  . GLY A 1 39  ? 6.56700  1.99500   4.91800   1.000 17.80000 ?  43  GLY A HA2  1 
ATOM   303  H  HA3  . GLY A 1 39  ? 7.83300  2.65900   5.59100   1.000 17.80000 ?  43  GLY A HA3  1 
ATOM   304  N  N    . SER A 1 40  ? 7.05900  4.77400   4.66100   1.000 13.84903 ?  44  SER A N    1 
ATOM   305  C  CA   . SER A 1 40  ? 6.76900  6.07000   4.07000   1.000 13.95957 ?  44  SER A CA   1 
ATOM   306  C  C    . SER A 1 40  ? 7.83900  7.06100   4.45900   1.000 13.29896 ?  44  SER A C    1 
ATOM   307  O  O    . SER A 1 40  ? 8.26600  7.08800   5.61700   1.000 13.55952 ?  44  SER A O    1 
ATOM   308  C  CB   . SER A 1 40  ? 5.42500  6.61700   4.55800   1.000 15.30183 ?  44  SER A CB   1 
ATOM   309  O  OG   . SER A 1 40  ? 4.36200  5.75800   4.20600   1.000 16.97046 ?  44  SER A OG   1 
ATOM   310  H  H    . SER A 1 40  ? 7.13400  4.80300   5.51700   1.000 16.61000 ?  44  SER A H    1 
ATOM   311  H  HA   . SER A 1 40  ? 6.74800  5.97200   3.10500   1.000 16.75000 ?  44  SER A HA   1 
ATOM   312  H  HB2  . SER A 1 40  ? 5.45300  6.70200   5.52300   1.000 18.36000 ?  44  SER A HB2  1 
ATOM   313  H  HB3  . SER A 1 40  ? 5.27400  7.48500   4.15200   1.000 18.36000 ?  44  SER A HB3  1 
ATOM   314  H  HG   . SER A 1 40  ? 3.63300  6.08200   4.46700   1.000 20.36000 ?  44  SER A HG   1 
ATOM   315  N  N    A ILE A 1 41  ? 8.25700  7.87400   3.48600   0.760 12.77785 ?  45  ILE A N    1 
ATOM   316  N  N    B ILE A 1 41  ? 8.27500  7.87000   3.50400   0.240 12.83312 ?  45  ILE A N    1 
ATOM   317  C  CA   A ILE A 1 41  ? 9.21800  8.95300   3.68500   0.760 12.96998 ?  45  ILE A CA   1 
ATOM   318  C  CA   B ILE A 1 41  ? 9.20700  8.95000   3.78800   0.240 12.49360 ?  45  ILE A CA   1 
ATOM   319  C  C    A ILE A 1 41  ? 8.55300  10.26500  3.30900   0.760 12.40938 ?  45  ILE A C    1 
ATOM   320  C  C    B ILE A 1 41  ? 8.58500  10.25800  3.32700   0.240 12.19094 ?  45  ILE A C    1 
ATOM   321  O  O    A ILE A 1 41  ? 7.91300  10.35700  2.25200   0.760 14.23329 ?  45  ILE A O    1 
ATOM   322  O  O    B ILE A 1 41  ? 8.02000  10.34300  2.22900   0.240 12.78311 ?  45  ILE A O    1 
ATOM   323  C  CB   A ILE A 1 41  ? 10.49500 8.72000   2.85400   0.760 14.55438 ?  45  ILE A CB   1 
ATOM   324  C  CB   B ILE A 1 41  ? 10.58500 8.72600   3.13900   0.240 12.85417 ?  45  ILE A CB   1 
ATOM   325  C  CG1  A ILE A 1 41  ? 11.16400 7.40100   3.26200   0.760 15.61503 ?  45  ILE A CG1  1 
ATOM   326  C  CG1  B ILE A 1 41  ? 10.48300 8.93500   1.63900   0.240 13.51215 ?  45  ILE A CG1  1 
ATOM   327  C  CG2  A ILE A 1 41  ? 11.47900 9.88400   3.00000   0.760 15.14392 ?  45  ILE A CG2  1 
ATOM   328  C  CG2  B ILE A 1 41  ? 11.10700 7.33100   3.45800   0.240 12.95682 ?  45  ILE A CG2  1 
ATOM   329  C  CD1  A ILE A 1 41  ? 12.22000 6.92900   2.29500   0.760 16.58620 ?  45  ILE A CD1  1 
ATOM   330  C  CD1  B ILE A 1 41  ? 11.79400 8.75800   0.91700   0.240 13.71217 ?  45  ILE A CD1  1 
ATOM   331  H  H    A ILE A 1 41  ? 7.98500  7.81400   2.67200   0.760 15.33000 ?  45  ILE A H    1 
ATOM   332  H  H    B ILE A 1 41  ? 8.04400  7.81200   2.67800   0.240 15.39000 ?  45  ILE A H    1 
ATOM   333  H  HA   A ILE A 1 41  ? 9.46400  9.00200   4.62200   0.760 15.56000 ?  45  ILE A HA   1 
ATOM   334  H  HA   B ILE A 1 41  ? 9.34500  9.00100   4.74700   0.240 14.99000 ?  45  ILE A HA   1 
ATOM   335  H  HB   A ILE A 1 41  ? 10.23200 8.66500   1.92100   0.760 17.46000 ?  45  ILE A HB   1 
ATOM   336  H  HB   B ILE A 1 41  ? 11.21200 9.37000   3.50300   0.240 15.42000 ?  45  ILE A HB   1 
ATOM   337  H  HG12 A ILE A 1 41  ? 11.58700 7.52200   4.12600   0.760 18.73000 ?  45  ILE A HG12 1 
ATOM   338  H  HG12 B ILE A 1 41  ? 9.85400  8.29200   1.27500   0.240 16.21000 ?  45  ILE A HG12 1 
ATOM   339  H  HG13 A ILE A 1 41  ? 10.48400 6.71100   3.31800   0.760 18.73000 ?  45  ILE A HG13 1 
ATOM   340  H  HG13 B ILE A 1 41  ? 10.17000 9.83800   1.46900   0.240 16.21000 ?  45  ILE A HG13 1 
ATOM   341  H  HG21 A ILE A 1 41  ? 12.28500 9.68100   2.50100   0.760 18.17000 ?  45  ILE A HG21 1 
ATOM   342  H  HG21 B ILE A 1 41  ? 12.03900 7.27500   3.19600   0.240 15.55000 ?  45  ILE A HG21 1 
ATOM   343  H  HG22 A ILE A 1 41  ? 11.06800 10.69100  2.65200   0.760 18.17000 ?  45  ILE A HG22 1 
ATOM   344  H  HG22 B ILE A 1 41  ? 11.02100 7.17200   4.41100   0.240 15.55000 ?  45  ILE A HG22 1 
ATOM   345  H  HG23 A ILE A 1 41  ? 11.69200 10.00100  3.93900   0.760 18.17000 ?  45  ILE A HG23 1 
ATOM   346  H  HG23 B ILE A 1 41  ? 10.58500 6.67800   2.96500   0.240 15.55000 ?  45  ILE A HG23 1 
ATOM   347  H  HD11 A ILE A 1 41  ? 12.47500 6.02200   2.52400   0.760 19.90000 ?  45  ILE A HD11 1 
ATOM   348  H  HD11 B ILE A 1 41  ? 11.67900 9.01100   -0.01200  0.240 16.45000 ?  45  ILE A HD11 1 
ATOM   349  H  HD12 A ILE A 1 41  ? 11.85800 6.95300   1.39500   0.760 19.90000 ?  45  ILE A HD12 1 
ATOM   350  H  HD12 B ILE A 1 41  ? 12.46300 9.32300   1.33400   0.240 16.45000 ?  45  ILE A HD12 1 
ATOM   351  H  HD13 A ILE A 1 41  ? 12.99000 7.51600   2.35700   0.760 19.90000 ?  45  ILE A HD13 1 
ATOM   352  H  HD13 B ILE A 1 41  ? 12.06400 7.82800   0.97600   0.240 16.45000 ?  45  ILE A HD13 1 
ATOM   353  N  N    . GLY A 1 42  ? 8.71200  11.27300  4.16800   1.000 11.94880 ?  46  GLY A N    1 
ATOM   354  C  CA   . GLY A 1 42  ? 8.21500  12.59700  3.89100   1.000 11.61192 ?  46  GLY A CA   1 
ATOM   355  C  C    . GLY A 1 42  ? 9.35600  13.59100  3.88800   1.000 12.25410 ?  46  GLY A C    1 
ATOM   356  O  O    . GLY A 1 42  ? 10.19000 13.60000  4.80300   1.000 12.74890 ?  46  GLY A O    1 
ATOM   357  H  H    . GLY A 1 42  ? 9.11100  11.20400  4.92600   1.000 14.33000 ?  46  GLY A H    1 
ATOM   358  H  HA2  . GLY A 1 42  ? 7.78200  12.61100  3.02300   1.000 13.93000 ?  46  GLY A HA2  1 
ATOM   359  H  HA3  . GLY A 1 42  ? 7.57200  12.85600  4.57000   1.000 13.93000 ?  46  GLY A HA3  1 
ATOM   360  N  N    . VAL A 1 43  ? 9.41100  14.42700  2.85600   1.000 12.12514 ?  47  VAL A N    1 
ATOM   361  C  CA   . VAL A 1 43  ? 10.53800 15.32800  2.62200   1.000 12.49887 ?  47  VAL A CA   1 
ATOM   362  C  C    . VAL A 1 43  ? 10.01200 16.69500  2.22000   1.000 12.70415 ?  47  VAL A C    1 
ATOM   363  O  O    . VAL A 1 43  ? 9.12300  16.80900  1.37000   1.000 12.85680 ?  47  VAL A O    1 
ATOM   364  C  CB   . VAL A 1 43  ? 11.46400 14.80900  1.49600   1.000 13.23053 ?  47  VAL A CB   1 
ATOM   365  C  CG1  . VAL A 1 43  ? 12.58300 15.79600  1.19800   1.000 14.52016 ?  47  VAL A CG1  1 
ATOM   366  C  CG2  . VAL A 1 43  ? 11.99600 13.43900  1.84700   1.000 15.19393 ?  47  VAL A CG2  1 
ATOM   367  H  H    . VAL A 1 43  ? 8.79300  14.49300  2.26200   1.000 14.54000 ?  47  VAL A H    1 
ATOM   368  H  HA   . VAL A 1 43  ? 11.03400 15.40500  3.45200   1.000 15.00000 ?  47  VAL A HA   1 
ATOM   369  H  HB   . VAL A 1 43  ? 10.94800 14.72400  0.67800   1.000 15.87000 ?  47  VAL A HB   1 
ATOM   370  H  HG11 . VAL A 1 43  ? 13.26300 15.35200  0.66800   1.000 17.42000 ?  47  VAL A HG11 1 
ATOM   371  H  HG12 . VAL A 1 43  ? 12.21800 16.54800  0.70600   1.000 17.42000 ?  47  VAL A HG12 1 
ATOM   372  H  HG13 . VAL A 1 43  ? 12.96500 16.10300  2.03500   1.000 17.42000 ?  47  VAL A HG13 1 
ATOM   373  H  HG21 . VAL A 1 43  ? 12.59800 13.14500  1.14600   1.000 18.23000 ?  47  VAL A HG21 1 
ATOM   374  H  HG22 . VAL A 1 43  ? 12.47200 13.49100  2.69100   1.000 18.23000 ?  47  VAL A HG22 1 
ATOM   375  H  HG23 . VAL A 1 43  ? 11.25200 12.82200  1.92500   1.000 18.23000 ?  47  VAL A HG23 1 
ATOM   376  N  N    A TYR A 1 44  ? 10.55000 17.73700  2.84100   0.550 12.80153 ?  48  TYR A N    1 
ATOM   377  N  N    B TYR A 1 44  ? 10.59700 17.74700  2.78800   0.450 12.29095 ?  48  TYR A N    1 
ATOM   378  C  CA   A TYR A 1 44  ? 10.37800 19.09300  2.34800   0.550 13.19632 ?  48  TYR A CA   1 
ATOM   379  C  CA   B TYR A 1 44  ? 10.34500 19.09700  2.30000   0.450 12.44097 ?  48  TYR A CA   1 
ATOM   380  C  C    A TYR A 1 44  ? 11.74000 19.75000  2.43500   0.550 13.67796 ?  48  TYR A C    1 
ATOM   381  C  C    B TYR A 1 44  ? 11.61700 19.90300  2.47300   0.450 12.91997 ?  48  TYR A C    1 
ATOM   382  O  O    A TYR A 1 44  ? 12.43600 19.62200  3.44600   0.550 14.14643 ?  48  TYR A O    1 
ATOM   383  O  O    B TYR A 1 44  ? 12.09700 20.07300  3.59900   0.450 13.32528 ?  48  TYR A O    1 
ATOM   384  C  CB   A TYR A 1 44  ? 9.36200  19.88900  3.14900   0.550 13.75428 ?  48  TYR A CB   1 
ATOM   385  C  CB   B TYR A 1 44  ? 9.20400  19.76800  3.04300   0.450 12.41465 ?  48  TYR A CB   1 
ATOM   386  C  CG   A TYR A 1 44  ? 8.73200  21.02600  2.36800   0.550 14.32277 ?  48  TYR A CG   1 
ATOM   387  C  CG   B TYR A 1 44  ? 8.75300  21.08100  2.42900   0.450 12.55940 ?  48  TYR A CG   1 
ATOM   388  C  CD1  A TYR A 1 44  ? 7.85500  20.77500  1.31600   0.550 14.62807 ?  48  TYR A CD1  1 
ATOM   389  C  CD1  B TYR A 1 44  ? 7.88700  21.10200  1.34300   0.450 12.38833 ?  48  TYR A CD1  1 
ATOM   390  C  CD2  A TYR A 1 44  ? 9.00000  22.35400  2.68200   0.550 14.75440 ?  48  TYR A CD2  1 
ATOM   391  C  CD2  B TYR A 1 44  ? 9.18500  22.30000  2.94100   0.450 13.27528 ?  48  TYR A CD2  1 
ATOM   392  C  CE1  A TYR A 1 44  ? 7.26700  21.80600  0.60900   0.550 14.57017 ?  48  TYR A CE1  1 
ATOM   393  C  CE1  B TYR A 1 44  ? 7.44700  22.29000  0.79400   0.450 12.50939 ?  48  TYR A CE1  1 
ATOM   394  C  CE2  A TYR A 1 44  ? 8.41000  23.39400  1.97800   0.550 14.90179 ?  48  TYR A CE2  1 
ATOM   395  C  CE2  B TYR A 1 44  ? 8.75500  23.49700  2.39400   0.450 13.03577 ?  48  TYR A CE2  1 
ATOM   396  C  CZ   A TYR A 1 44  ? 7.54600  23.11300  0.94300   0.550 14.30961 ?  48  TYR A CZ   1 
ATOM   397  C  CZ   B TYR A 1 44  ? 7.88800  23.48700  1.31500   0.450 12.56730 ?  48  TYR A CZ   1 
ATOM   398  O  OH   A TYR A 1 44  ? 6.93200  24.13100  0.23800   0.550 15.12550 ?  48  TYR A OH   1 
ATOM   399  O  OH   B TYR A 1 44  ? 7.44400  24.67200  0.76700   0.450 13.73323 ?  48  TYR A OH   1 
ATOM   400  H  H    A TYR A 1 44  ? 11.02300 17.68200  3.55700   0.550 15.36000 ?  48  TYR A H    1 
ATOM   401  H  H    B TYR A 1 44  ? 11.14100 17.70300  3.45200   0.450 14.75000 ?  48  TYR A H    1 
ATOM   402  H  HA   A TYR A 1 44  ? 10.05600 19.08100  1.43400   0.550 15.83000 ?  48  TYR A HA   1 
ATOM   403  H  HA   B TYR A 1 44  ? 10.10900 19.05300  1.36000   0.450 14.93000 ?  48  TYR A HA   1 
ATOM   404  H  HB2  A TYR A 1 44  ? 8.65000  19.29300  3.43100   0.550 16.50000 ?  48  TYR A HB2  1 
ATOM   405  H  HB2  B TYR A 1 44  ? 8.44100  19.16900  3.04800   0.450 14.89000 ?  48  TYR A HB2  1 
ATOM   406  H  HB3  A TYR A 1 44  ? 9.80300  20.26900  3.92400   0.550 16.50000 ?  48  TYR A HB3  1 
ATOM   407  H  HB3  B TYR A 1 44  ? 9.48900  19.95100  3.95200   0.450 14.89000 ?  48  TYR A HB3  1 
ATOM   408  H  HD1  A TYR A 1 44  ? 7.66100  19.89500  1.08400   0.550 17.55000 ?  48  TYR A HD1  1 
ATOM   409  H  HD1  B TYR A 1 44  ? 7.59600  20.29700  0.97800   0.450 14.86000 ?  48  TYR A HD1  1 
ATOM   410  H  HD2  A TYR A 1 44  ? 9.58700  22.54800  3.37700   0.550 17.70000 ?  48  TYR A HD2  1 
ATOM   411  H  HD2  B TYR A 1 44  ? 9.77100  22.31100  3.66300   0.450 15.92000 ?  48  TYR A HD2  1 
ATOM   412  H  HE1  A TYR A 1 44  ? 6.68400  21.61800  -0.09000  0.550 17.48000 ?  48  TYR A HE1  1 
ATOM   413  H  HE1  B TYR A 1 44  ? 6.85600  22.28200  0.07600   0.450 15.01000 ?  48  TYR A HE1  1 
ATOM   414  H  HE2  A TYR A 1 44  ? 8.59700  24.27700  2.20400   0.550 17.88000 ?  48  TYR A HE2  1 
ATOM   415  H  HE2  B TYR A 1 44  ? 9.04900  24.30500  2.74900   0.450 15.64000 ?  48  TYR A HE2  1 
ATOM   416  H  HH   A TYR A 1 44  ? 6.32200  23.81700  -0.24700  0.550 18.15000 ?  48  TYR A HH   1 
ATOM   417  H  HH   B TYR A 1 44  ? 7.79000  25.32200  1.17000   0.450 16.48000 ?  48  TYR A HH   1 
ATOM   418  N  N    . ALA A 1 45  ? 12.14100 20.40600  1.36200   1.000 13.55689 ?  49  ALA A N    1 
ATOM   419  C  CA   . ALA A 1 45  ? 13.40200 21.12700  1.33800   1.000 14.01747 ?  49  ALA A CA   1 
ATOM   420  C  C    . ALA A 1 45  ? 13.19200 22.42800  0.59100   1.000 14.27013 ?  49  ALA A C    1 
ATOM   421  O  O    . ALA A 1 45  ? 12.58500 22.44300  -0.48400  1.000 15.75189 ?  49  ALA A O    1 
ATOM   422  C  CB   . ALA A 1 45  ? 14.48500 20.31200  0.65400   1.000 14.24118 ?  49  ALA A CB   1 
ATOM   423  H  H    A ALA A 1 45  ? 11.69700 20.45000  0.62700   0.550 16.27000 ?  49  ALA A H    1 
ATOM   424  H  H    B ALA A 1 45  ? 11.77200 20.34000  0.58800   0.450 16.27000 ?  49  ALA A H    1 
ATOM   425  H  HA   . ALA A 1 45  ? 13.69600 21.32400  2.24100   1.000 16.82000 ?  49  ALA A HA   1 
ATOM   426  H  HB1  . ALA A 1 45  ? 15.31600 20.81200  0.67300   1.000 17.09000 ?  49  ALA A HB1  1 
ATOM   427  H  HB2  . ALA A 1 45  ? 14.59400 19.47200  1.12700   1.000 17.09000 ?  49  ALA A HB2  1 
ATOM   428  H  HB3  . ALA A 1 45  ? 14.22100 20.14300  -0.26400  1.000 17.09000 ?  49  ALA A HB3  1 
ATOM   429  N  N    . MET A 1 46  ? 13.74300 23.50300  1.14300   1.000 15.06760 ?  50  MET A N    1 
ATOM   430  C  CA   . MET A 1 46  ? 13.57800 24.85300  0.62200   1.000 17.02046 ?  50  MET A CA   1 
ATOM   431  C  C    . MET A 1 46  ? 14.94300 25.47400  0.35800   1.000 16.50461 ?  50  MET A C    1 
ATOM   432  O  O    . MET A 1 46  ? 15.79400 25.53200  1.25900   1.000 15.73610 ?  50  MET A O    1 
ATOM   433  C  CB   . MET A 1 46  ? 12.84600 25.70300  1.65100   1.000 20.00766 ?  50  MET A CB   1 
ATOM   434  C  CG   . MET A 1 46  ? 12.83100 27.18800  1.38000   1.000 24.83719 ?  50  MET A CG   1 
ATOM   435  S  SD   . MET A 1 46  ? 11.82300 27.67100  -0.01300  1.000 29.54038 ?  50  MET A SD   1 
ATOM   436  C  CE   . MET A 1 46  ? 10.19500 27.52500  0.69200   1.000 30.10098 ?  50  MET A CE   1 
ATOM   437  H  H    . MET A 1 46  ? 14.23500 23.47400  1.84800   1.000 18.08000 ?  50  MET A H    1 
ATOM   438  H  HA   . MET A 1 46  ? 13.07900 24.82100  -0.20900  1.000 20.42000 ?  50  MET A HA   1 
ATOM   439  H  HB2  . MET A 1 46  ? 11.92200 25.40800  1.68800   1.000 24.01000 ?  50  MET A HB2  1 
ATOM   440  H  HB3  . MET A 1 46  ? 13.27100 25.57200  2.51300   1.000 24.01000 ?  50  MET A HB3  1 
ATOM   441  H  HG2  . MET A 1 46  ? 12.48500 27.64300  2.16400   1.000 29.80000 ?  50  MET A HG2  1 
ATOM   442  H  HG3  . MET A 1 46  ? 13.73800 27.48000  1.20100   1.000 29.80000 ?  50  MET A HG3  1 
ATOM   443  H  HE1  . MET A 1 46  ? 9.54600  27.88000  0.06400   1.000 36.12000 ?  50  MET A HE1  1 
ATOM   444  H  HE2  . MET A 1 46  ? 10.00800 26.58900  0.86500   1.000 36.12000 ?  50  MET A HE2  1 
ATOM   445  H  HE3  . MET A 1 46  ? 10.16300 28.02800  1.52100   1.000 36.12000 ?  50  MET A HE3  1 
ATOM   446  N  N    . ASP A 1 47  ? 15.13500 25.95600  -0.87300  1.000 16.69937 ?  51  ASP A N    1 
ATOM   447  C  CA   . ASP A 1 47  ? 16.26400 26.82300  -1.20000  1.000 16.83360 ?  51  ASP A CA   1 
ATOM   448  C  C    . ASP A 1 47  ? 15.83100 28.23700  -0.84400  1.000 16.55988 ?  51  ASP A C    1 
ATOM   449  O  O    . ASP A 1 47  ? 14.95900 28.80700  -1.50300  1.000 17.71265 ?  51  ASP A O    1 
ATOM   450  C  CB   . ASP A 1 47  ? 16.59900 26.70400  -2.68300  1.000 18.62065 ?  51  ASP A CB   1 
ATOM   451  C  CG   . ASP A 1 47  ? 17.80800 27.52200  -3.07900  1.000 20.92883 ?  51  ASP A CG   1 
ATOM   452  O  OD1  . ASP A 1 47  ? 18.15100 28.48100  -2.36300  1.000 20.92619 ?  51  ASP A OD1  1 
ATOM   453  O  OD2  . ASP A 1 47  ? 18.40700 27.20700  -4.12700  1.000 22.67377 -1 51  ASP A OD2  1 
ATOM   454  H  H    A ASP A 1 47  ? 14.61800 25.79200  -1.54100  0.490 20.03000 ?  51  ASP A H    1 
ATOM   455  H  H    B ASP A 1 47  ? 14.61800 25.79200  -1.54100  0.510 20.03000 ?  51  ASP A H    1 
ATOM   456  H  HA   . ASP A 1 47  ? 17.05800 26.58000  -0.69900  1.000 20.20000 ?  51  ASP A HA   1 
ATOM   457  H  HB2  . ASP A 1 47  ? 16.78400 25.77500  -2.89100  1.000 22.34000 ?  51  ASP A HB2  1 
ATOM   458  H  HB3  . ASP A 1 47  ? 15.84200 27.01700  -3.20300  1.000 22.34000 ?  51  ASP A HB3  1 
ATOM   459  N  N    . THR A 1 48  ? 16.41500 28.80400  0.21100   1.000 16.23616 ?  52  THR A N    1 
ATOM   460  C  CA   . THR A 1 48  ? 15.96700 30.10900  0.68500   1.000 17.80740 ?  52  THR A CA   1 
ATOM   461  C  C    . THR A 1 48  ? 16.39900 31.24800  -0.22500  1.000 19.90502 ?  52  THR A C    1 
ATOM   462  O  O    . THR A 1 48  ? 15.95200 32.37700  -0.01800  1.000 22.09475 ?  52  THR A O    1 
ATOM   463  C  CB   . THR A 1 48  ? 16.41100 30.38000  2.13000   1.000 18.24429 ?  52  THR A CB   1 
ATOM   464  O  OG1  . THR A 1 48  ? 17.83400 30.54100  2.16700   1.000 18.32588 ?  52  THR A OG1  1 
ATOM   465  C  CG2  . THR A 1 48  ? 15.96700 29.25300  3.03900   1.000 17.79424 ?  52  THR A CG2  1 
ATOM   466  H  H    . THR A 1 48  ? 17.06200 28.45900  0.66100   1.000 19.48000 ?  52  THR A H    1 
ATOM   467  H  HA   . THR A 1 48  ? 14.99700 30.09300  0.70300   1.000 21.37000 ?  52  THR A HA   1 
ATOM   468  H  HB   . THR A 1 48  ? 16.00300 31.19400  2.46200   1.000 21.89000 ?  52  THR A HB   1 
ATOM   469  H  HG1  . THR A 1 48  ? 18.21000 29.80900  1.99700   1.000 21.99000 ?  52  THR A HG1  1 
ATOM   470  H  HG21 . THR A 1 48  ? 16.20900 29.45100  3.95700   1.000 21.35000 ?  52  THR A HG21 1 
ATOM   471  H  HG22 . THR A 1 48  ? 15.00500 29.14200  2.98400   1.000 21.35000 ?  52  THR A HG22 1 
ATOM   472  H  HG23 . THR A 1 48  ? 16.39400 28.42400  2.77300   1.000 21.35000 ?  52  THR A HG23 1 
ATOM   473  N  N    . GLY A 1 49  ? 17.23800 30.99200  -1.21800  1.000 20.21821 ?  53  GLY A N    1 
ATOM   474  C  CA   . GLY A 1 49  ? 17.59500 32.02800  -2.15800  1.000 21.79735 ?  53  GLY A CA   1 
ATOM   475  C  C    . GLY A 1 49  ? 16.51200 32.23500  -3.19300  1.000 24.29502 ?  53  GLY A C    1 
ATOM   476  O  O    . GLY A 1 49  ? 15.97900 33.34100  -3.34500  1.000 26.86112 ?  53  GLY A O    1 
ATOM   477  H  H    . GLY A 1 49  ? 17.60900 30.23000  -1.36400  1.000 24.25000 ?  53  GLY A H    1 
ATOM   478  H  HA2  . GLY A 1 49  ? 17.73300 32.86200  -1.68400  1.000 26.15000 ?  53  GLY A HA2  1 
ATOM   479  H  HA3  . GLY A 1 49  ? 18.41600 31.78300  -2.61400  1.000 26.15000 ?  53  GLY A HA3  1 
ATOM   480  N  N    . SER A 1 50  ? 16.14800 31.16800  -3.89200  1.000 24.87930 ?  54  SER A N    1 
ATOM   481  C  CA   . SER A 1 50  ? 15.20000 31.25500  -4.98900  1.000 25.05300 ?  54  SER A CA   1 
ATOM   482  C  C    . SER A 1 50  ? 13.76900 30.95400  -4.57400  1.000 25.62149 ?  54  SER A C    1 
ATOM   483  O  O    . SER A 1 50  ? 12.83100 31.33800  -5.29300  1.000 26.61898 ?  54  SER A O    1 
ATOM   484  C  CB   . SER A 1 50  ? 15.58500 30.22300  -6.04300  1.000 25.29777 ?  54  SER A CB   1 
ATOM   485  O  OG   . SER A 1 50  ? 15.47400 28.92200  -5.47900  1.000 24.62137 ?  54  SER A OG   1 
ATOM   486  H  H    . SER A 1 50  ? 16.44100 30.37300  -3.74700  1.000 29.85000 ?  54  SER A H    1 
ATOM   487  H  HA   . SER A 1 50  ? 15.23100 32.15100  -5.35800  1.000 30.06000 ?  54  SER A HA   1 
ATOM   488  H  HB2  . SER A 1 50  ? 14.98700 30.29800  -6.80300  1.000 30.35000 ?  54  SER A HB2  1 
ATOM   489  H  HB3  . SER A 1 50  ? 16.50100 30.37500  -6.32500  1.000 30.35000 ?  54  SER A HB3  1 
ATOM   490  H  HG   . SER A 1 50  ? 15.70700 28.34300  -6.04100  1.000 29.54000 ?  54  SER A HG   1 
ATOM   491  N  N    . GLY A 1 51  ? 13.58300 30.25500  -3.45800  1.000 24.92930 ?  55  GLY A N    1 
ATOM   492  C  CA   . GLY A 1 51  ? 12.28600 29.76000  -3.06700  1.000 24.82140 ?  55  GLY A CA   1 
ATOM   493  C  C    . GLY A 1 51  ? 11.91600 28.43400  -3.68100  1.000 23.04224 ?  55  GLY A C    1 
ATOM   494  O  O    . GLY A 1 51  ? 10.80600 27.94200  -3.43400  1.000 22.58429 ?  55  GLY A O    1 
ATOM   495  H  H    . GLY A 1 51  ? 14.21100 30.05500  -2.90500  1.000 29.91000 ?  55  GLY A H    1 
ATOM   496  H  HA2  . GLY A 1 51  ? 12.26800 29.65700  -2.10300  1.000 29.78000 ?  55  GLY A HA2  1 
ATOM   497  H  HA3  . GLY A 1 51  ? 11.61300 30.40800  -3.32800  1.000 29.78000 ?  55  GLY A HA3  1 
ATOM   498  N  N    . ALA A 1 52  ? 12.80400 27.83400  -4.47000  1.000 21.31308 ?  56  ALA A N    1 
ATOM   499  C  CA   . ALA A 1 52  ? 12.52400 26.52200  -5.02400  1.000 20.63932 ?  56  ALA A CA   1 
ATOM   500  C  C    . ALA A 1 52  ? 12.44200 25.49400  -3.90600  1.000 18.41537 ?  56  ALA A C    1 
ATOM   501  O  O    . ALA A 1 52  ? 13.11400 25.60200  -2.87400  1.000 17.48894 ?  56  ALA A O    1 
ATOM   502  C  CB   . ALA A 1 52  ? 13.63300 26.12400  -5.98500  1.000 21.69734 ?  56  ALA A CB   1 
ATOM   503  H  H    . ALA A 1 52  ? 13.56600 28.16500  -4.69500  1.000 25.57000 ?  56  ALA A H    1 
ATOM   504  H  HA   . ALA A 1 52  ? 11.68100 26.53900  -5.50300  1.000 24.76000 ?  56  ALA A HA   1 
ATOM   505  H  HB1  . ALA A 1 52  ? 13.42600 25.25500  -6.36300  1.000 26.04000 ?  56  ALA A HB1  1 
ATOM   506  H  HB2  . ALA A 1 52  ? 13.69100 26.78600  -6.69100  1.000 26.04000 ?  56  ALA A HB2  1 
ATOM   507  H  HB3  . ALA A 1 52  ? 14.47200 26.08300  -5.50000  1.000 26.04000 ?  56  ALA A HB3  1 
ATOM   508  N  N    . THR A 1 53  ? 11.61300 24.47900  -4.13500  1.000 17.37840 ?  57  THR A N    1 
ATOM   509  C  CA   . THR A 1 53  ? 11.37700 23.45800  -3.12800  1.000 16.89150 ?  57  THR A CA   1 
ATOM   510  C  C    . THR A 1 53  ? 11.38900 22.07100  -3.75500  1.000 16.43881 ?  57  THR A C    1 
ATOM   511  O  O    . THR A 1 53  ? 11.10400 21.88800  -4.94700  1.000 17.39682 ?  57  THR A O    1 
ATOM   512  C  CB   . THR A 1 53  ? 10.04700 23.67400  -2.36200  1.000 18.40484 ?  57  THR A CB   1 
ATOM   513  O  OG1  . THR A 1 53  ? 8.96000  23.70900  -3.29500  1.000 20.31296 ?  57  THR A OG1  1 
ATOM   514  C  CG2  . THR A 1 53  ? 10.07000 24.96000  -1.56100  1.000 19.05228 ?  57  THR A CG2  1 
ATOM   515  H  H    . THR A 1 53  ? 11.17700 24.36300  -4.86700  1.000 20.85000 ?  57  THR A H    1 
ATOM   516  H  HA   . THR A 1 53  ? 12.10800 23.50100  -2.49200  1.000 20.26000 ?  57  THR A HA   1 
ATOM   517  H  HB   . THR A 1 53  ? 9.92000  22.94300  -1.73700  1.000 22.08000 ?  57  THR A HB   1 
ATOM   518  H  HG1  . THR A 1 53  ? 9.03800  24.37400  -3.80300  1.000 24.38000 ?  57  THR A HG1  1 
ATOM   519  H  HG21 . THR A 1 53  ? 9.22600  25.07800  -1.09800  1.000 22.86000 ?  57  THR A HG21 1 
ATOM   520  H  HG22 . THR A 1 53  ? 10.78600 24.93000  -0.90600  1.000 22.86000 ?  57  THR A HG22 1 
ATOM   521  H  HG23 . THR A 1 53  ? 10.21400 25.71600  -2.15100  1.000 22.86000 ?  57  THR A HG23 1 
ATOM   522  N  N    . VAL A 1 54  ? 11.69400 21.09500  -2.90000  1.000 16.00981 ?  58  VAL A N    1 
ATOM   523  C  CA   . VAL A 1 54  ? 11.48000 19.67600  -3.15300  1.000 15.10181 ?  58  VAL A CA   1 
ATOM   524  C  C    . VAL A 1 54  ? 10.48100 19.19100  -2.11400  1.000 14.86494 ?  58  VAL A C    1 
ATOM   525  O  O    . VAL A 1 54  ? 10.62800 19.48900  -0.92200  1.000 15.15971 ?  58  VAL A O    1 
ATOM   526  C  CB   . VAL A 1 54  ? 12.80300 18.89900  -3.06800  1.000 15.92296 ?  58  VAL A CB   1 
ATOM   527  C  CG1  . VAL A 1 54  ? 12.55100 17.39600  -3.03800  1.000 16.66779 ?  58  VAL A CG1  1 
ATOM   528  C  CG2  . VAL A 1 54  ? 13.72500 19.25800  -4.22800  1.000 16.60199 ?  58  VAL A CG2  1 
ATOM   529  H  H    A VAL A 1 54  ? 12.04400 21.24100  -2.12800  0.180 19.21000 ?  58  VAL A H    1 
ATOM   530  H  H    C VAL A 1 54  ? 12.04400 21.24300  -2.12900  0.820 19.21000 ?  58  VAL A H    1 
ATOM   531  H  HA   . VAL A 1 54  ? 11.10600 19.53200  -4.03600  1.000 18.12000 ?  58  VAL A HA   1 
ATOM   532  H  HB   . VAL A 1 54  ? 13.24600 19.14800  -2.24200  1.000 19.11000 ?  58  VAL A HB   1 
ATOM   533  H  HG11 . VAL A 1 54  ? 13.37800 16.93300  -3.24600  1.000 20.00000 ?  58  VAL A HG11 1 
ATOM   534  H  HG12 . VAL A 1 54  ? 12.24400 17.14500  -2.15300  1.000 20.00000 ?  58  VAL A HG12 1 
ATOM   535  H  HG13 . VAL A 1 54  ? 11.87500 17.17700  -3.69800  1.000 20.00000 ?  58  VAL A HG13 1 
ATOM   536  H  HG21 . VAL A 1 54  ? 14.55200 18.75900  -4.14100  1.000 19.92000 ?  58  VAL A HG21 1 
ATOM   537  H  HG22 . VAL A 1 54  ? 13.28600 19.02900  -5.06300  1.000 19.92000 ?  58  VAL A HG22 1 
ATOM   538  H  HG23 . VAL A 1 54  ? 13.90900 20.21000  -4.20200  1.000 19.92000 ?  58  VAL A HG23 1 
ATOM   539  N  N    A SER A 1 55  ? 9.48900  18.42800  -2.56500  0.730 13.84903 ?  59  SER A N    1 
ATOM   540  N  N    B SER A 1 55  ? 9.43100  18.50600  -2.56700  0.270 14.63860 ?  59  SER A N    1 
ATOM   541  C  CA   A SER A 1 55  ? 8.36100  18.08500  -1.71500  0.730 13.63585 ?  59  SER A CA   1 
ATOM   542  C  CA   B SER A 1 55  ? 8.36600  18.09100  -1.66300  0.270 14.80704 ?  59  SER A CA   1 
ATOM   543  C  C    A SER A 1 55  ? 7.85500  16.69600  -2.05700  0.730 13.34107 ?  59  SER A C    1 
ATOM   544  C  C    B SER A 1 55  ? 7.84900  16.71400  -2.04000  0.270 14.25960 ?  59  SER A C    1 
ATOM   545  O  O    A SER A 1 55  ? 7.50800  16.42900  -3.21100  0.730 14.77282 ?  59  SER A O    1 
ATOM   546  O  O    B SER A 1 55  ? 7.49300  16.47200  -3.19700  0.270 14.74387 ?  59  SER A O    1 
ATOM   547  C  CB   A SER A 1 55  ? 7.26500  19.12000  -1.95800  0.730 14.35172 ?  59  SER A CB   1 
ATOM   548  C  CB   B SER A 1 55  ? 7.20500  19.10800  -1.66200  0.270 15.63872 ?  59  SER A CB   1 
ATOM   549  O  OG   A SER A 1 55  ? 6.14200  18.85100  -1.16900  0.730 13.92272 ?  59  SER A OG   1 
ATOM   550  O  OG   B SER A 1 55  ? 6.55900  19.17300  -2.91600  0.270 16.51777 ?  59  SER A OG   1 
ATOM   551  H  H    A SER A 1 55  ? 9.44900  18.10000  -3.35800  0.730 16.61000 ?  59  SER A H    1 
ATOM   552  H  H    B SER A 1 55  ? 9.31500  18.27500  -3.38700  0.270 17.57000 ?  59  SER A H    1 
ATOM   553  H  HA   A SER A 1 55  ? 8.63000  18.06300  -0.78300  0.730 16.36000 ?  59  SER A HA   1 
ATOM   554  H  HA   B SER A 1 55  ? 8.73400  18.02700  -0.76800  0.270 17.76000 ?  59  SER A HA   1 
ATOM   555  H  HB2  A SER A 1 55  ? 7.60600  20.00000  -1.73300  0.730 17.22000 ?  59  SER A HB2  1 
ATOM   556  H  HB2  B SER A 1 55  ? 6.55700  18.83900  -0.99100  0.270 18.76000 ?  59  SER A HB2  1 
ATOM   557  H  HB3  A SER A 1 55  ? 7.00700  19.09400  -2.89300  0.730 17.22000 ?  59  SER A HB3  1 
ATOM   558  H  HB3  B SER A 1 55  ? 7.56000  19.98500  -1.44800  0.270 18.76000 ?  59  SER A HB3  1 
ATOM   559  H  HG   A SER A 1 55  ? 6.07800  19.42100  -0.55500  0.730 16.70000 ?  59  SER A HG   1 
ATOM   560  H  HG   B SER A 1 55  ? 5.92800  19.72700  -2.88600  0.270 19.82000 ?  59  SER A HG   1 
ATOM   561  N  N    . TYR A 1 56  ? 7.80700  15.82200  -1.05200  1.000 13.88061 ?  60  TYR A N    1 
ATOM   562  C  CA   . TYR A 1 56  ? 7.32000  14.45800  -1.22500  1.000 13.28580 ?  60  TYR A CA   1 
ATOM   563  C  C    . TYR A 1 56  ? 6.61900  14.05300  0.06400   1.000 13.17000 ?  60  TYR A C    1 
ATOM   564  O  O    . TYR A 1 56  ? 7.24500  14.04800  1.11800   1.000 12.89628 ?  60  TYR A O    1 
ATOM   565  C  CB   . TYR A 1 56  ? 8.48100  13.49700  -1.55800  1.000 13.95957 ?  60  TYR A CB   1 
ATOM   566  C  CG   . TYR A 1 56  ? 7.98100  12.11200  -1.87700  1.000 13.82271 ?  60  TYR A CG   1 
ATOM   567  C  CD1  . TYR A 1 56  ? 7.48900  11.80700  -3.13800  1.000 15.08339 ?  60  TYR A CD1  1 
ATOM   568  C  CD2  . TYR A 1 56  ? 7.94900  11.12600  -0.91300  1.000 14.11748 ?  60  TYR A CD2  1 
ATOM   569  C  CE1  . TYR A 1 56  ? 6.99900  10.54500  -3.43800  1.000 15.36500 ?  60  TYR A CE1  1 
ATOM   570  C  CE2  . TYR A 1 56  ? 7.45000  9.85400   -1.18400  1.000 14.41752 ?  60  TYR A CE2  1 
ATOM   571  C  CZ   . TYR A 1 56  ? 6.97800  9.56700   -2.46200  1.000 15.90454 ?  60  TYR A CZ   1 
ATOM   572  O  OH   . TYR A 1 56  ? 6.44900  8.33300   -2.78300  1.000 17.66791 ?  60  TYR A OH   1 
ATOM   573  H  H    A TYR A 1 56  ? 8.05500  16.00000  -0.24800  0.730 16.66000 ?  60  TYR A H    1 
ATOM   574  H  H    B TYR A 1 56  ? 8.06300  15.98900  -0.24800  0.270 16.66000 ?  60  TYR A H    1 
ATOM   575  H  HA   . TYR A 1 56  ? 6.68100  14.41600  -1.95300  1.000 15.94000 ?  60  TYR A HA   1 
ATOM   576  H  HB2  . TYR A 1 56  ? 8.96300  13.83300  -2.33000  1.000 16.75000 ?  60  TYR A HB2  1 
ATOM   577  H  HB3  . TYR A 1 56  ? 9.07600  13.43800  -0.79500  1.000 16.75000 ?  60  TYR A HB3  1 
ATOM   578  H  HD1  . TYR A 1 56  ? 7.48800  12.46300  -3.79600  1.000 18.09000 ?  60  TYR A HD1  1 
ATOM   579  H  HD2  . TYR A 1 56  ? 8.27000  11.31500  -0.06100  1.000 16.94000 ?  60  TYR A HD2  1 
ATOM   580  H  HE1  . TYR A 1 56  ? 6.68600  10.35700  -4.29300  1.000 18.43000 ?  60  TYR A HE1  1 
ATOM   581  H  HE2  . TYR A 1 56  ? 7.43200  9.20500   -0.51900  1.000 17.30000 ?  60  TYR A HE2  1 
ATOM   582  H  HH   . TYR A 1 56  ? 6.27300  7.90500   -2.08200  1.000 21.20000 ?  60  TYR A HH   1 
ATOM   583  N  N    . ARG A 1 57  ? 5.31900  13.75900  -0.01500  1.000 12.71995 ?  61  ARG A N    1 
ATOM   584  C  CA   . ARG A 1 57  ? 4.51000  13.48600  1.17400   1.000 12.37254 ?  61  ARG A CA   1 
ATOM   585  C  C    . ARG A 1 57  ? 4.66200  14.58900  2.21100   1.000 12.42254 ?  61  ARG A C    1 
ATOM   586  O  O    . ARG A 1 57  ? 4.57600  14.34500  3.42300   1.000 12.93050 ?  61  ARG A O    1 
ATOM   587  C  CB   . ARG A 1 57  ? 4.81700  12.12100  1.79400   1.000 12.94892 ?  61  ARG A CB   1 
ATOM   588  C  CG   . ARG A 1 57  ? 4.57800  10.93300  0.91000   1.000 13.52531 ?  61  ARG A CG   1 
ATOM   589  C  CD   . ARG A 1 57  ? 4.68500  9.64700   1.72600   1.000 14.03326 ?  61  ARG A CD   1 
ATOM   590  N  NE   . ARG A 1 57  ? 4.60000  8.44500   0.90300   1.000 14.75703 ?  61  ARG A NE   1 
ATOM   591  C  CZ   . ARG A 1 57  ? 3.47200  7.93400   0.43400   1.000 16.26248 ?  61  ARG A CZ   1 
ATOM   592  N  NH1  . ARG A 1 57  ? 2.30300  8.45600   0.75400   1.000 16.76254 ?  61  ARG A NH1  1 
ATOM   593  N  NH2  . ARG A 1 57  ? 3.52700  6.88500   -0.37800  1.000 17.43367 ?  61  ARG A NH2  1 
ATOM   594  H  H    . ARG A 1 57  ? 4.87900  13.71100  -0.75200  1.000 15.26000 ?  61  ARG A H    1 
ATOM   595  H  HA   . ARG A 1 57  ? 3.58300  13.46400  0.89000   1.000 14.85000 ?  61  ARG A HA   1 
ATOM   596  H  HB2  . ARG A 1 57  ? 5.75400  12.10600  2.04700   1.000 15.53000 ?  61  ARG A HB2  1 
ATOM   597  H  HB3  . ARG A 1 57  ? 4.25900  12.01100  2.57900   1.000 15.53000 ?  61  ARG A HB3  1 
ATOM   598  H  HG2  . ARG A 1 57  ? 3.68800  10.98500  0.52600   1.000 16.23000 ?  61  ARG A HG2  1 
ATOM   599  H  HG3  . ARG A 1 57  ? 5.24300  10.91100  0.20400   1.000 16.23000 ?  61  ARG A HG3  1 
ATOM   600  H  HD2  . ARG A 1 57  ? 5.54000  9.63500   2.18600   1.000 16.84000 ?  61  ARG A HD2  1 
ATOM   601  H  HD3  . ARG A 1 57  ? 3.96100  9.62000   2.37100   1.000 16.84000 ?  61  ARG A HD3  1 
ATOM   602  H  HE   . ARG A 1 57  ? 5.33300  8.04000   0.70900   1.000 17.71000 ?  61  ARG A HE   1 
ATOM   603  H  HH11 . ARG A 1 57  ? 2.26400  9.13900   1.27500   1.000 20.11000 ?  61  ARG A HH11 1 
ATOM   604  H  HH12 . ARG A 1 57  ? 1.57900  8.11300   0.44100   1.000 20.11000 ?  61  ARG A HH12 1 
ATOM   605  H  HH21 . ARG A 1 57  ? 4.28800  6.54700   -0.59300  1.000 20.92000 ?  61  ARG A HH21 1 
ATOM   606  H  HH22 . ARG A 1 57  ? 2.80200  6.54400   -0.68900  1.000 20.92000 ?  61  ARG A HH22 1 
ATOM   607  N  N    . ALA A 1 58  ? 4.83300  15.82500  1.75300   1.000 12.49097 ?  62  ALA A N    1 
ATOM   608  C  CA   . ALA A 1 58  ? 5.28700  16.89200  2.64200   1.000 12.93050 ?  62  ALA A CA   1 
ATOM   609  C  C    . ALA A 1 58  ? 4.22300  17.40100  3.59900   1.000 12.67784 ?  62  ALA A C    1 
ATOM   610  O  O    . ALA A 1 58  ? 4.56800  18.01100  4.61300   1.000 12.46728 ?  62  ALA A O    1 
ATOM   611  C  CB   . ALA A 1 58  ? 5.82100  18.07700  1.84300   1.000 13.53583 ?  62  ALA A CB   1 
ATOM   612  H  H    . ALA A 1 58  ? 4.69600  16.07000  0.94000   1.000 14.98000 ?  62  ALA A H    1 
ATOM   613  H  HA   . ALA A 1 58  ? 6.01000  16.52100  3.17200   1.000 15.51000 ?  62  ALA A HA   1 
ATOM   614  H  HB1  . ALA A 1 58  ? 6.13900  18.75500  2.45900   1.000 16.24000 ?  62  ALA A HB1  1 
ATOM   615  H  HB2  . ALA A 1 58  ? 6.54900  17.77400  1.27800   1.000 16.24000 ?  62  ALA A HB2  1 
ATOM   616  H  HB3  . ALA A 1 58  ? 5.10500  18.43600  1.29500   1.000 16.24000 ?  62  ALA A HB3  1 
ATOM   617  N  N    . GLU A 1 59  ? 2.95400  17.16800  3.29100   1.000 12.71205 ?  63  GLU A N    1 
ATOM   618  C  CA   . GLU A 1 59  ? 1.85300  17.60100  4.13500   1.000 12.81206 ?  63  GLU A CA   1 
ATOM   619  C  C    . GLU A 1 59  ? 1.24500  16.45300  4.92200   1.000 12.99893 ?  63  GLU A C    1 
ATOM   620  O  O    . GLU A 1 59  ? 0.24600  16.65700  5.61900   1.000 15.60187 ?  63  GLU A O    1 
ATOM   621  C  CB   . GLU A 1 59  ? 0.80700  18.38300  3.34000   1.000 14.15959 ?  63  GLU A CB   1 
ATOM   622  C  CG   . GLU A 1 59  ? 1.35800  19.65700  2.68500   1.000 14.67281 ?  63  GLU A CG   1 
ATOM   623  C  CD   . GLU A 1 59  ? 2.02400  19.42000  1.34900   1.000 14.42541 ?  63  GLU A CD   1 
ATOM   624  O  OE1  . GLU A 1 59  ? 1.74800  18.36000  0.73100   1.000 15.00706 ?  63  GLU A OE1  1 
ATOM   625  O  OE2  . GLU A 1 59  ? 2.76200  20.31900  0.86800   1.000 15.13339 -1 63  GLU A OE2  1 
ATOM   626  H  H    . GLU A 1 59  ? 2.70200  16.75100  2.58200   1.000 15.25000 ?  63  GLU A H    1 
ATOM   627  H  HA   . GLU A 1 59  ? 2.19600  18.23400  4.78600   1.000 15.37000 ?  63  GLU A HA   1 
ATOM   628  H  HB2  . GLU A 1 59  ? 0.46000  17.81400  2.63600   1.000 16.99000 ?  63  GLU A HB2  1 
ATOM   629  H  HB3  . GLU A 1 59  ? 0.09000  18.64400  3.94000   1.000 16.99000 ?  63  GLU A HB3  1 
ATOM   630  H  HG2  . GLU A 1 59  ? 0.62500  20.27600  2.54400   1.000 17.60000 ?  63  GLU A HG2  1 
ATOM   631  H  HG3  . GLU A 1 59  ? 2.01700  20.05200  3.27700   1.000 17.60000 ?  63  GLU A HG3  1 
ATOM   632  N  N    . GLU A 1 60  ? 1.81900  15.25900  4.85500   1.000 12.36990 ?  64  GLU A N    1 
ATOM   633  C  CA   . GLU A 1 60  ? 1.37900  14.17800  5.71800   1.000 12.49360 ?  64  GLU A CA   1 
ATOM   634  C  C    . GLU A 1 60  ? 1.94000  14.36500  7.12000   1.000 12.72784 ?  64  GLU A C    1 
ATOM   635  O  O    . GLU A 1 60  ? 3.01500  14.94700  7.31400   1.000 12.94103 ?  64  GLU A O    1 
ATOM   636  C  CB   . GLU A 1 60  ? 1.83600  12.81100  5.21600   1.000 13.45688 ?  64  GLU A CB   1 
ATOM   637  C  CG   . GLU A 1 60  ? 1.24900  12.41500  3.88400   1.000 14.50963 ?  64  GLU A CG   1 
ATOM   638  C  CD   . GLU A 1 60  ? 1.59500  11.00500  3.47500   1.000 14.15170 ?  64  GLU A CD   1 
ATOM   639  O  OE1  . GLU A 1 60  ? 1.85200  10.13200  4.34600   1.000 17.44946 ?  64  GLU A OE1  1 
ATOM   640  O  OE2  . GLU A 1 60  ? 1.59500  10.72500  2.26700   1.000 13.85429 -1 64  GLU A OE2  1 
ATOM   641  H  H    . GLU A 1 60  ? 2.46100  15.05200  4.32100   1.000 14.84000 ?  64  GLU A H    1 
ATOM   642  H  HA   . GLU A 1 60  ? 0.41000  14.18700  5.73200   1.000 14.99000 ?  64  GLU A HA   1 
ATOM   643  H  HB2  . GLU A 1 60  ? 2.80100  12.82100  5.12200   1.000 16.15000 ?  64  GLU A HB2  1 
ATOM   644  H  HB3  . GLU A 1 60  ? 1.57300  12.13900  5.86500   1.000 16.15000 ?  64  GLU A HB3  1 
ATOM   645  H  HG2  . GLU A 1 60  ? 0.28200  12.48200  3.93400   1.000 17.41000 ?  64  GLU A HG2  1 
ATOM   646  H  HG3  . GLU A 1 60  ? 1.58800  13.01500  3.20100   1.000 17.41000 ?  64  GLU A HG3  1 
ATOM   647  N  N    . ARG A 1 61  ? 1.22000  13.83100  8.10100   1.000 12.54361 ?  65  ARG A N    1 
ATOM   648  C  CA   . ARG A 1 61  ? 1.71200  13.85200  9.47300   1.000 12.36727 ?  65  ARG A CA   1 
ATOM   649  C  C    . ARG A 1 61  ? 2.64200  12.68300  9.74000   1.000 11.66456 ?  65  ARG A C    1 
ATOM   650  O  O    . ARG A 1 61  ? 2.39700  11.55300  9.30000   1.000 12.54887 ?  65  ARG A O    1 
ATOM   651  C  CB   . ARG A 1 61  ? 0.54700  13.82100  10.45900  1.000 12.62783 ?  65  ARG A CB   1 
ATOM   652  C  CG   . ARG A 1 61  ? -0.18900 15.12300  10.50600  1.000 13.03314 ?  65  ARG A CG   1 
ATOM   653  C  CD   . ARG A 1 61  ? -1.30900 15.12700  11.56000  1.000 13.27264 ?  65  ARG A CD   1 
ATOM   654  N  NE   . ARG A 1 61  ? -1.88300 16.46200  11.70600  1.000 13.59110 ?  65  ARG A NE   1 
ATOM   655  C  CZ   . ARG A 1 61  ? -1.31900 17.46000  12.37300  1.000 13.30686 ?  65  ARG A CZ   1 
ATOM   656  N  NH1  . ARG A 1 61  ? -0.20300 17.29200  13.06400  1.000 12.81996 ?  65  ARG A NH1  1 
ATOM   657  N  NH2  . ARG A 1 61  ? -1.87200 18.66300  12.33100  1.000 14.10432 ?  65  ARG A NH2  1 
ATOM   658  H  H    . ARG A 1 61  ? 0.45300  13.45400  7.99900   1.000 15.05000 ?  65  ARG A H    1 
ATOM   659  H  HA   . ARG A 1 61  ? 2.21300  14.67100  9.61200   1.000 14.84000 ?  65  ARG A HA   1 
ATOM   660  H  HB2  . ARG A 1 61  ? -0.07900 13.13000  10.19000  1.000 15.15000 ?  65  ARG A HB2  1 
ATOM   661  H  HB3  . ARG A 1 61  ? 0.88700  13.63400  11.34700  1.000 15.15000 ?  65  ARG A HB3  1 
ATOM   662  H  HG2  . ARG A 1 61  ? 0.43500  15.83200  10.72600  1.000 15.64000 ?  65  ARG A HG2  1 
ATOM   663  H  HG3  . ARG A 1 61  ? -0.59100 15.29200  9.63900   1.000 15.64000 ?  65  ARG A HG3  1 
ATOM   664  H  HD2  . ARG A 1 61  ? -2.01300 14.51900  11.28700  1.000 15.92000 ?  65  ARG A HD2  1 
ATOM   665  H  HD3  . ARG A 1 61  ? -0.94800 14.85200  12.41700  1.000 15.92000 ?  65  ARG A HD3  1 
ATOM   666  H  HE   . ARG A 1 61  ? -2.64200 16.61300  11.33200  1.000 16.31000 ?  65  ARG A HE   1 
ATOM   667  H  HH11 . ARG A 1 61  ? 0.17500  16.52000  13.08900  1.000 15.38000 ?  65  ARG A HH11 1 
ATOM   668  H  HH12 . ARG A 1 61  ? 0.14400  17.95400  13.48900  1.000 15.38000 ?  65  ARG A HH12 1 
ATOM   669  H  HH21 . ARG A 1 61  ? -2.58900 18.79100  11.87400  1.000 16.92000 ?  65  ARG A HH21 1 
ATOM   670  H  HH22 . ARG A 1 61  ? -1.51300 19.31700  12.76000  1.000 16.92000 ?  65  ARG A HH22 1 
ATOM   671  N  N    . PHE A 1 62  ? 3.70400  12.96200  10.48800  1.000 11.20397 ?  66  PHE A N    1 
ATOM   672  C  CA   . PHE A 1 62  ? 4.64900  11.97000  10.97100  1.000 11.24872 ?  66  PHE A CA   1 
ATOM   673  C  C    . PHE A 1 62  ? 4.92300  12.27400  12.43800  1.000 10.75655 ?  66  PHE A C    1 
ATOM   674  O  O    . PHE A 1 62  ? 4.93500  13.44800  12.83000  1.000 11.89353 ?  66  PHE A O    1 
ATOM   675  C  CB   . PHE A 1 62  ? 5.98700  12.03200  10.22600  1.000 11.83563 ?  66  PHE A CB   1 
ATOM   676  C  CG   . PHE A 1 62  ? 5.91600  11.61300  8.78100   1.000 11.74878 ?  66  PHE A CG   1 
ATOM   677  C  CD1  . PHE A 1 62  ? 5.44200  12.48700  7.80900   1.000 12.63836 ?  66  PHE A CD1  1 
ATOM   678  C  CD2  . PHE A 1 62  ? 6.39400  10.37100  8.37500   1.000 12.22778 ?  66  PHE A CD2  1 
ATOM   679  C  CE1  . PHE A 1 62  ? 5.44000  12.11100  6.47400   1.000 12.70942 ?  66  PHE A CE1  1 
ATOM   680  C  CE2  . PHE A 1 62  ? 6.40200  10.00200  7.04400   1.000 13.33581 ?  66  PHE A CE2  1 
ATOM   681  C  CZ   . PHE A 1 62  ? 5.91300  10.86300  6.09700   1.000 13.14631 ?  66  PHE A CZ   1 
ATOM   682  H  H    . PHE A 1 62  ? 3.90500  13.76000  10.74000  1.000 13.44000 ?  66  PHE A H    1 
ATOM   683  H  HA   . PHE A 1 62  ? 4.27400  11.08200  10.86200  1.000 13.49000 ?  66  PHE A HA   1 
ATOM   684  H  HB2  . PHE A 1 62  ? 6.31300  12.94500  10.25100  1.000 14.20000 ?  66  PHE A HB2  1 
ATOM   685  H  HB3  . PHE A 1 62  ? 6.61500  11.44200  10.67100  1.000 14.20000 ?  66  PHE A HB3  1 
ATOM   686  H  HD1  . PHE A 1 62  ? 5.12500  13.32600  8.05500   1.000 15.16000 ?  66  PHE A HD1  1 
ATOM   687  H  HD2  . PHE A 1 62  ? 6.71500  9.77600   9.01300   1.000 14.67000 ?  66  PHE A HD2  1 
ATOM   688  H  HE1  . PHE A 1 62  ? 5.12000  12.69900  5.82800   1.000 15.25000 ?  66  PHE A HE1  1 
ATOM   689  H  HE2  . PHE A 1 62  ? 6.73800  9.17300   6.79100   1.000 16.00000 ?  66  PHE A HE2  1 
ATOM   690  H  HZ   . PHE A 1 62  ? 5.89800  10.61100  5.20200   1.000 15.77000 ?  66  PHE A HZ   1 
ATOM   691  N  N    . PRO A 1 63  ? 5.18100  11.24800  13.26300  1.000 11.32767 ?  67  PRO A N    1 
ATOM   692  C  CA   . PRO A 1 63  ? 5.54300  11.51600  14.66400  1.000 11.55402 ?  67  PRO A CA   1 
ATOM   693  C  C    . PRO A 1 63  ? 6.81300  12.34600  14.76100  1.000 11.02501 ?  67  PRO A C    1 
ATOM   694  O  O    . PRO A 1 63  ? 7.79300  12.11200  14.04200  1.000 11.93038 ?  67  PRO A O    1 
ATOM   695  C  CB   . PRO A 1 63  ? 5.73600  10.11500  15.25700  1.000 12.09619 ?  67  PRO A CB   1 
ATOM   696  C  CG   . PRO A 1 63  ? 4.88500  9.21500   14.37300  1.000 12.33043 ?  67  PRO A CG   1 
ATOM   697  C  CD   . PRO A 1 63  ? 5.06500  9.79900   13.00100  1.000 11.73299 ?  67  PRO A CD   1 
ATOM   698  H  HA   . PRO A 1 63  ? 4.82000  11.97100  15.12300  1.000 13.86000 ?  67  PRO A HA   1 
ATOM   699  H  HB2  . PRO A 1 63  ? 6.67200  9.86200   15.21600  1.000 14.51000 ?  67  PRO A HB2  1 
ATOM   700  H  HB3  . PRO A 1 63  ? 5.42800  10.09600  16.17600  1.000 14.51000 ?  67  PRO A HB3  1 
ATOM   701  H  HG2  . PRO A 1 63  ? 5.20900  8.30100   14.41200  1.000 14.79000 ?  67  PRO A HG2  1 
ATOM   702  H  HG3  . PRO A 1 63  ? 3.95700  9.25000   14.65200  1.000 14.79000 ?  67  PRO A HG3  1 
ATOM   703  H  HD2  . PRO A 1 63  ? 5.87100  9.45700   12.58400  1.000 14.08000 ?  67  PRO A HD2  1 
ATOM   704  H  HD3  . PRO A 1 63  ? 4.29600  9.60900   12.44100  1.000 14.08000 ?  67  PRO A HD3  1 
ATOM   705  N  N    . LEU A 1 64  ? 6.80400  13.29400  15.70100  1.000 11.21713 ?  68  LEU A N    1 
ATOM   706  C  CA   . LEU A 1 64  ? 7.96800  14.12700  15.96700  1.000 11.64087 ?  68  LEU A CA   1 
ATOM   707  C  C    . LEU A 1 64  ? 9.09200  13.34500  16.63400  1.000 11.48559 ?  68  LEU A C    1 
ATOM   708  O  O    . LEU A 1 64  ? 10.27600 13.59800  16.36100  1.000 11.68824 ?  68  LEU A O    1 
ATOM   709  C  CB   . LEU A 1 64  ? 7.53100  15.28400  16.87000  1.000 11.88037 ?  68  LEU A CB   1 
ATOM   710  C  CG   . LEU A 1 64  ? 6.70000  16.34100  16.17100  1.000 12.53571 ?  68  LEU A CG   1 
ATOM   711  C  CD1  . LEU A 1 64  ? 5.86000  17.14600  17.17400  1.000 13.59637 ?  68  LEU A CD1  1 
ATOM   712  C  CD2  . LEU A 1 64  ? 7.54300  17.27700  15.31000  1.000 14.25434 ?  68  LEU A CD2  1 
ATOM   713  H  H    . LEU A 1 64  ? 6.12900  13.47400  16.20200  1.000 13.46000 ?  68  LEU A H    1 
ATOM   714  H  HA   . LEU A 1 64  ? 8.31300  14.47100  15.12800  1.000 13.97000 ?  68  LEU A HA   1 
ATOM   715  H  HB2  . LEU A 1 64  ? 6.99900  14.92400  17.59800  1.000 14.25000 ?  68  LEU A HB2  1 
ATOM   716  H  HB3  . LEU A 1 64  ? 8.32400  15.71700  17.22200  1.000 14.25000 ?  68  LEU A HB3  1 
ATOM   717  H  HG   . LEU A 1 64  ? 6.09700  15.87400  15.57200  1.000 15.04000 ?  68  LEU A HG   1 
ATOM   718  H  HD11 . LEU A 1 64  ? 5.30900  17.77900  16.68800  1.000 16.31000 ?  68  LEU A HD11 1 
ATOM   719  H  HD12 . LEU A 1 64  ? 5.29900  16.53500  17.67700  1.000 16.31000 ?  68  LEU A HD12 1 
ATOM   720  H  HD13 . LEU A 1 64  ? 6.45500  17.62000  17.77600  1.000 16.31000 ?  68  LEU A HD13 1 
ATOM   721  H  HD21 . LEU A 1 64  ? 6.95600  17.90200  14.85600  1.000 17.10000 ?  68  LEU A HD21 1 
ATOM   722  H  HD22 . LEU A 1 64  ? 8.16200  17.75800  15.87900  1.000 17.10000 ?  68  LEU A HD22 1 
ATOM   723  H  HD23 . LEU A 1 64  ? 8.03300  16.75100  14.65800  1.000 17.10000 ?  68  LEU A HD23 1 
ATOM   724  N  N    . CYS A 1 65  ? 8.75500  12.43800  17.54700  1.000 12.26463 ?  69  CYS A N    1 
ATOM   725  C  CA   . CYS A 1 65  ? 9.78000  11.80900  18.38000  1.000 12.02776 ?  69  CYS A CA   1 
ATOM   726  C  C    . CYS A 1 65  ? 10.60500 12.93700  19.00200  1.000 11.88037 ?  69  CYS A C    1 
ATOM   727  O  O    . CYS A 1 65  ? 10.06900 14.00500  19.30400  1.000 12.80943 ?  69  CYS A O    1 
ATOM   728  C  CB   . CYS A 1 65  ? 10.59700 10.79200  17.59400  1.000 13.01472 ?  69  CYS A CB   1 
ATOM   729  S  SG   . CYS A 1 65  ? 9.65300  9.74800   16.46300  1.000 13.41477 ?  69  CYS A SG   1 
ATOM   730  H  H    . CYS A 1 65  ? 7.95200  12.17200  17.70200  1.000 14.71000 ?  69  CYS A H    1 
ATOM   731  H  HA   . CYS A 1 65  ? 9.39800  11.27800  19.09600  1.000 14.43000 ?  69  CYS A HA   1 
ATOM   732  H  HB2  . CYS A 1 65  ? 11.25400 11.27100  17.06500  1.000 15.61000 ?  69  CYS A HB2  1 
ATOM   733  H  HB3  . CYS A 1 65  ? 11.04300 10.20500  18.22500  1.000 15.61000 ?  69  CYS A HB3  1 
ATOM   734  N  N    . SER A 1 66  ? 11.91100 12.75500  19.17000  1.000 12.09619 ?  70  SER A N    1 
ATOM   735  C  CA   . SER A 1 66  ? 12.69300 13.77500  19.85100  1.000 12.16462 ?  70  SER A CA   1 
ATOM   736  C  C    . SER A 1 66  ? 12.86700 15.06000  19.05000  1.000 12.04618 ?  70  SER A C    1 
ATOM   737  O  O    . SER A 1 66  ? 13.43400 16.02000  19.59000  1.000 12.86207 ?  70  SER A O    1 
ATOM   738  C  CB   . SER A 1 66  ? 14.07400 13.25800  20.24000  1.000 13.24369 ?  70  SER A CB   1 
ATOM   739  O  OG   . SER A 1 66  ? 14.01900 12.27900  21.25500  1.000 14.48068 ?  70  SER A OG   1 
ATOM   740  H  H    . SER A 1 66  ? 12.35400 12.06700  18.90500  1.000 14.51000 ?  70  SER A H    1 
ATOM   741  H  HA   . SER A 1 66  ? 12.21000 13.98500  20.66600  1.000 14.59000 ?  70  SER A HA   1 
ATOM   742  H  HB2  . SER A 1 66  ? 14.49000 12.86700  19.45600  1.000 15.89000 ?  70  SER A HB2  1 
ATOM   743  H  HB3  . SER A 1 66  ? 14.60500 14.00400  20.56000  1.000 15.89000 ?  70  SER A HB3  1 
ATOM   744  N  N    . SER A 1 67  ? 12.43800 15.11400  17.79000  1.000 12.01723 ?  71  SER A N    1 
ATOM   745  C  CA   . SER A 1 67  ? 12.67200 16.33000  17.02200  1.000 12.07513 ?  71  SER A CA   1 
ATOM   746  C  C    . SER A 1 67  ? 11.93800 17.53300  17.60200  1.000 11.91722 ?  71  SER A C    1 
ATOM   747  O  O    . SER A 1 67  ? 12.32800 18.66500  17.33600  1.000 12.56466 ?  71  SER A O    1 
ATOM   748  C  CB   . SER A 1 67  ? 12.37300 16.09800  15.52800  1.000 12.56993 ?  71  SER A CB   1 
ATOM   749  O  OG   . SER A 1 67  ? 10.97900 16.02800  15.28100  1.000 12.25673 ?  71  SER A OG   1 
ATOM   750  H  H    . SER A 1 67  ? 12.02500 14.48400  17.37400  1.000 14.42000 ?  71  SER A H    1 
ATOM   751  H  HA   . SER A 1 67  ? 13.61500 16.55700  17.05800  1.000 14.48000 ?  71  SER A HA   1 
ATOM   752  H  HB2  . SER A 1 67  ? 12.74500 16.83400  15.01600  1.000 15.08000 ?  71  SER A HB2  1 
ATOM   753  H  HB3  . SER A 1 67  ? 12.78200 15.26300  15.25300  1.000 15.08000 ?  71  SER A HB3  1 
ATOM   754  H  HG   . SER A 1 67  ? 10.65700 15.34200  15.64500  1.000 14.71000 ?  71  SER A HG   1 
ATOM   755  N  N    . PHE A 1 68  ? 10.90600 17.32900  18.42300  1.000 11.93827 ?  72  PHE A N    1 
ATOM   756  C  CA   . PHE A 1 68  ? 10.28000 18.48400  19.05400  1.000 12.68836 ?  72  PHE A CA   1 
ATOM   757  C  C    . PHE A 1 68  ? 11.24000 19.24600  19.96100  1.000 12.28832 ?  72  PHE A C    1 
ATOM   758  O  O    . PHE A 1 68  ? 10.98200 20.41400  20.26400  1.000 12.62257 ?  72  PHE A O    1 
ATOM   759  C  CB   . PHE A 1 68  ? 9.04600  18.09000  19.87700  1.000 13.23053 ?  72  PHE A CB   1 
ATOM   760  C  CG   . PHE A 1 68  ? 9.35800  17.59900  21.27500  1.000 13.18579 ?  72  PHE A CG   1 
ATOM   761  C  CD1  . PHE A 1 68  ? 9.63600  16.25100  21.51800  1.000 13.94115 ?  72  PHE A CD1  1 
ATOM   762  C  CD2  . PHE A 1 68  ? 9.36500  18.46500  22.35000  1.000 13.40687 ?  72  PHE A CD2  1 
ATOM   763  C  CE1  . PHE A 1 68  ? 9.92900  15.79800  22.78600  1.000 14.70439 ?  72  PHE A CE1  1 
ATOM   764  C  CE2  . PHE A 1 68  ? 9.63700  18.00600  23.61700  1.000 13.64637 ?  72  PHE A CE2  1 
ATOM   765  C  CZ   . PHE A 1 68  ? 9.93700  16.67300  23.82300  1.000 14.50700 ?  72  PHE A CZ   1 
ATOM   766  H  H    . PHE A 1 68  ? 10.56500 16.56400  18.62100  1.000 14.32000 ?  72  PHE A H    1 
ATOM   767  H  HA   . PHE A 1 68  ? 9.98600  19.06600  18.33700  1.000 15.22000 ?  72  PHE A HA   1 
ATOM   768  H  HB2  . PHE A 1 68  ? 8.46900  18.86500  19.96000  1.000 15.87000 ?  72  PHE A HB2  1 
ATOM   769  H  HB3  . PHE A 1 68  ? 8.58000  17.37700  19.41300  1.000 15.87000 ?  72  PHE A HB3  1 
ATOM   770  H  HD1  . PHE A 1 68  ? 9.62300  15.64800  20.81000  1.000 16.72000 ?  72  PHE A HD1  1 
ATOM   771  H  HD2  . PHE A 1 68  ? 9.18300  19.36800  22.21600  1.000 16.08000 ?  72  PHE A HD2  1 
ATOM   772  H  HE1  . PHE A 1 68  ? 10.11900 14.89900  22.93000  1.000 17.64000 ?  72  PHE A HE1  1 
ATOM   773  H  HE2  . PHE A 1 68  ? 9.62000  18.59400  24.33800  1.000 16.37000 ?  72  PHE A HE2  1 
ATOM   774  H  HZ   . PHE A 1 68  ? 10.14600 16.37300  24.67800  1.000 17.41000 ?  72  PHE A HZ   1 
ATOM   775  N  N    . LYS A 1 69  ? 12.32100 18.60800  20.42100  1.000 12.47255 ?  73  LYS A N    1 
ATOM   776  C  CA   . LYS A 1 69  ? 13.21300 19.24400  21.38800  1.000 12.52782 ?  73  LYS A CA   1 
ATOM   777  C  C    . LYS A 1 69  ? 13.92600 20.45600  20.80700  1.000 13.02261 ?  73  LYS A C    1 
ATOM   778  O  O    . LYS A 1 69  ? 14.29100 21.36200  21.56000  1.000 13.36476 ?  73  LYS A O    1 
ATOM   779  C  CB   . LYS A 1 69  ? 14.20200 18.23500  21.97100  1.000 12.98840 ?  73  LYS A CB   1 
ATOM   780  C  CG   . LYS A 1 69  ? 13.56100 17.12800  22.78700  1.000 13.06209 ?  73  LYS A CG   1 
ATOM   781  C  CD   . LYS A 1 69  ? 14.46000 15.95200  23.06800  1.000 13.61216 ?  73  LYS A CD   1 
ATOM   782  C  CE   . LYS A 1 69  ? 13.73200 14.82000  23.72500  1.000 14.38857 ?  73  LYS A CE   1 
ATOM   783  N  NZ   . LYS A 1 69  ? 14.41400 13.51500  23.73700  1.000 14.50963 ?  73  LYS A NZ   1 
ATOM   784  H  H    . LYS A 1 69  ? 12.55600 17.81400  20.19000  1.000 14.96000 ?  73  LYS A H    1 
ATOM   785  H  HA   . LYS A 1 69  ? 12.67500 19.56200  22.13000  1.000 15.03000 ?  73  LYS A HA   1 
ATOM   786  H  HB2  . LYS A 1 69  ? 14.68700 17.81900  21.24100  1.000 15.58000 ?  73  LYS A HB2  1 
ATOM   787  H  HB3  . LYS A 1 69  ? 14.81900 18.70800  22.55200  1.000 15.58000 ?  73  LYS A HB3  1 
ATOM   788  H  HG2  . LYS A 1 69  ? 13.28500 17.49300  23.64200  1.000 15.67000 ?  73  LYS A HG2  1 
ATOM   789  H  HG3  . LYS A 1 69  ? 12.78900 16.79500  22.30300  1.000 15.67000 ?  73  LYS A HG3  1 
ATOM   790  H  HD2  . LYS A 1 69  ? 14.82900 15.62700  22.23200  1.000 16.33000 ?  73  LYS A HD2  1 
ATOM   791  H  HD3  . LYS A 1 69  ? 15.17600 16.23400  23.65900  1.000 16.33000 ?  73  LYS A HD3  1 
ATOM   792  H  HE2  . LYS A 1 69  ? 13.57000 15.06300  24.65000  1.000 17.26000 ?  73  LYS A HE2  1 
ATOM   793  H  HE3  . LYS A 1 69  ? 12.88900 14.69500  23.26300  1.000 17.26000 ?  73  LYS A HE3  1 
ATOM   794  H  HZ1  . LYS A 1 69  ? 13.93400 12.92400  24.19900  1.000 17.41000 ?  73  LYS A HZ1  1 
ATOM   795  H  HZ2  . LYS A 1 69  ? 14.51500 13.21600  22.90500  1.000 17.41000 ?  73  LYS A HZ2  1 
ATOM   796  H  HZ3  . LYS A 1 69  ? 15.21600 13.59300  24.11500  1.000 17.41000 ?  73  LYS A HZ3  1 
ATOM   797  N  N    . GLY A 1 70  ? 14.16000 20.49400  19.48900  1.000 12.97787 ?  74  GLY A N    1 
ATOM   798  C  CA   . GLY A 1 70  ? 14.69700 21.71500  18.90700  1.000 13.12526 ?  74  GLY A CA   1 
ATOM   799  C  C    . GLY A 1 70  ? 13.74300 22.88600  19.07100  1.000 12.37254 ?  74  GLY A C    1 
ATOM   800  O  O    . GLY A 1 70  ? 14.13000 23.96500  19.52600  1.000 13.34634 ?  74  GLY A O    1 
ATOM   801  H  H    . GLY A 1 70  ? 14.02000 19.84900  18.93700  1.000 15.57000 ?  74  GLY A H    1 
ATOM   802  H  HA2  . GLY A 1 70  ? 15.53600 21.93800  19.33900  1.000 15.75000 ?  74  GLY A HA2  1 
ATOM   803  H  HA3  . GLY A 1 70  ? 14.85700 21.57800  17.96000  1.000 15.75000 ?  74  GLY A HA3  1 
ATOM   804  N  N    . PHE A 1 71  ? 12.46900 22.68000  18.71700  1.000 12.99103 ?  75  PHE A N    1 
ATOM   805  C  CA   . PHE A 1 71  ? 11.46200 23.72600  18.88100  1.000 12.97261 ?  75  PHE A CA   1 
ATOM   806  C  C    . PHE A 1 71  ? 11.27300 24.09100  20.34500  1.000 12.66731 ?  75  PHE A C    1 
ATOM   807  O  O    . PHE A 1 71  ? 11.02800 25.25900  20.66900  1.000 13.86482 ?  75  PHE A O    1 
ATOM   808  C  CB   . PHE A 1 71  ? 10.15500 23.27200  18.21100  1.000 13.41740 ?  75  PHE A CB   1 
ATOM   809  C  CG   . PHE A 1 71  ? 10.30300 23.06300  16.71600  1.000 12.68836 ?  75  PHE A CG   1 
ATOM   810  C  CD1  . PHE A 1 71  ? 10.72500 24.11300  15.91200  1.000 13.94641 ?  75  PHE A CD1  1 
ATOM   811  C  CD2  . PHE A 1 71  ? 10.04200 21.83700  16.11400  1.000 12.81469 ?  75  PHE A CD2  1 
ATOM   812  C  CE1  . PHE A 1 71  ? 10.89500 23.95300  14.56500  1.000 14.33330 ?  75  PHE A CE1  1 
ATOM   813  C  CE2  . PHE A 1 71  ? 10.20000 21.68700  14.73300  1.000 13.40161 ?  75  PHE A CE2  1 
ATOM   814  C  CZ   . PHE A 1 71  ? 10.62700 22.74400  13.97500  1.000 13.33844 ?  75  PHE A CZ   1 
ATOM   815  H  H    . PHE A 1 71  ? 12.16600 21.94800  18.38200  1.000 15.59000 ?  75  PHE A H    1 
ATOM   816  H  HA   . PHE A 1 71  ? 11.74300 24.54000  18.43500  1.000 15.56000 ?  75  PHE A HA   1 
ATOM   817  H  HB2  . PHE A 1 71  ? 9.87400  22.43100  18.60500  1.000 16.10000 ?  75  PHE A HB2  1 
ATOM   818  H  HB3  . PHE A 1 71  ? 9.47500  23.94900  18.35400  1.000 16.10000 ?  75  PHE A HB3  1 
ATOM   819  H  HD1  . PHE A 1 71  ? 10.89600 24.94200  16.29700  1.000 16.73000 ?  75  PHE A HD1  1 
ATOM   820  H  HD2  . PHE A 1 71  ? 9.76300  21.11600  16.63100  1.000 15.38000 ?  75  PHE A HD2  1 
ATOM   821  H  HE1  . PHE A 1 71  ? 11.19300 24.66600  14.04700  1.000 17.20000 ?  75  PHE A HE1  1 
ATOM   822  H  HE2  . PHE A 1 71  ? 10.01500 20.87000  14.33000  1.000 16.08000 ?  75  PHE A HE2  1 
ATOM   823  H  HZ   . PHE A 1 71  ? 10.73700 22.64100  13.05800  1.000 16.00000 ?  75  PHE A HZ   1 
ATOM   824  N  N    . LEU A 1 72  ? 11.39400 23.11200  21.23200  1.000 13.04630 ?  76  LEU A N    1 
ATOM   825  C  CA   . LEU A 1 72  ? 11.36100 23.38100  22.66300  1.000 13.24633 ?  76  LEU A CA   1 
ATOM   826  C  C    . LEU A 1 72  ? 12.43100 24.38700  23.06400  1.000 13.43582 ?  76  LEU A C    1 
ATOM   827  O  O    . LEU A 1 72  ? 12.14700 25.36300  23.77500  1.000 14.06221 ?  76  LEU A O    1 
ATOM   828  C  CB   . LEU A 1 72  ? 11.53100 22.06700  23.42700  1.000 14.18328 ?  76  LEU A CB   1 
ATOM   829  C  CG   . LEU A 1 72  ? 11.54200 22.13800  24.94400  1.000 15.37026 ?  76  LEU A CG   1 
ATOM   830  C  CD1  . LEU A 1 72  ? 10.21400 22.52700  25.54500  1.000 17.21259 ?  76  LEU A CD1  1 
ATOM   831  C  CD2  . LEU A 1 72  ? 12.01700 20.77200  25.46100  1.000 17.71265 ?  76  LEU A CD2  1 
ATOM   832  H  H    . LEU A 1 72  ? 11.49700 22.28200  21.03200  1.000 15.65000 ?  76  LEU A H    1 
ATOM   833  H  HA   . LEU A 1 72  ? 10.50100 23.76500  22.89700  1.000 15.89000 ?  76  LEU A HA   1 
ATOM   834  H  HB2  . LEU A 1 72  ? 10.79900 21.48200  23.17800  1.000 17.01000 ?  76  LEU A HB2  1 
ATOM   835  H  HB3  . LEU A 1 72  ? 12.37600 21.67400  23.15700  1.000 17.01000 ?  76  LEU A HB3  1 
ATOM   836  H  HG   . LEU A 1 72  ? 12.14400 22.84300  25.22900  1.000 18.44000 ?  76  LEU A HG   1 
ATOM   837  H  HD11 . LEU A 1 72  ? 10.31700 22.62400  26.50400  1.000 20.65000 ?  76  LEU A HD11 1 
ATOM   838  H  HD12 . LEU A 1 72  ? 9.92600  23.36800  25.15700  1.000 20.65000 ?  76  LEU A HD12 1 
ATOM   839  H  HD13 . LEU A 1 72  ? 9.56400  21.83400  25.35100  1.000 20.65000 ?  76  LEU A HD13 1 
ATOM   840  H  HD21 . LEU A 1 72  ? 11.98100 20.77100  26.43000  1.000 21.25000 ?  76  LEU A HD21 1 
ATOM   841  H  HD22 . LEU A 1 72  ? 11.43500 20.08100  25.10800  1.000 21.25000 ?  76  LEU A HD22 1 
ATOM   842  H  HD23 . LEU A 1 72  ? 12.92800 20.62100  25.16300  1.000 21.25000 ?  76  LEU A HD23 1 
ATOM   843  N  N    . ALA A 1 73  ? 13.67500 24.15200  22.63100  1.000 13.42003 ?  77  ALA A N    1 
ATOM   844  C  CA   . ALA A 1 73  ? 14.74700 25.08600  22.94400  1.000 13.73323 ?  77  ALA A CA   1 
ATOM   845  C  C    . ALA A 1 73  ? 14.47900 26.46800  22.35300  1.000 13.67269 ?  77  ALA A C    1 
ATOM   846  O  O    . ALA A 1 73  ? 14.77900 27.49000  22.98500  1.000 14.97022 ?  77  ALA A O    1 
ATOM   847  C  CB   . ALA A 1 73  ? 16.08600 24.52600  22.47300  1.000 14.71755 ?  77  ALA A CB   1 
ATOM   848  H  H    . ALA A 1 73  ? 13.91500 23.47100  22.16300  1.000 16.10000 ?  77  ALA A H    1 
ATOM   849  H  HA   . ALA A 1 73  ? 14.79800 25.19200  23.90700  1.000 16.48000 ?  77  ALA A HA   1 
ATOM   850  H  HB1  . ALA A 1 73  ? 16.79100 25.14600  22.71700  1.000 17.66000 ?  77  ALA A HB1  1 
ATOM   851  H  HB2  . ALA A 1 73  ? 16.23700 23.66800  22.90000  1.000 17.66000 ?  77  ALA A HB2  1 
ATOM   852  H  HB3  . ALA A 1 73  ? 16.06000 24.41600  21.51000  1.000 17.66000 ?  77  ALA A HB3  1 
ATOM   853  N  N    . ALA A 1 74  ? 13.92600 26.52800  21.13400  1.000 13.97273 ?  78  ALA A N    1 
ATOM   854  C  CA   . ALA A 1 74  ? 13.59600 27.82200  20.54700  1.000 14.71755 ?  78  ALA A CA   1 
ATOM   855  C  C    . ALA A 1 74  ? 12.54900 28.55600  21.37800  1.000 14.14117 ?  78  ALA A C    1 
ATOM   856  O  O    . ALA A 1 74  ? 12.62600 29.77800  21.55400  1.000 15.26762 ?  78  ALA A O    1 
ATOM   857  C  CB   . ALA A 1 74  ? 13.11400 27.64900  19.10400  1.000 15.37290 ?  78  ALA A CB   1 
ATOM   858  H  H    . ALA A 1 74  ? 13.73700 25.84900  20.64100  1.000 16.77000 ?  78  ALA A H    1 
ATOM   859  H  HA   . ALA A 1 74  ? 14.40100 28.36400  20.52600  1.000 17.66000 ?  78  ALA A HA   1 
ATOM   860  H  HB1  . ALA A 1 74  ? 12.92600 28.52300  18.72700  1.000 18.44000 ?  78  ALA A HB1  1 
ATOM   861  H  HB2  . ALA A 1 74  ? 13.80800 27.20900  18.58900  1.000 18.44000 ?  78  ALA A HB2  1 
ATOM   862  H  HB3  . ALA A 1 74  ? 12.30800 27.10900  19.10400  1.000 18.44000 ?  78  ALA A HB3  1 
ATOM   863  N  N    . ALA A 1 75  ? 11.57100 27.81300  21.91400  1.000 14.39909 ?  79  ALA A N    1 
ATOM   864  C  CA   . ALA A 1 75  ? 10.53000 28.40900  22.74200  1.000 14.69387 ?  79  ALA A CA   1 
ATOM   865  C  C    . ALA A 1 75  ? 11.12500 28.97400  24.02200  1.000 15.13076 ?  79  ALA A C    1 
ATOM   866  O  O    . ALA A 1 75  ? 10.71800 30.04800  24.48500  1.000 16.19405 ?  79  ALA A O    1 
ATOM   867  C  CB   . ALA A 1 75  ? 9.46100  27.36200  23.05900  1.000 15.42553 ?  79  ALA A CB   1 
ATOM   868  H  H    . ALA A 1 75  ? 11.49100 26.96300  21.81100  1.000 17.28000 ?  79  ALA A H    1 
ATOM   869  H  HA   . ALA A 1 75  ? 10.10400 29.13400  22.25800  1.000 17.63000 ?  79  ALA A HA   1 
ATOM   870  H  HB1  . ALA A 1 75  ? 8.76900  27.77200  23.60200  1.000 18.51000 ?  79  ALA A HB1  1 
ATOM   871  H  HB2  . ALA A 1 75  ? 9.08100  27.03800  22.22800  1.000 18.51000 ?  79  ALA A HB2  1 
ATOM   872  H  HB3  . ALA A 1 75  ? 9.87100  26.62900  23.54400  1.000 18.51000 ?  79  ALA A HB3  1 
ATOM   873  N  N    . VAL A 1 76  ? 12.08500 28.25700  24.61000  1.000 15.63345 ?  80  VAL A N    1 
ATOM   874  C  CA   . VAL A 1 76  ? 12.79600 28.76500  25.78500  1.000 15.83611 ?  80  VAL A CA   1 
ATOM   875  C  C    . VAL A 1 76  ? 13.53800 30.04500  25.43400  1.000 15.79400 ?  80  VAL A C    1 
ATOM   876  O  O    . VAL A 1 76  ? 13.49300 31.03100  26.17000  1.000 16.88624 ?  80  VAL A O    1 
ATOM   877  C  CB   . VAL A 1 76  ? 13.75000 27.69400  26.34100  1.000 17.04415 ?  80  VAL A CB   1 
ATOM   878  C  CG1  . VAL A 1 76  ? 14.66300 28.29200  27.40000  1.000 18.47064 ?  80  VAL A CG1  1 
ATOM   879  C  CG2  . VAL A 1 76  ? 12.97900 26.49500  26.88800  1.000 17.53105 ?  80  VAL A CG2  1 
ATOM   880  H  H    . VAL A 1 76  ? 12.34300 27.47900  24.35000  1.000 18.76000 ?  80  VAL A H    1 
ATOM   881  H  HA   . VAL A 1 76  ? 12.14600 28.97200  26.47500  1.000 19.00000 ?  80  VAL A HA   1 
ATOM   882  H  HB   . VAL A 1 76  ? 14.30500 27.36900  25.61500  1.000 20.45000 ?  80  VAL A HB   1 
ATOM   883  H  HG11 . VAL A 1 76  ? 15.08100 27.57300  27.90000  1.000 22.16000 ?  80  VAL A HG11 1 
ATOM   884  H  HG12 . VAL A 1 76  ? 15.34300 28.82900  26.96300  1.000 22.16000 ?  80  VAL A HG12 1 
ATOM   885  H  HG13 . VAL A 1 76  ? 14.13600 28.84600  27.99600  1.000 22.16000 ?  80  VAL A HG13 1 
ATOM   886  H  HG21 . VAL A 1 76  ? 13.61000 25.83800  27.21900  1.000 21.03000 ?  80  VAL A HG21 1 
ATOM   887  H  HG22 . VAL A 1 76  ? 12.40200 26.79300  27.60900  1.000 21.03000 ?  80  VAL A HG22 1 
ATOM   888  H  HG23 . VAL A 1 76  ? 12.44500 26.11100  26.17500  1.000 21.03000 ?  80  VAL A HG23 1 
ATOM   889  N  N    . LEU A 1 77  ? 14.23900 30.05000  24.30100  1.000 15.95718 ?  81  LEU A N    1 
ATOM   890  C  CA   . LEU A 1 77  ? 14.93000 31.26300  23.87800  1.000 16.91519 ?  81  LEU A CA   1 
ATOM   891  C  C    . LEU A 1 77  ? 13.96400 32.42300  23.66300  1.000 17.90215 ?  81  LEU A C    1 
ATOM   892  O  O    . LEU A 1 77  ? 14.25800 33.56100  24.04900  1.000 19.64183 ?  81  LEU A O    1 
ATOM   893  C  CB   . LEU A 1 77  ? 15.74700 30.98300  22.61200  1.000 17.52579 ?  81  LEU A CB   1 
ATOM   894  C  CG   . LEU A 1 77  ? 17.00900 30.14800  22.78900  1.000 18.29956 ?  81  LEU A CG   1 
ATOM   895  C  CD1  . LEU A 1 77  ? 17.52800 29.64800  21.43400  1.000 18.32062 ?  81  LEU A CD1  1 
ATOM   896  C  CD2  . LEU A 1 77  ? 18.12100 30.95300  23.51400  1.000 19.00754 ?  81  LEU A CD2  1 
ATOM   897  H  H    . LEU A 1 77  ? 14.32700 29.37900  23.77100  1.000 19.15000 ?  81  LEU A H    1 
ATOM   898  H  HA   . LEU A 1 77  ? 15.54600 31.52800  24.57900  1.000 20.29000 ?  81  LEU A HA   1 
ATOM   899  H  HB2  . LEU A 1 77  ? 15.17800 30.51100  21.98500  1.000 21.03000 ?  81  LEU A HB2  1 
ATOM   900  H  HB3  . LEU A 1 77  ? 16.01900 31.83500  22.23600  1.000 21.03000 ?  81  LEU A HB3  1 
ATOM   901  H  HG   . LEU A 1 77  ? 16.78500 29.38100  23.33800  1.000 21.96000 ?  81  LEU A HG   1 
ATOM   902  H  HD11 . LEU A 1 77  ? 18.34800 29.14800  21.57500  1.000 21.98000 ?  81  LEU A HD11 1 
ATOM   903  H  HD12 . LEU A 1 77  ? 16.85700 29.07600  21.03000  1.000 21.98000 ?  81  LEU A HD12 1 
ATOM   904  H  HD13 . LEU A 1 77  ? 17.70100 30.41100  20.86000  1.000 21.98000 ?  81  LEU A HD13 1 
ATOM   905  H  HD21 . LEU A 1 77  ? 18.90000 30.38600  23.62400  1.000 22.80000 ?  81  LEU A HD21 1 
ATOM   906  H  HD22 . LEU A 1 77  ? 18.35000 31.72800  22.97800  1.000 22.80000 ?  81  LEU A HD22 1 
ATOM   907  H  HD23 . LEU A 1 77  ? 17.79200 31.23600  24.38100  1.000 22.80000 ?  81  LEU A HD23 1 
ATOM   908  N  N    . ALA A 1 78  ? 12.80800 32.16800  23.04600  1.000 17.91531 ?  82  ALA A N    1 
ATOM   909  C  CA   . ALA A 1 78  ? 11.82200 33.23400  22.88700  1.000 18.85752 ?  82  ALA A CA   1 
ATOM   910  C  C    . ALA A 1 78  ? 11.41300 33.80400  24.24800  1.000 19.88396 ?  82  ALA A C    1 
ATOM   911  O  O    . ALA A 1 78  ? 11.35500 35.02400  24.43800  1.000 20.79460 ?  82  ALA A O    1 
ATOM   912  C  CB   . ALA A 1 78  ? 10.60600 32.71500  22.12100  1.000 18.48116 ?  82  ALA A CB   1 
ATOM   913  H  H    . ALA A 1 78  ? 12.57700 31.40700  22.72000  1.000 21.49000 ?  82  ALA A H    1 
ATOM   914  H  HA   . ALA A 1 78  ? 12.21300 33.95200  22.36500  1.000 22.63000 ?  82  ALA A HA   1 
ATOM   915  H  HB1  . ALA A 1 78  ? 9.96200  33.43400  22.02800  1.000 22.18000 ?  82  ALA A HB1  1 
ATOM   916  H  HB2  . ALA A 1 78  ? 10.89100 32.41000  21.24600  1.000 22.18000 ?  82  ALA A HB2  1 
ATOM   917  H  HB3  . ALA A 1 78  ? 10.21200 31.97900  22.61600  1.000 22.18000 ?  82  ALA A HB3  1 
ATOM   918  N  N    A ARG A 1 79  ? 11.15300 32.93300  25.22400  0.550 20.68143 ?  83  ARG A N    1 
ATOM   919  N  N    B ARG A 1 79  ? 11.14000 32.92600  25.21800  0.450 20.73406 ?  83  ARG A N    1 
ATOM   920  C  CA   A ARG A 1 79  ? 10.78900 33.43300  26.54400  0.550 22.14476 ?  83  ARG A CA   1 
ATOM   921  C  CA   B ARG A 1 79  ? 10.80000 33.39000  26.56000  0.450 22.13686 ?  83  ARG A CA   1 
ATOM   922  C  C    A ARG A 1 79  ? 11.92900 34.21800  27.17900  0.550 22.63166 ?  83  ARG A C    1 
ATOM   923  C  C    B ARG A 1 79  ? 11.92600 34.23100  27.14800  0.450 22.58692 ?  83  ARG A C    1 
ATOM   924  O  O    A ARG A 1 79  ? 11.68500 35.17600  27.91800  0.550 23.63178 ?  83  ARG A O    1 
ATOM   925  O  O    B ARG A 1 79  ? 11.67500 35.24100  27.81100  0.450 23.38438 ?  83  ARG A O    1 
ATOM   926  C  CB   A ARG A 1 79  ? 10.37200 32.28000  27.45300  0.550 23.64494 ?  83  ARG A CB   1 
ATOM   927  C  CB   B ARG A 1 79  ? 10.51600 32.19300  27.47000  0.450 23.53703 ?  83  ARG A CB   1 
ATOM   928  C  CG   A ARG A 1 79  ? 10.02500 32.75500  28.85700  0.550 25.31883 ?  83  ARG A CG   1 
ATOM   929  C  CG   B ARG A 1 79  ? 9.33000  31.33000  27.06800  0.450 25.46095 ?  83  ARG A CG   1 
ATOM   930  C  CD   A ARG A 1 79  ? 9.41700  31.66100  29.70100  0.550 28.09284 ?  83  ARG A CD   1 
ATOM   931  C  CD   B ARG A 1 79  ? 7.98600  31.95300  27.42200  0.450 27.23484 ?  83  ARG A CD   1 
ATOM   932  N  NE   A ARG A 1 79  ? 8.09000  31.28100  29.23000  0.550 30.12993 ?  83  ARG A NE   1 
ATOM   933  N  NE   B ARG A 1 79  ? 6.87300  31.12900  26.95500  0.450 28.23233 ?  83  ARG A NE   1 
ATOM   934  C  CZ   A ARG A 1 79  ? 7.24900  30.52000  29.91500  0.550 31.51167 ?  83  ARG A CZ   1 
ATOM   935  C  CZ   B ARG A 1 79  ? 6.19000  30.27600  27.70800  0.450 29.35878 ?  83  ARG A CZ   1 
ATOM   936  N  NH1  A ARG A 1 79  ? 7.57000  30.03600  31.10300  0.550 32.51442 ?  83  ARG A NH1  1 
ATOM   937  N  NH1  B ARG A 1 79  ? 6.45800  30.11700  28.99300  0.450 29.62724 ?  83  ARG A NH1  1 
ATOM   938  N  NH2  A ARG A 1 79  ? 6.05700  30.24100  29.39800  0.550 31.96436 ?  83  ARG A NH2  1 
ATOM   939  N  NH2  B ARG A 1 79  ? 5.21400  29.56000  27.15400  0.450 29.53249 ?  83  ARG A NH2  1 
ATOM   940  H  H    A ARG A 1 79  ? 11.18000 32.07700  25.14800  0.550 24.82000 ?  83  ARG A H    1 
ATOM   941  H  H    B ARG A 1 79  ? 11.14600 32.07100  25.12500  0.450 24.88000 ?  83  ARG A H    1 
ATOM   942  H  HA   A ARG A 1 79  ? 10.02700 34.02600  26.44900  0.550 26.57000 ?  83  ARG A HA   1 
ATOM   943  H  HA   B ARG A 1 79  ? 9.99900  33.93500  26.50900  0.450 26.56000 ?  83  ARG A HA   1 
ATOM   944  H  HB2  A ARG A 1 79  ? 9.59100  31.84500  27.07800  0.550 28.37000 ?  83  ARG A HB2  1 
ATOM   945  H  HB2  B ARG A 1 79  ? 11.30000 31.62100  27.47500  0.450 28.24000 ?  83  ARG A HB2  1 
ATOM   946  H  HB3  A ARG A 1 79  ? 11.10400 31.64700  27.52000  0.550 28.37000 ?  83  ARG A HB3  1 
ATOM   947  H  HB3  B ARG A 1 79  ? 10.34200 32.52400  28.36500  0.450 28.24000 ?  83  ARG A HB3  1 
ATOM   948  H  HG2  A ARG A 1 79  ? 10.83300 33.06100  29.29700  0.550 30.38000 ?  83  ARG A HG2  1 
ATOM   949  H  HG2  B ARG A 1 79  ? 9.35100  31.19500  26.10700  0.450 30.55000 ?  83  ARG A HG2  1 
ATOM   950  H  HG3  A ARG A 1 79  ? 9.38400  33.48100  28.79700  0.550 30.38000 ?  83  ARG A HG3  1 
ATOM   951  H  HG3  B ARG A 1 79  ? 9.39200  30.47700  27.52500  0.450 30.55000 ?  83  ARG A HG3  1 
ATOM   952  H  HD2  A ARG A 1 79  ? 9.98600  30.87700  29.66600  0.550 33.71000 ?  83  ARG A HD2  1 
ATOM   953  H  HD2  B ARG A 1 79  ? 7.91700  32.04100  28.38500  0.450 32.68000 ?  83  ARG A HD2  1 
ATOM   954  H  HD3  A ARG A 1 79  ? 9.33500  31.97200  30.61600  0.550 33.71000 ?  83  ARG A HD3  1 
ATOM   955  H  HD3  B ARG A 1 79  ? 7.91600  32.82600  27.00300  0.450 32.68000 ?  83  ARG A HD3  1 
ATOM   956  H  HE   A ARG A 1 79  ? 7.83800  31.56900  28.46000  0.550 36.15000 ?  83  ARG A HE   1 
ATOM   957  H  HE   B ARG A 1 79  ? 6.64300  31.20300  26.13000  0.450 33.87000 ?  83  ARG A HE   1 
ATOM   958  H  HH11 A ARG A 1 79  ? 8.33800  30.21200  31.44600  0.550 39.01000 ?  83  ARG A HH11 1 
ATOM   959  H  HH11 B ARG A 1 79  ? 7.08800  30.57300  29.36100  0.450 35.55000 ?  83  ARG A HH11 1 
ATOM   960  H  HH12 A ARG A 1 79  ? 7.01000  29.54300  31.53200  0.550 39.01000 ?  83  ARG A HH12 1 
ATOM   961  H  HH12 B ARG A 1 79  ? 6.00200  29.55800  29.46200  0.450 35.55000 ?  83  ARG A HH12 1 
ATOM   962  H  HH21 A ARG A 1 79  ? 5.83900  30.55300  28.62700  0.550 38.36000 ?  83  ARG A HH21 1 
ATOM   963  H  HH21 B ARG A 1 79  ? 5.03300  29.65400  26.31800  0.450 35.44000 ?  83  ARG A HH21 1 
ATOM   964  H  HH22 A ARG A 1 79  ? 5.50400  29.74800  29.83500  0.550 38.36000 ?  83  ARG A HH22 1 
ATOM   965  H  HH22 B ARG A 1 79  ? 4.76400  29.00400  27.63200  0.450 35.44000 ?  83  ARG A HH22 1 
ATOM   966  N  N    . SER A 1 80  ? 13.17700 33.83300  26.90500  1.000 22.55797 ?  84  SER A N    1 
ATOM   967  C  CA   . SER A 1 80  ? 14.31800 34.53300  27.48400  1.000 23.82654 ?  84  SER A CA   1 
ATOM   968  C  C    . SER A 1 80  ? 14.44900 35.96300  26.97100  1.000 25.07669 ?  84  SER A C    1 
ATOM   969  O  O    . SER A 1 80  ? 15.13000 36.77800  27.60500  1.000 25.57149 ?  84  SER A O    1 
ATOM   970  C  CB   . SER A 1 80  ? 15.59800 33.74800  27.19700  1.000 24.01341 ?  84  SER A CB   1 
ATOM   971  O  OG   . SER A 1 80  ? 16.06800 33.97200  25.88100  1.000 24.33713 ?  84  SER A OG   1 
ATOM   972  H  H    . SER A 1 80  ? 13.38200 33.17400  26.39100  1.000 27.07000 ?  84  SER A H    1 
ATOM   973  H  HA   . SER A 1 80  ? 14.20100 34.58300  28.44600  1.000 28.59000 ?  84  SER A HA   1 
ATOM   974  H  HB2  . SER A 1 80  ? 16.28300 34.02700  27.82500  1.000 28.81000 ?  84  SER A HB2  1 
ATOM   975  H  HB3  . SER A 1 80  ? 15.41500 32.80100  27.30600  1.000 28.81000 ?  84  SER A HB3  1 
ATOM   976  H  HG   . SER A 1 80  ? 15.48700 33.73300  25.32400  1.000 29.20000 ?  84  SER A HG   1 
ATOM   977  N  N    . GLN A 1 81  ? 13.80900 36.28600  25.84900  1.000 26.28210 ?  85  GLN A N    1 
ATOM   978  C  CA   . GLN A 1 81  ? 13.81500 37.66100  25.36600  1.000 28.49815 ?  85  GLN A CA   1 
ATOM   979  C  C    . GLN A 1 81  ? 13.08000 38.58600  26.32200  1.000 31.93278 ?  85  GLN A C    1 
ATOM   980  O  O    . GLN A 1 81  ? 13.40700 39.77700  26.41100  1.000 33.21451 ?  85  GLN A O    1 
ATOM   981  C  CB   . GLN A 1 81  ? 13.19400 37.72300  23.96400  1.000 27.44276 ?  85  GLN A CB   1 
ATOM   982  C  CG   . GLN A 1 81  ? 13.99200 36.94600  22.92100  1.000 27.19273 ?  85  GLN A CG   1 
ATOM   983  C  CD   . GLN A 1 81  ? 13.36900 36.93500  21.52700  1.000 27.49540 ?  85  GLN A CD   1 
ATOM   984  O  OE1  . GLN A 1 81  ? 13.74000 36.12900  20.68600  1.000 27.08746 ?  85  GLN A OE1  1 
ATOM   985  N  NE2  . GLN A 1 81  ? 12.43400 37.84900  21.28100  1.000 28.70344 ?  85  GLN A NE2  1 
ATOM   986  H  H    . GLN A 1 81  ? 13.37100 35.73500  25.35600  1.000 31.54000 ?  85  GLN A H    1 
ATOM   987  H  HA   . GLN A 1 81  ? 14.73100 37.97100  25.29800  1.000 34.20000 ?  85  GLN A HA   1 
ATOM   988  H  HB2  . GLN A 1 81  ? 12.30100 37.34700  23.99800  1.000 32.93000 ?  85  GLN A HB2  1 
ATOM   989  H  HB3  . GLN A 1 81  ? 13.15300 38.65000  23.67900  1.000 32.93000 ?  85  GLN A HB3  1 
ATOM   990  H  HG2  . GLN A 1 81  ? 14.87300 37.34500  22.84500  1.000 32.63000 ?  85  GLN A HG2  1 
ATOM   991  H  HG3  . GLN A 1 81  ? 14.07000 36.02400  23.21400  1.000 32.63000 ?  85  GLN A HG3  1 
ATOM   992  H  HE21 . GLN A 1 81  ? 12.20800 38.40900  21.89400  1.000 34.44000 ?  85  GLN A HE21 1 
ATOM   993  H  HE22 . GLN A 1 81  ? 12.05600 37.88000  20.51000  1.000 34.44000 ?  85  GLN A HE22 1 
ATOM   994  N  N    . GLN A 1 82  ? 12.09800 38.06200  27.05900  1.000 34.28569 ?  86  GLN A N    1 
ATOM   995  C  CA   . GLN A 1 82  ? 11.38100 38.84500  28.06000  1.000 37.31500 ?  86  GLN A CA   1 
ATOM   996  C  C    . GLN A 1 82  ? 11.85600 38.58100  29.48300  1.000 37.97824 ?  86  GLN A C    1 
ATOM   997  O  O    . GLN A 1 82  ? 11.51300 39.35400  30.38400  1.000 37.50713 ?  86  GLN A O    1 
ATOM   998  C  CB   . GLN A 1 82  ? 9.87800  38.56100  27.96700  1.000 40.24167 ?  86  GLN A CB   1 
ATOM   999  C  CG   . GLN A 1 82  ? 9.25400  38.94200  26.63300  1.000 42.89988 ?  86  GLN A CG   1 
ATOM   1000 C  CD   . GLN A 1 82  ? 9.45100  40.40900  26.29700  1.000 45.12646 ?  86  GLN A CD   1 
ATOM   1001 O  OE1  . GLN A 1 82  ? 10.22500 40.75600  25.40200  1.000 46.33713 ?  86  GLN A OE1  1 
ATOM   1002 N  NE2  . GLN A 1 82  ? 8.74600  41.28000  27.01200  1.000 46.01078 ?  86  GLN A NE2  1 
ATOM   1003 H  H    . GLN A 1 82  ? 11.82800 37.24800  26.99400  1.000 41.14000 ?  86  GLN A H    1 
ATOM   1004 H  HA   . GLN A 1 82  ? 11.52000 39.78700  27.87500  1.000 44.77000 ?  86  GLN A HA   1 
ATOM   1005 H  HB2  . GLN A 1 82  ? 9.73300  37.61100  28.10000  1.000 48.28000 ?  86  GLN A HB2  1 
ATOM   1006 H  HB3  . GLN A 1 82  ? 9.42400  39.06500  28.66000  1.000 48.28000 ?  86  GLN A HB3  1 
ATOM   1007 H  HG2  . GLN A 1 82  ? 9.66400  38.41500  25.92900  1.000 51.48000 ?  86  GLN A HG2  1 
ATOM   1008 H  HG3  . GLN A 1 82  ? 8.30100  38.76600  26.66700  1.000 51.48000 ?  86  GLN A HG3  1 
ATOM   1009 H  HE21 . GLN A 1 82  ? 8.21300  41.00100  27.62700  1.000 55.21000 ?  86  GLN A HE21 1 
ATOM   1010 H  HE22 . GLN A 1 82  ? 8.82200  42.12300  26.86000  1.000 55.21000 ?  86  GLN A HE22 1 
ATOM   1011 N  N    . GLN A 1 83  ? 12.64800 37.53100  29.70800  1.000 38.69148 ?  87  GLN A N    1 
ATOM   1012 C  CA   . GLN A 1 83  ? 13.14200 37.17000  31.04100  1.000 39.10995 ?  87  GLN A CA   1 
ATOM   1013 C  C    . GLN A 1 83  ? 14.66600 37.06300  30.96400  1.000 38.41513 ?  87  GLN A C    1 
ATOM   1014 O  O    . GLN A 1 83  ? 15.21100 35.98300  30.71900  1.000 37.76769 ?  87  GLN A O    1 
ATOM   1015 C  CB   . GLN A 1 83  ? 12.50000 35.87000  31.51400  1.000 40.75225 ?  87  GLN A CB   1 
ATOM   1016 C  CG   . GLN A 1 83  ? 10.97900 35.88400  31.50100  1.000 42.36824 ?  87  GLN A CG   1 
ATOM   1017 C  CD   . GLN A 1 83  ? 10.36400 34.58400  31.99200  1.000 44.04475 ?  87  GLN A CD   1 
ATOM   1018 O  OE1  . GLN A 1 83  ? 11.01300 33.79200  32.68100  1.000 44.56324 ?  87  GLN A OE1  1 
ATOM   1019 N  NE2  . GLN A 1 83  ? 9.10700  34.35400  31.63700  1.000 44.87643 ?  87  GLN A NE2  1 
ATOM   1020 H  H    . GLN A 1 83  ? 12.92000 36.99900  29.09000  1.000 46.43000 ?  87  GLN A H    1 
ATOM   1021 H  HA   . GLN A 1 83  ? 12.92300 37.87400  31.67200  1.000 46.93000 ?  87  GLN A HA   1 
ATOM   1022 H  HB2  . GLN A 1 83  ? 12.79200 35.15100  30.93300  1.000 48.90000 ?  87  GLN A HB2  1 
ATOM   1023 H  HB3  . GLN A 1 83  ? 12.78400 35.69700  32.42500  1.000 48.90000 ?  87  GLN A HB3  1 
ATOM   1024 H  HG2  . GLN A 1 83  ? 10.66600 36.59900  32.07800  1.000 50.84000 ?  87  GLN A HG2  1 
ATOM   1025 H  HG3  . GLN A 1 83  ? 10.67300 36.03400  30.59200  1.000 50.84000 ?  87  GLN A HG3  1 
ATOM   1026 H  HE21 . GLN A 1 83  ? 8.68500  34.92700  31.15400  1.000 53.85000 ?  87  GLN A HE21 1 
ATOM   1027 H  HE22 . GLN A 1 83  ? 8.71400  33.63200  31.89000  1.000 53.85000 ?  87  GLN A HE22 1 
ATOM   1028 N  N    . ALA A 1 84  ? 15.35100 38.18200  31.20400  1.000 39.10206 ?  88  ALA A N    1 
ATOM   1029 C  CA   . ALA A 1 84  ? 16.79000 38.24200  30.97400  1.000 39.04416 ?  88  ALA A CA   1 
ATOM   1030 C  C    . ALA A 1 84  ? 17.58300 37.29400  31.86900  1.000 38.57831 ?  88  ALA A C    1 
ATOM   1031 O  O    . ALA A 1 84  ? 18.72700 36.95300  31.53700  1.000 39.20733 ?  88  ALA A O    1 
ATOM   1032 C  CB   . ALA A 1 84  ? 17.29100 39.67500  31.18500  1.000 39.55474 ?  88  ALA A CB   1 
ATOM   1033 H  H    A ALA A 1 84  ? 15.00700 38.91400  31.49700  0.570 46.92000 ?  88  ALA A H    1 
ATOM   1034 H  H    B ALA A 1 84  ? 15.00700 38.91400  31.49700  0.430 46.92000 ?  88  ALA A H    1 
ATOM   1035 H  HA   . ALA A 1 84  ? 16.95600 37.98100  30.05400  1.000 46.85000 ?  88  ALA A HA   1 
ATOM   1036 H  HB1  . ALA A 1 84  ? 18.24700 39.70300  31.02600  1.000 47.46000 ?  88  ALA A HB1  1 
ATOM   1037 H  HB2  . ALA A 1 84  ? 16.83500 40.26400  30.56300  1.000 47.46000 ?  88  ALA A HB2  1 
ATOM   1038 H  HB3  . ALA A 1 84  ? 17.09900 39.94600  32.09700  1.000 47.46000 ?  88  ALA A HB3  1 
ATOM   1039 N  N    . GLY A 1 85  ? 17.02300 36.86400  32.98700  1.000 36.84126 ?  89  GLY A N    1 
ATOM   1040 C  CA   . GLY A 1 85  ? 17.73100 35.93500  33.83900  1.000 34.86471 ?  89  GLY A CA   1 
ATOM   1041 C  C    . GLY A 1 85  ? 17.42900 34.47600  33.60200  1.000 32.89605 ?  89  GLY A C    1 
ATOM   1042 O  O    . GLY A 1 85  ? 17.97200 33.61900  34.30800  1.000 33.37769 ?  89  GLY A O    1 
ATOM   1043 H  H    . GLY A 1 85  ? 16.24300 37.09500  33.26700  1.000 44.20000 ?  89  GLY A H    1 
ATOM   1044 H  HA2  . GLY A 1 85  ? 18.68300 36.06200  33.70900  1.000 41.83000 ?  89  GLY A HA2  1 
ATOM   1045 H  HA3  . GLY A 1 85  ? 17.50900 36.13400  34.76200  1.000 41.83000 ?  89  GLY A HA3  1 
ATOM   1046 N  N    . LEU A 1 86  ? 16.58900 34.15900  32.61800  1.000 30.80369 ?  90  LEU A N    1 
ATOM   1047 C  CA   . LEU A 1 86  ? 16.07000 32.80200  32.50600  1.000 28.48763 ?  90  LEU A CA   1 
ATOM   1048 C  C    . LEU A 1 86  ? 17.16900 31.79700  32.19100  1.000 26.89533 ?  90  LEU A C    1 
ATOM   1049 O  O    . LEU A 1 86  ? 17.26000 30.74500  32.83600  1.000 26.30315 ?  90  LEU A O    1 
ATOM   1050 C  CB   . LEU A 1 86  ? 14.98100 32.75700  31.43500  1.000 27.75859 ?  90  LEU A CB   1 
ATOM   1051 C  CG   . LEU A 1 86  ? 14.41400 31.37000  31.13800  1.000 26.82427 ?  90  LEU A CG   1 
ATOM   1052 C  CD1  . LEU A 1 86  ? 13.75500 30.77900  32.36500  1.000 26.49791 ?  90  LEU A CD1  1 
ATOM   1053 C  CD2  . LEU A 1 86  ? 13.42500 31.46300  29.99800  1.000 26.56108 ?  90  LEU A CD2  1 
ATOM   1054 H  H    . LEU A 1 86  ? 16.31000 34.70300  32.01300  1.000 36.96000 ?  90  LEU A H    1 
ATOM   1055 H  HA   . LEU A 1 86  ? 15.68100 32.55100  33.35800  1.000 34.18000 ?  90  LEU A HA   1 
ATOM   1056 H  HB2  . LEU A 1 86  ? 14.24300 33.31600  31.72600  1.000 33.30000 ?  90  LEU A HB2  1 
ATOM   1057 H  HB3  . LEU A 1 86  ? 15.35200 33.10100  30.60800  1.000 33.30000 ?  90  LEU A HB3  1 
ATOM   1058 H  HG   . LEU A 1 86  ? 15.13600 30.77500  30.88300  1.000 32.19000 ?  90  LEU A HG   1 
ATOM   1059 H  HD11 . LEU A 1 86  ? 13.32900 29.94200  32.12200  1.000 31.79000 ?  90  LEU A HD11 1 
ATOM   1060 H  HD12 . LEU A 1 86  ? 14.43100 30.62200  33.04200  1.000 31.79000 ?  90  LEU A HD12 1 
ATOM   1061 H  HD13 . LEU A 1 86  ? 13.09100 31.40300  32.69800  1.000 31.79000 ?  90  LEU A HD13 1 
ATOM   1062 H  HD21 . LEU A 1 86  ? 13.06600 30.58000  29.81800  1.000 31.87000 ?  90  LEU A HD21 1 
ATOM   1063 H  HD22 . LEU A 1 86  ? 12.70900 32.06600  30.24900  1.000 31.87000 ?  90  LEU A HD22 1 
ATOM   1064 H  HD23 . LEU A 1 86  ? 13.88200 31.80000  29.21100  1.000 31.87000 ?  90  LEU A HD23 1 
ATOM   1065 N  N    . LEU A 1 87  ? 17.99500 32.07900  31.18300  1.000 26.69004 ?  91  LEU A N    1 
ATOM   1066 C  CA   . LEU A 1 87  ? 18.93700 31.06200  30.72200  1.000 25.89784 ?  91  LEU A CA   1 
ATOM   1067 C  C    . LEU A 1 87  ? 19.92800 30.68000  31.81200  1.000 25.38725 ?  91  LEU A C    1 
ATOM   1068 O  O    . LEU A 1 87  ? 20.37900 29.52800  31.86500  1.000 23.12383 ?  91  LEU A O    1 
ATOM   1069 C  CB   . LEU A 1 87  ? 19.67200 31.52600  29.46900  1.000 25.84257 ?  91  LEU A CB   1 
ATOM   1070 C  CG   . LEU A 1 87  ? 18.83000 31.65100  28.20700  1.000 26.81374 ?  91  LEU A CG   1 
ATOM   1071 C  CD1  . LEU A 1 87  ? 19.75600 32.01700  27.04900  1.000 27.88229 ?  91  LEU A CD1  1 
ATOM   1072 C  CD2  . LEU A 1 87  ? 18.06100 30.39700  27.89100  1.000 26.17682 ?  91  LEU A CD2  1 
ATOM   1073 H  H    . LEU A 1 87  ? 18.02900 32.82800  30.76200  1.000 32.03000 ?  91  LEU A H    1 
ATOM   1074 H  HA   . LEU A 1 87  ? 18.43300 30.26800  30.48200  1.000 31.07000 ?  91  LEU A HA   1 
ATOM   1075 H  HB2  . LEU A 1 87  ? 20.05200 32.40100  29.64800  1.000 31.01000 ?  91  LEU A HB2  1 
ATOM   1076 H  HB3  . LEU A 1 87  ? 20.38000 30.89000  29.28000  1.000 31.01000 ?  91  LEU A HB3  1 
ATOM   1077 H  HG   . LEU A 1 87  ? 18.16200 32.34100  28.34100  1.000 32.17000 ?  91  LEU A HG   1 
ATOM   1078 H  HD11 . LEU A 1 87  ? 19.23200 32.09000  26.23600  1.000 33.46000 ?  91  LEU A HD11 1 
ATOM   1079 H  HD12 . LEU A 1 87  ? 20.18400 32.86600  27.24300  1.000 33.46000 ?  91  LEU A HD12 1 
ATOM   1080 H  HD13 . LEU A 1 87  ? 20.42700 31.32400  26.94900  1.000 33.46000 ?  91  LEU A HD13 1 
ATOM   1081 H  HD21 . LEU A 1 87  ? 17.65100 30.49000  27.01600  1.000 31.41000 ?  91  LEU A HD21 1 
ATOM   1082 H  HD22 . LEU A 1 87  ? 18.67200 29.64300  27.89100  1.000 31.41000 ?  91  LEU A HD22 1 
ATOM   1083 H  HD23 . LEU A 1 87  ? 17.37600 30.26700  28.56500  1.000 31.41000 ?  91  LEU A HD23 1 
ATOM   1084 N  N    . ASP A 1 88  ? 20.26500 31.62900  32.68700  1.000 26.38474 ?  92  ASP A N    1 
ATOM   1085 C  CA   . ASP A 1 88  ? 21.21200 31.41000  33.76600  1.000 27.07693 ?  92  ASP A CA   1 
ATOM   1086 C  C    . ASP A 1 88  ? 20.59100 30.77700  35.00500  1.000 25.23987 ?  92  ASP A C    1 
ATOM   1087 O  O    . ASP A 1 88  ? 21.30700 30.55800  35.98900  1.000 25.53201 ?  92  ASP A O    1 
ATOM   1088 C  CB   . ASP A 1 88  ? 21.80200 32.74800  34.23200  1.000 30.77474 ?  92  ASP A CB   1 
ATOM   1089 C  CG   . ASP A 1 88  ? 22.82500 33.32500  33.27900  1.000 34.84102 ?  92  ASP A CG   1 
ATOM   1090 O  OD1  . ASP A 1 88  ? 23.49200 32.55000  32.55700  1.000 36.24382 ?  92  ASP A OD1  1 
ATOM   1091 O  OD2  . ASP A 1 88  ? 22.99500 34.57000  33.29500  1.000 37.24920 -1 92  ASP A OD2  1 
ATOM   1092 H  H    . ASP A 1 88  ? 19.94700 32.42800  32.67200  1.000 31.66000 ?  92  ASP A H    1 
ATOM   1093 H  HA   . ASP A 1 88  ? 21.90700 30.83300  33.41200  1.000 32.49000 ?  92  ASP A HA   1 
ATOM   1094 H  HB2  . ASP A 1 88  ? 21.08300 33.39300  34.32100  1.000 36.93000 ?  92  ASP A HB2  1 
ATOM   1095 H  HB3  . ASP A 1 88  ? 22.23700 32.61600  35.08900  1.000 36.93000 ?  92  ASP A HB3  1 
ATOM   1096 N  N    . THR A 1 89  ? 19.29300 30.50300  35.01300  1.000 24.12921 ?  93  THR A N    1 
ATOM   1097 C  CA   . THR A 1 89  ? 18.64100 30.05700  36.23600  1.000 22.88432 ?  93  THR A CA   1 
ATOM   1098 C  C    . THR A 1 89  ? 19.02300 28.62000  36.54200  1.000 20.83671 ?  93  THR A C    1 
ATOM   1099 O  O    . THR A 1 89  ? 18.89300 27.75300  35.67300  1.000 20.47351 ?  93  THR A O    1 
ATOM   1100 C  CB   . THR A 1 89  ? 17.12700 30.15200  36.07000  1.000 24.65822 ?  93  THR A CB   1 
ATOM   1101 O  OG1  . THR A 1 89  ? 16.74200 31.52000  35.93500  1.000 27.24011 ?  93  THR A OG1  1 
ATOM   1102 C  CG2  . THR A 1 89  ? 16.41800 29.55000  37.27200  1.000 23.98972 ?  93  THR A CG2  1 
ATOM   1103 H  H    . THR A 1 89  ? 18.77200 30.56600  34.33100  1.000 28.95000 ?  93  THR A H    1 
ATOM   1104 H  HA   . THR A 1 89  ? 18.92400 30.61700  36.97600  1.000 27.46000 ?  93  THR A HA   1 
ATOM   1105 H  HB   . THR A 1 89  ? 16.86000 29.66000  35.27700  1.000 29.58000 ?  93  THR A HB   1 
ATOM   1106 H  HG1  . THR A 1 89  ? 17.06800 31.84200  35.23200  1.000 32.68000 ?  93  THR A HG1  1 
ATOM   1107 H  HG21 . THR A 1 89  ? 15.49200 29.83700  37.28900  1.000 28.79000 ?  93  THR A HG21 1 
ATOM   1108 H  HG22 . THR A 1 89  ? 16.44700 28.58100  37.22300  1.000 28.79000 ?  93  THR A HG22 1 
ATOM   1109 H  HG23 . THR A 1 89  ? 16.85200 29.83600  38.09100  1.000 28.79000 ?  93  THR A HG23 1 
ATOM   1110 N  N    A PRO A 1 90  ? 19.53200 28.33000  37.73900  0.310 20.38929 ?  94  PRO A N    1 
ATOM   1111 N  N    B PRO A 1 90  ? 19.45000 28.31100  37.77000  0.690 20.14189 ?  94  PRO A N    1 
ATOM   1112 C  CA   A PRO A 1 90  ? 19.78700 26.93500  38.10700  0.310 19.92081 ?  94  PRO A CA   1 
ATOM   1113 C  CA   B PRO A 1 90  ? 19.83500 26.92700  38.10200  0.690 19.07334 ?  94  PRO A CA   1 
ATOM   1114 C  C    A PRO A 1 90  ? 18.47900 26.17700  38.26000  0.310 19.65236 ?  94  PRO A C    1 
ATOM   1115 C  C    B PRO A 1 90  ? 18.61300 26.08800  38.48400  0.690 18.93122 ?  94  PRO A C    1 
ATOM   1116 O  O    A PRO A 1 90  ? 17.47300 26.72800  38.71100  0.310 20.46298 ?  94  PRO A O    1 
ATOM   1117 O  O    B PRO A 1 90  ? 17.80000 26.49000  39.33200  0.690 18.64171 ?  94  PRO A O    1 
ATOM   1118 C  CB   A PRO A 1 90  ? 20.53600 27.04800  39.44200  0.310 20.25506 ?  94  PRO A CB   1 
ATOM   1119 C  CB   B PRO A 1 90  ? 20.78300 27.10200  39.30300  0.690 19.68131 ?  94  PRO A CB   1 
ATOM   1120 C  CG   A PRO A 1 90  ? 21.06400 28.45500  39.47400  0.310 20.32349 ?  94  PRO A CG   1 
ATOM   1121 C  CG   B PRO A 1 90  ? 20.28100 28.34800  39.98400  0.690 20.75249 ?  94  PRO A CG   1 
ATOM   1122 C  CD   A PRO A 1 90  ? 20.05300 29.27500  38.74500  0.310 20.40771 ?  94  PRO A CD   1 
ATOM   1123 C  CD   B PRO A 1 90  ? 19.80300 29.25300  38.85500  0.690 20.77618 ?  94  PRO A CD   1 
ATOM   1124 H  HA   A PRO A 1 90  ? 20.35600 26.49300  37.45700  0.310 23.90000 ?  94  PRO A HA   1 
ATOM   1125 H  HA   B PRO A 1 90  ? 20.30100 26.51100  37.35900  0.690 22.88000 ?  94  PRO A HA   1 
ATOM   1126 H  HB2  A PRO A 1 90  ? 19.92400 26.89100  40.17800  0.310 24.30000 ?  94  PRO A HB2  1 
ATOM   1127 H  HB2  B PRO A 1 90  ? 20.72300 26.33300  39.89100  0.690 23.61000 ?  94  PRO A HB2  1 
ATOM   1128 H  HB3  A PRO A 1 90  ? 21.26100 26.40500  39.47000  0.310 24.30000 ?  94  PRO A HB3  1 
ATOM   1129 H  HB3  B PRO A 1 90  ? 21.69600 27.21400  38.99500  0.690 23.61000 ?  94  PRO A HB3  1 
ATOM   1130 H  HG2  A PRO A 1 90  ? 21.15200 28.75300  40.39300  0.310 24.38000 ?  94  PRO A HG2  1 
ATOM   1131 H  HG2  B PRO A 1 90  ? 19.55000 28.12500  40.58200  0.690 24.90000 ?  94  PRO A HG2  1 
ATOM   1132 H  HG3  A PRO A 1 90  ? 21.92500 28.49300  39.02900  0.310 24.38000 ?  94  PRO A HG3  1 
ATOM   1133 H  HG3  B PRO A 1 90  ? 21.00200 28.76500  40.48100  0.690 24.90000 ?  94  PRO A HG3  1 
ATOM   1134 H  HD2  A PRO A 1 90  ? 19.34800 29.57000  39.34300  0.310 24.48000 ?  94  PRO A HD2  1 
ATOM   1135 H  HD2  B PRO A 1 90  ? 19.02700 29.76500  39.13100  0.690 24.93000 ?  94  PRO A HD2  1 
ATOM   1136 H  HD3  A PRO A 1 90  ? 20.46900 30.04100  38.32000  0.310 24.48000 ?  94  PRO A HD3  1 
ATOM   1137 H  HD3  B PRO A 1 90  ? 20.51200 29.85100  38.57200  0.690 24.93000 ?  94  PRO A HD3  1 
ATOM   1138 N  N    . ILE A 1 91  ? 18.50400 24.91000  37.86400  1.000 18.71540 ?  95  ILE A N    1 
ATOM   1139 C  CA   . ILE A 1 91  ? 17.38800 23.99400  38.05200  1.000 18.54433 ?  95  ILE A CA   1 
ATOM   1140 C  C    . ILE A 1 91  ? 17.89600 22.74100  38.75000  1.000 18.32851 ?  95  ILE A C    1 
ATOM   1141 O  O    . ILE A 1 91  ? 18.74700 22.01800  38.21400  1.000 18.40221 ?  95  ILE A O    1 
ATOM   1142 C  CB   . ILE A 1 91  ? 16.74000 23.61600  36.70800  1.000 19.07860 ?  95  ILE A CB   1 
ATOM   1143 C  CG1  . ILE A 1 91  ? 16.27200 24.83600  35.92000  1.000 19.64972 ?  95  ILE A CG1  1 
ATOM   1144 C  CG2  . ILE A 1 91  ? 15.59300 22.62400  36.93100  1.000 19.36285 ?  95  ILE A CG2  1 
ATOM   1145 C  CD1  . ILE A 1 91  ? 15.22900 25.66100  36.63400  1.000 21.17622 ?  95  ILE A CD1  1 
ATOM   1146 H  H    A ILE A 1 91  ? 19.17800 24.54700  37.47300  0.310 22.45000 ?  95  ILE A H    1 
ATOM   1147 H  H    B ILE A 1 91  ? 19.09000 24.61200  37.31000  0.690 22.45000 ?  95  ILE A H    1 
ATOM   1148 H  HA   . ILE A 1 91  ? 16.73100 24.42200  38.62300  1.000 22.25000 ?  95  ILE A HA   1 
ATOM   1149 H  HB   . ILE A 1 91  ? 17.42400 23.18800  36.17000  1.000 22.89000 ?  95  ILE A HB   1 
ATOM   1150 H  HG12 . ILE A 1 91  ? 17.03600 25.40900  35.75000  1.000 23.58000 ?  95  ILE A HG12 1 
ATOM   1151 H  HG13 . ILE A 1 91  ? 15.88800 24.53700  35.08100  1.000 23.58000 ?  95  ILE A HG13 1 
ATOM   1152 H  HG21 . ILE A 1 91  ? 15.06500 22.56400  36.11900  1.000 23.23000 ?  95  ILE A HG21 1 
ATOM   1153 H  HG22 . ILE A 1 91  ? 15.96400 21.75500  37.14900  1.000 23.23000 ?  95  ILE A HG22 1 
ATOM   1154 H  HG23 . ILE A 1 91  ? 15.04000 22.94100  37.66300  1.000 23.23000 ?  95  ILE A HG23 1 
ATOM   1155 H  HD11 . ILE A 1 91  ? 14.97100 26.40400  36.06600  1.000 25.41000 ?  95  ILE A HD11 1 
ATOM   1156 H  HD12 . ILE A 1 91  ? 14.45800 25.10300  36.82000  1.000 25.41000 ?  95  ILE A HD12 1 
ATOM   1157 H  HD13 . ILE A 1 91  ? 15.60400 25.99400  37.46400  1.000 25.41000 ?  95  ILE A HD13 1 
ATOM   1158 N  N    A ARG A 1 92  ? 17.37600 22.49300  39.94000  0.490 19.03123 ?  96  ARG A N    1 
ATOM   1159 N  N    B ARG A 1 92  ? 17.38400 22.46900  39.94500  0.510 18.95754 ?  96  ARG A N    1 
ATOM   1160 C  CA   A ARG A 1 92  ? 17.59900 21.24500  40.64600  0.490 19.47076 ?  96  ARG A CA   1 
ATOM   1161 C  CA   B ARG A 1 92  ? 17.68500 21.22700  40.65200  0.510 19.33916 ?  96  ARG A CA   1 
ATOM   1162 C  C    A ARG A 1 92  ? 16.47900 20.27800  40.29800  0.490 18.80752 ?  96  ARG A C    1 
ATOM   1163 C  C    B ARG A 1 92  ? 16.49900 20.27600  40.54000  0.510 18.66540 ?  96  ARG A C    1 
ATOM   1164 O  O    A ARG A 1 92  ? 15.36000 20.68000  39.95700  0.490 19.53918 ?  96  ARG A O    1 
ATOM   1165 O  O    B ARG A 1 92  ? 15.34100 20.69700  40.62600  0.510 18.88911 ?  96  ARG A O    1 
ATOM   1166 C  CB   A ARG A 1 92  ? 17.64600 21.51500  42.15200  0.490 20.72091 ?  96  ARG A CB   1 
ATOM   1167 C  CB   B ARG A 1 92  ? 18.05400 21.48100  42.11400  0.510 20.39981 ?  96  ARG A CB   1 
ATOM   1168 C  CG   A ARG A 1 92  ? 18.58000 22.67900  42.51400  0.490 21.59206 ?  96  ARG A CG   1 
ATOM   1169 C  CG   B ARG A 1 92  ? 19.53300 21.84900  42.33900  0.510 21.84209 ?  96  ARG A CG   1 
ATOM   1170 C  CD   A ARG A 1 92  ? 18.83800 22.78000  44.00800  0.490 22.93696 ?  96  ARG A CD   1 
ATOM   1171 C  CD   B ARG A 1 92  ? 19.88400 21.97200  43.82200  0.510 23.15541 ?  96  ARG A CD   1 
ATOM   1172 N  NE   A ARG A 1 92  ? 18.94300 21.45600  44.60000  0.490 23.22647 ?  96  ARG A NE   1 
ATOM   1173 N  NE   B ARG A 1 92  ? 21.27500 22.36500  44.03800  0.510 23.98709 ?  96  ARG A NE   1 
ATOM   1174 C  CZ   A ARG A 1 92  ? 18.15100 20.99400  45.55700  0.490 23.05013 ?  96  ARG A CZ   1 
ATOM   1175 C  CZ   B ARG A 1 92  ? 22.28100 21.52000  44.22100  0.510 23.56335 ?  96  ARG A CZ   1 
ATOM   1176 N  NH1  A ARG A 1 92  ? 17.24300 21.76200  46.13900  0.490 23.11856 ?  96  ARG A NH1  1 
ATOM   1177 N  NH1  B ARG A 1 92  ? 22.09300 20.21300  44.23000  0.510 23.69758 ?  96  ARG A NH1  1 
ATOM   1178 N  NH2  A ARG A 1 92  ? 18.27200 19.72800  45.93500  0.490 22.49217 ?  96  ARG A NH2  1 
ATOM   1179 N  NH2  B ARG A 1 92  ? 23.50300 22.00100  44.41100  0.510 24.30818 ?  96  ARG A NH2  1 
ATOM   1180 H  H    A ARG A 1 92  ? 16.87800 23.04600  40.37100  0.490 22.84000 ?  96  ARG A H    1 
ATOM   1181 H  H    B ARG A 1 92  ? 16.85300 22.99300  40.37300  0.510 22.75000 ?  96  ARG A H    1 
ATOM   1182 H  HA   A ARG A 1 92  ? 18.44100 20.83500  40.39400  0.490 23.36000 ?  96  ARG A HA   1 
ATOM   1183 H  HA   B ARG A 1 92  ? 18.45300 20.79800  40.24300  0.510 23.20000 ?  96  ARG A HA   1 
ATOM   1184 H  HB2  A ARG A 1 92  ? 16.75400 21.73600  42.46200  0.490 24.86000 ?  96  ARG A HB2  1 
ATOM   1185 H  HB2  B ARG A 1 92  ? 17.51500 22.21500  42.44700  0.510 24.48000 ?  96  ARG A HB2  1 
ATOM   1186 H  HB3  A ARG A 1 92  ? 17.96700 20.71900  42.60500  0.490 24.86000 ?  96  ARG A HB3  1 
ATOM   1187 H  HB3  B ARG A 1 92  ? 17.87100 20.67700  42.62400  0.510 24.48000 ?  96  ARG A HB3  1 
ATOM   1188 H  HG2  A ARG A 1 92  ? 19.43300 22.55100  42.07100  0.490 25.91000 ?  96  ARG A HG2  1 
ATOM   1189 H  HG2  B ARG A 1 92  ? 20.09400 21.15800  41.95300  0.510 26.21000 ?  96  ARG A HG2  1 
ATOM   1190 H  HG3  A ARG A 1 92  ? 18.17600 23.51200  42.22300  0.490 25.91000 ?  96  ARG A HG3  1 
ATOM   1191 H  HG3  B ARG A 1 92  ? 19.71700 22.70100  41.91400  0.510 26.21000 ?  96  ARG A HG3  1 
ATOM   1192 H  HD2  A ARG A 1 92  ? 19.67000 23.25400  44.16300  0.490 27.52000 ?  96  ARG A HD2  1 
ATOM   1193 H  HD2  B ARG A 1 92  ? 19.31500 22.64500  44.22800  0.510 27.78000 ?  96  ARG A HD2  1 
ATOM   1194 H  HD3  A ARG A 1 92  ? 18.10400 23.25100  44.43300  0.490 27.52000 ?  96  ARG A HD3  1 
ATOM   1195 H  HD3  B ARG A 1 92  ? 19.74400 21.11500  44.25400  0.510 27.78000 ?  96  ARG A HD3  1 
ATOM   1196 H  HE   A ARG A 1 92  ? 19.56200 20.93600  44.30700  0.490 27.87000 ?  96  ARG A HE   1 
ATOM   1197 H  HE   B ARG A 1 92  ? 21.45500 23.20600  44.04600  0.510 28.78000 ?  96  ARG A HE   1 
ATOM   1198 H  HH11 A ARG A 1 92  ? 17.15500 22.58300  45.89800  0.490 27.74000 ?  96  ARG A HH11 1 
ATOM   1199 H  HH11 B ARG A 1 92  ? 21.30300 19.89100  44.11500  0.510 28.43000 ?  96  ARG A HH11 1 
ATOM   1200 H  HH12 A ARG A 1 92  ? 16.74000 21.44000  46.75800  0.490 27.74000 ?  96  ARG A HH12 1 
ATOM   1201 H  HH12 B ARG A 1 92  ? 22.75900 19.68300  44.35100  0.510 28.43000 ?  96  ARG A HH12 1 
ATOM   1202 H  HH21 A ARG A 1 92  ? 18.85600 19.22100  45.55900  0.490 26.99000 ?  96  ARG A HH21 1 
ATOM   1203 H  HH21 B ARG A 1 92  ? 23.63500 22.85100  44.41400  0.510 29.17000 ?  96  ARG A HH21 1 
ATOM   1204 H  HH22 A ARG A 1 92  ? 17.76500 19.41400  46.55500  0.490 26.99000 ?  96  ARG A HH22 1 
ATOM   1205 H  HH22 B ARG A 1 92  ? 24.16300 21.46300  44.53100  0.510 29.17000 ?  96  ARG A HH22 1 
ATOM   1206 N  N    . TYR A 1 93  ? 16.79800 18.99200  40.35600  1.000 17.72318 ?  97  TYR A N    1 
ATOM   1207 C  CA   . TYR A 1 93  ? 15.81000 17.97300  40.03000  1.000 17.74423 ?  97  TYR A CA   1 
ATOM   1208 C  C    . TYR A 1 93  ? 16.15100 16.71000  40.79500  1.000 18.01269 ?  97  TYR A C    1 
ATOM   1209 O  O    . TYR A 1 93  ? 17.28900 16.50700  41.22900  1.000 19.05492 ?  97  TYR A O    1 
ATOM   1210 C  CB   . TYR A 1 93  ? 15.72000 17.72800  38.50200  1.000 16.83886 ?  97  TYR A CB   1 
ATOM   1211 C  CG   . TYR A 1 93  ? 17.07100 17.56900  37.82600  1.000 15.79663 ?  97  TYR A CG   1 
ATOM   1212 C  CD1  . TYR A 1 93  ? 17.73900 18.67800  37.32900  1.000 15.93612 ?  97  TYR A CD1  1 
ATOM   1213 C  CD2  . TYR A 1 93  ? 17.66800 16.32700  37.68600  1.000 15.52291 ?  97  TYR A CD2  1 
ATOM   1214 C  CE1  . TYR A 1 93  ? 18.97900 18.55800  36.71900  1.000 15.58608 ?  97  TYR A CE1  1 
ATOM   1215 C  CE2  . TYR A 1 93  ? 18.91600 16.19500  37.06200  1.000 15.43343 ?  97  TYR A CE2  1 
ATOM   1216 C  CZ   . TYR A 1 93  ? 19.55100 17.32500  36.58700  1.000 15.06760 ?  97  TYR A CZ   1 
ATOM   1217 O  OH   . TYR A 1 93  ? 20.78500 17.26100  35.96500  1.000 16.15983 ?  97  TYR A OH   1 
ATOM   1218 H  H    A TYR A 1 93  ? 17.57000 18.68700  40.58000  0.490 21.27000 ?  97  TYR A H    1 
ATOM   1219 H  H    B TYR A 1 93  ? 17.59500 18.67700  40.41800  0.510 21.27000 ?  97  TYR A H    1 
ATOM   1220 H  HA   . TYR A 1 93  ? 14.92700 18.25400  40.31800  1.000 21.29000 ?  97  TYR A HA   1 
ATOM   1221 H  HB2  . TYR A 1 93  ? 15.21300 16.91600  38.34600  1.000 20.20000 ?  97  TYR A HB2  1 
ATOM   1222 H  HB3  . TYR A 1 93  ? 15.27100 18.48400  38.09100  1.000 20.20000 ?  97  TYR A HB3  1 
ATOM   1223 H  HD1  . TYR A 1 93  ? 17.34800 19.51900  37.40600  1.000 19.12000 ?  97  TYR A HD1  1 
ATOM   1224 H  HD2  . TYR A 1 93  ? 17.23500 15.57100  38.01000  1.000 18.62000 ?  97  TYR A HD2  1 
ATOM   1225 H  HE1  . TYR A 1 93  ? 19.41900 19.31300  36.40100  1.000 18.70000 ?  97  TYR A HE1  1 
ATOM   1226 H  HE2  . TYR A 1 93  ? 19.31100 15.35800  36.96900  1.000 18.51000 ?  97  TYR A HE2  1 
ATOM   1227 H  HH   . TYR A 1 93  ? 21.04300 16.46300  35.91900  1.000 19.39000 ?  97  TYR A HH   1 
ATOM   1228 N  N    . GLY A 1 94  ? 15.12700 15.88400  41.00000  1.000 19.26547 ?  98  GLY A N    1 
ATOM   1229 C  CA   . GLY A 1 94  ? 15.33600 14.64800  41.71800  1.000 20.24716 ?  98  GLY A CA   1 
ATOM   1230 C  C    . GLY A 1 94  ? 15.58100 13.47200  40.82300  1.000 19.48392 ?  98  GLY A C    1 
ATOM   1231 O  O    . GLY A 1 94  ? 15.44900 13.53400  39.59600  1.000 19.28652 ?  98  GLY A O    1 
ATOM   1232 H  H    . GLY A 1 94  ? 14.32100 16.02100  40.73500  1.000 23.12000 ?  98  GLY A H    1 
ATOM   1233 H  HA2  . GLY A 1 94  ? 16.10400 14.74700  42.30200  1.000 24.29000 ?  98  GLY A HA2  1 
ATOM   1234 H  HA3  . GLY A 1 94  ? 14.55100 14.45900  42.25600  1.000 24.29000 ?  98  GLY A HA3  1 
ATOM   1235 N  N    . LYS A 1 95  ? 15.94600 12.34800  41.44100  1.000 19.68657 ?  99  LYS A N    1 
ATOM   1236 C  CA   . LYS A 1 95  ? 16.18900 11.13700  40.66000  1.000 20.47877 ?  99  LYS A CA   1 
ATOM   1237 C  C    . LYS A 1 95  ? 14.95400 10.74000  39.86500  1.000 22.06317 ?  99  LYS A C    1 
ATOM   1238 O  O    . LYS A 1 95  ? 15.08000 10.19800  38.76400  1.000 22.42111 ?  99  LYS A O    1 
ATOM   1239 C  CB   . LYS A 1 95  ? 16.62800 10.00800  41.60000  1.000 23.50019 ?  99  LYS A CB   1 
ATOM   1240 C  CG   . LYS A 1 95  ? 17.10500 8.76300   40.87000  1.000 27.17957 ?  99  LYS A CG   1 
ATOM   1241 C  CD   . LYS A 1 95  ? 17.62700 7.68800   41.81200  1.000 30.22994 ?  99  LYS A CD   1 
ATOM   1242 C  CE   . LYS A 1 95  ? 18.00500 6.42400   41.04100  1.000 33.10397 ?  99  LYS A CE   1 
ATOM   1243 N  NZ   . LYS A 1 95  ? 18.48800 5.33800   41.94700  1.000 35.13842 ?  99  LYS A NZ   1 
ATOM   1244 H  H    . LYS A 1 95  ? 16.05800 12.26200  42.28900  1.000 23.62000 ?  99  LYS A H    1 
ATOM   1245 H  HA   . LYS A 1 95  ? 16.90700 11.29100  40.02600  1.000 24.57000 ?  99  LYS A HA   1 
ATOM   1246 H  HB2  . LYS A 1 95  ? 17.35800 10.32700  42.15200  1.000 28.20000 ?  99  LYS A HB2  1 
ATOM   1247 H  HB3  . LYS A 1 95  ? 15.87600 9.75500   42.15800  1.000 28.20000 ?  99  LYS A HB3  1 
ATOM   1248 H  HG2  . LYS A 1 95  ? 16.36400 8.38700   40.36900  1.000 32.61000 ?  99  LYS A HG2  1 
ATOM   1249 H  HG3  . LYS A 1 95  ? 17.82400 9.00600   40.26600  1.000 32.61000 ?  99  LYS A HG3  1 
ATOM   1250 H  HD2  . LYS A 1 95  ? 18.41600 8.01600   42.27100  1.000 36.27000 ?  99  LYS A HD2  1 
ATOM   1251 H  HD3  . LYS A 1 95  ? 16.93900 7.46100   42.45700  1.000 36.27000 ?  99  LYS A HD3  1 
ATOM   1252 H  HE2  . LYS A 1 95  ? 17.22600 6.09700   40.56500  1.000 39.72000 ?  99  LYS A HE2  1 
ATOM   1253 H  HE3  . LYS A 1 95  ? 18.71400 6.63400   40.41400  1.000 39.72000 ?  99  LYS A HE3  1 
ATOM   1254 H  HZ1  . LYS A 1 95  ? 18.71000 4.62000   41.47000  1.000 42.16000 ?  99  LYS A HZ1  1 
ATOM   1255 H  HZ2  . LYS A 1 95  ? 19.20300 5.61400   42.40000  1.000 42.16000 ?  99  LYS A HZ2  1 
ATOM   1256 H  HZ3  . LYS A 1 95  ? 17.84900 5.11500   42.52400  1.000 42.16000 ?  99  LYS A HZ3  1 
ATOM   1257 N  N    . ASN A 1 96  ? 13.75300 11.03100  40.38700  1.000 22.38163 ?  100 ASN A N    1 
ATOM   1258 C  CA   . ASN A 1 96  ? 12.51800 10.69100  39.67800  1.000 24.44504 ?  100 ASN A CA   1 
ATOM   1259 C  C    . ASN A 1 96  ? 12.35800 11.45600  38.36100  1.000 24.07131 ?  100 ASN A C    1 
ATOM   1260 O  O    . ASN A 1 96  ? 11.55500 11.04400  37.51400  1.000 25.95311 ?  100 ASN A O    1 
ATOM   1261 C  CB   . ASN A 1 96  ? 11.30500 10.83100  40.61000  1.000 27.08483 ?  100 ASN A CB   1 
ATOM   1262 C  CG   . ASN A 1 96  ? 11.05500 12.26300  41.09200  1.000 28.86662 ?  100 ASN A CG   1 
ATOM   1263 O  OD1  . ASN A 1 96  ? 11.92200 13.12700  41.04500  1.000 30.50366 ?  100 ASN A OD1  1 
ATOM   1264 N  ND2  . ASN A 1 96  ? 9.84900  12.49800  41.61600  1.000 30.32206 ?  100 ASN A ND2  1 
ATOM   1265 H  H    . ASN A 1 96  ? 13.63000 11.42200  41.14300  1.000 26.85000 ?  100 ASN A H    1 
ATOM   1266 H  HA   . ASN A 1 96  ? 12.54200 9.75400   39.42800  1.000 29.33000 ?  100 ASN A HA   1 
ATOM   1267 H  HB2  . ASN A 1 96  ? 10.51200 10.53700  40.13500  1.000 32.50000 ?  100 ASN A HB2  1 
ATOM   1268 H  HB3  . ASN A 1 96  ? 11.44800 10.27700  41.39300  1.000 32.50000 ?  100 ASN A HB3  1 
ATOM   1269 H  HD21 . ASN A 1 96  ? 9.65100  13.28300  41.90400  1.000 36.38000 ?  100 ASN A HD21 1 
ATOM   1270 H  HD22 . ASN A 1 96  ? 9.27100  11.86300  41.66500  1.000 36.38000 ?  100 ASN A HD22 1 
ATOM   1271 N  N    . ALA A 1 97  ? 13.11500 12.53400  38.15100  1.000 22.68167 ?  101 ALA A N    1 
ATOM   1272 C  CA   . ALA A 1 97  ? 13.07000 13.24000  36.87600  1.000 22.43953 ?  101 ALA A CA   1 
ATOM   1273 C  C    . ALA A 1 97  ? 13.88700 12.54300  35.79300  1.000 21.05252 ?  101 ALA A C    1 
ATOM   1274 O  O    . ALA A 1 97  ? 13.68700 12.83100  34.60200  1.000 21.84999 ?  101 ALA A O    1 
ATOM   1275 C  CB   . ALA A 1 97  ? 13.58400 14.67400  37.04800  1.000 23.77127 ?  101 ALA A CB   1 
ATOM   1276 H  H    . ALA A 1 97  ? 13.65700 12.87100  38.72800  1.000 27.22000 ?  101 ALA A H    1 
ATOM   1277 H  HA   . ALA A 1 97  ? 12.14800 13.28300  36.58000  1.000 26.92000 ?  101 ALA A HA   1 
ATOM   1278 H  HB1  . ALA A 1 97  ? 13.52100 15.13600  36.19800  1.000 28.52000 ?  101 ALA A HB1  1 
ATOM   1279 H  HB2  . ALA A 1 97  ? 13.04100 15.12600  37.71300  1.000 28.52000 ?  101 ALA A HB2  1 
ATOM   1280 H  HB3  . ALA A 1 97  ? 14.50900 14.64500  37.34100  1.000 28.52000 ?  101 ALA A HB3  1 
ATOM   1281 N  N    A LEU A 1 98  ? 14.75000 11.58100  36.15900  0.590 20.23927 ?  102 LEU A N    1 
ATOM   1282 N  N    B LEU A 1 98  ? 14.85200 11.71900  36.17000  0.410 21.35256 ?  102 LEU A N    1 
ATOM   1283 C  CA   A LEU A 1 98  ? 15.72400 11.00900  35.22100  0.590 19.60235 ?  102 LEU A CA   1 
ATOM   1284 C  CA   B LEU A 1 98  ? 15.59000 10.96400  35.17400  0.410 21.70787 ?  102 LEU A CA   1 
ATOM   1285 C  C    A LEU A 1 98  ? 15.17200 9.78200   34.48900  0.590 19.89186 ?  102 LEU A C    1 
ATOM   1286 C  C    B LEU A 1 98  ? 14.62600 9.99200   34.50200  0.410 22.93696 ?  102 LEU A C    1 
ATOM   1287 O  O    A LEU A 1 98  ? 15.47700 8.62500   34.79200  0.590 20.53404 ?  102 LEU A O    1 
ATOM   1288 O  O    B LEU A 1 98  ? 13.98200 9.17600   35.16900  0.410 24.25291 ?  102 LEU A O    1 
ATOM   1289 C  CB   A LEU A 1 98  ? 17.02500 10.66900  35.93700  0.590 19.52866 ?  102 LEU A CB   1 
ATOM   1290 C  CB   B LEU A 1 98  ? 16.76200 10.24800  35.82500  0.410 21.21833 ?  102 LEU A CB   1 
ATOM   1291 C  CG   A LEU A 1 98  ? 17.94000 11.80100  36.36900  0.590 19.74447 ?  102 LEU A CG   1 
ATOM   1292 C  CG   B LEU A 1 98  ? 17.75600 11.22800  36.45800  0.410 20.39192 ?  102 LEU A CG   1 
ATOM   1293 C  CD1  A LEU A 1 98  ? 19.13000 11.22900  37.13500  0.590 20.16558 ?  102 LEU A CD1  1 
ATOM   1294 C  CD1  B LEU A 1 98  ? 18.91700 10.47100  37.08900  0.410 20.50246 ?  102 LEU A CD1  1 
ATOM   1295 C  CD2  A LEU A 1 98  ? 18.41800 12.61000  35.18000  0.590 19.39443 ?  102 LEU A CD2  1 
ATOM   1296 C  CD2  B LEU A 1 98  ? 18.28200 12.25200  35.45700  0.410 20.24980 ?  102 LEU A CD2  1 
ATOM   1297 H  H    A LEU A 1 98  ? 14.79000 11.24400  36.94900  0.590 24.28000 ?  102 LEU A H    1 
ATOM   1298 H  H    B LEU A 1 98  ? 15.09500 11.58100  36.98400  0.410 25.62000 ?  102 LEU A H    1 
ATOM   1299 H  HA   A LEU A 1 98  ? 15.87700 11.68900  34.54600  0.590 23.52000 ?  102 LEU A HA   1 
ATOM   1300 H  HA   B LEU A 1 98  ? 15.96000 11.55000  34.49600  0.410 26.04000 ?  102 LEU A HA   1 
ATOM   1301 H  HB2  A LEU A 1 98  ? 16.79500 10.17900  36.74200  0.590 23.43000 ?  102 LEU A HB2  1 
ATOM   1302 H  HB2  B LEU A 1 98  ? 16.42800 9.66100   36.52100  0.410 25.46000 ?  102 LEU A HB2  1 
ATOM   1303 H  HB3  A LEU A 1 98  ? 17.54600 10.10600  35.34400  0.590 23.43000 ?  102 LEU A HB3  1 
ATOM   1304 H  HB3  B LEU A 1 98  ? 17.23200 9.73100   35.15200  0.410 25.46000 ?  102 LEU A HB3  1 
ATOM   1305 H  HG   A LEU A 1 98  ? 17.44700 12.40400  36.94800  0.590 23.69000 ?  102 LEU A HG   1 
ATOM   1306 H  HG   B LEU A 1 98  ? 17.28300 11.72100  37.14700  0.410 24.47000 ?  102 LEU A HG   1 
ATOM   1307 H  HD11 A LEU A 1 98  ? 18.80400 10.74500  37.91000  0.590 24.20000 ?  102 LEU A HD11 1 
ATOM   1308 H  HD11 B LEU A 1 98  ? 19.54100 11.10900  37.46900  0.410 24.60000 ?  102 LEU A HD11 1 
ATOM   1309 H  HD12 A LEU A 1 98  ? 19.62100 10.62800  36.55200  0.590 24.20000 ?  102 LEU A HD12 1 
ATOM   1310 H  HD12 B LEU A 1 98  ? 18.57400 9.88900   37.78400  0.410 24.60000 ?  102 LEU A HD12 1 
ATOM   1311 H  HD13 A LEU A 1 98  ? 19.70400 11.95800  37.41800  0.590 24.20000 ?  102 LEU A HD13 1 
ATOM   1312 H  HD13 B LEU A 1 98  ? 19.35900 9.94400   36.40400  0.410 24.60000 ?  102 LEU A HD13 1 
ATOM   1313 H  HD21 A LEU A 1 98  ? 19.10000 13.23300  35.47500  0.590 23.27000 ?  102 LEU A HD21 1 
ATOM   1314 H  HD21 B LEU A 1 98  ? 19.00500 12.75200  35.86700  0.410 24.30000 ?  102 LEU A HD21 1 
ATOM   1315 H  HD22 A LEU A 1 98  ? 18.78600 12.00600  34.51500  0.590 23.27000 ?  102 LEU A HD22 1 
ATOM   1316 H  HD22 B LEU A 1 98  ? 18.60700 11.78600  34.67100  0.410 24.30000 ?  102 LEU A HD22 1 
ATOM   1317 H  HD23 A LEU A 1 98  ? 17.66600 13.09500  34.80500  0.590 23.27000 ?  102 LEU A HD23 1 
ATOM   1318 H  HD23 B LEU A 1 98  ? 17.56200 12.85300  35.21100  0.410 24.30000 ?  102 LEU A HD23 1 
ATOM   1319 N  N    A VAL A 1 99  ? 14.40900 10.05000  33.44600  0.590 19.57866 ?  103 VAL A N    1 
ATOM   1320 N  N    B VAL A 1 99  ? 14.46700 10.13700  33.19300  0.410 22.76326 ?  103 VAL A N    1 
ATOM   1321 C  CA   A VAL A 1 99  ? 13.84500 8.98200   32.62900  0.590 19.51550 ?  103 VAL A CA   1 
ATOM   1322 C  CA   B VAL A 1 99  ? 13.74500 9.17400   32.36600  0.410 21.44468 ?  103 VAL A CA   1 
ATOM   1323 C  C    A VAL A 1 99  ? 14.91000 8.45300   31.67200  0.590 18.86279 ?  103 VAL A C    1 
ATOM   1324 C  C    B VAL A 1 99  ? 14.83000 8.55800   31.49100  0.410 20.37086 ?  103 VAL A C    1 
ATOM   1325 O  O    A VAL A 1 99  ? 16.00500 9.02800   31.56800  0.590 18.48643 ?  103 VAL A O    1 
ATOM   1326 O  O    B VAL A 1 99  ? 15.89500 9.16800   31.30700  0.410 20.52615 ?  103 VAL A O    1 
ATOM   1327 C  CB   A VAL A 1 99  ? 12.59000 9.47500   31.89400  0.590 19.46549 ?  103 VAL A CB   1 
ATOM   1328 C  CB   B VAL A 1 99  ? 12.58300 9.81700   31.59700  0.410 21.44994 ?  103 VAL A CB   1 
ATOM   1329 C  CG1  A VAL A 1 99  ? 11.51700 9.88600   32.88800  0.590 20.12610 ?  103 VAL A CG1  1 
ATOM   1330 C  CG1  B VAL A 1 99  ? 12.42600 11.28200  31.98100  0.410 21.53416 ?  103 VAL A CG1  1 
ATOM   1331 C  CG2  A VAL A 1 99  ? 12.97800 10.63300  30.99500  0.590 17.04941 ?  103 VAL A CG2  1 
ATOM   1332 C  CG2  B VAL A 1 99  ? 12.73100 9.63600   30.09400  0.410 20.71564 ?  103 VAL A CG2  1 
ATOM   1333 H  H    A VAL A 1 99  ? 14.20000 10.84300  33.18600  0.590 23.49000 ?  103 VAL A H    1 
ATOM   1334 H  H    B VAL A 1 99  ? 14.77600 10.80400  32.74600  0.410 27.31000 ?  103 VAL A H    1 
ATOM   1335 H  HA   A VAL A 1 99  ? 13.59100 8.23800   33.19700  0.590 23.42000 ?  103 VAL A HA   1 
ATOM   1336 H  HA   B VAL A 1 99  ? 13.31200 8.48000   32.88600  0.410 25.73000 ?  103 VAL A HA   1 
ATOM   1337 H  HB   A VAL A 1 99  ? 12.21800 8.76200   31.35100  0.590 23.36000 ?  103 VAL A HB   1 
ATOM   1338 H  HB   B VAL A 1 99  ? 11.76500 9.36000   31.84700  0.410 25.74000 ?  103 VAL A HB   1 
ATOM   1339 H  HG11 A VAL A 1 99  ? 10.74500 10.21600  32.40100  0.590 24.15000 ?  103 VAL A HG11 1 
ATOM   1340 H  HG11 B VAL A 1 99  ? 11.66400 11.65300  31.50800  0.410 25.84000 ?  103 VAL A HG11 1 
ATOM   1341 H  HG12 A VAL A 1 99  ? 11.26700 9.11400   33.42000  0.590 24.15000 ?  103 VAL A HG12 1 
ATOM   1342 H  HG12 B VAL A 1 99  ? 12.28200 11.34400  32.93800  0.410 25.84000 ?  103 VAL A HG12 1 
ATOM   1343 H  HG13 A VAL A 1 99  ? 11.86800 10.58400  33.46200  0.590 24.15000 ?  103 VAL A HG13 1 
ATOM   1344 H  HG13 B VAL A 1 99  ? 13.23200 11.76200  31.73600  0.410 25.84000 ?  103 VAL A HG13 1 
ATOM   1345 H  HG21 A VAL A 1 99  ? 12.23400 10.83800  30.40700  0.590 20.46000 ?  103 VAL A HG21 1 
ATOM   1346 H  HG21 B VAL A 1 99  ? 12.01100 10.10800  29.64700  0.410 24.86000 ?  103 VAL A HG21 1 
ATOM   1347 H  HG22 A VAL A 1 99  ? 13.18700 11.40400  31.54500  0.590 20.46000 ?  103 VAL A HG22 1 
ATOM   1348 H  HG22 B VAL A 1 99  ? 13.58700 9.99800   29.81500  0.410 24.86000 ?  103 VAL A HG22 1 
ATOM   1349 H  HG23 A VAL A 1 99  ? 13.75400 10.37900  30.47100  0.590 20.46000 ?  103 VAL A HG23 1 
ATOM   1350 H  HG23 B VAL A 1 99  ? 12.68700 8.69000   29.88300  0.410 24.86000 ?  103 VAL A HG23 1 
ATOM   1351 N  N    . PRO A 1 100 ? 14.63900 7.35100   30.97500  1.000 19.92081 ?  104 PRO A N    1 
ATOM   1352 C  CA   . PRO A 1 100 ? 15.65500 6.76800   30.09400  1.000 20.26559 ?  104 PRO A CA   1 
ATOM   1353 C  C    . PRO A 1 100 ? 16.12300 7.75000   29.03500  1.000 18.62592 ?  104 PRO A C    1 
ATOM   1354 O  O    . PRO A 1 100 ? 15.37500 8.60900   28.55800  1.000 18.53643 ?  104 PRO A O    1 
ATOM   1355 C  CB   . PRO A 1 100 ? 14.93700 5.55600   29.48900  1.000 21.12622 ?  104 PRO A CB   1 
ATOM   1356 C  CG   . PRO A 1 100 ? 13.95100 5.15300   30.56300  1.000 21.89473 ?  104 PRO A CG   1 
ATOM   1357 C  CD   . PRO A 1 100 ? 13.47200 6.45900   31.14000  1.000 20.82092 ?  104 PRO A CD   1 
ATOM   1358 H  HA   . PRO A 1 100 ? 16.42400 6.47000   30.60500  1.000 24.32000 ?  104 PRO A HA   1 
ATOM   1359 H  HB2  . PRO A 1 100 ? 14.48100 5.81000   28.67100  1.000 25.35000 ?  104 PRO A HB2  1 
ATOM   1360 H  HB3  . PRO A 1 100 ? 15.57100 4.84500   29.30800  1.000 25.35000 ?  104 PRO A HB3  1 
ATOM   1361 H  HG2  . PRO A 1 100 ? 13.21700 4.65400   30.17200  1.000 26.27000 ?  104 PRO A HG2  1 
ATOM   1362 H  HG3  . PRO A 1 100 ? 14.39500 4.61600   31.23800  1.000 26.27000 ?  104 PRO A HG3  1 
ATOM   1363 H  HD2  . PRO A 1 100 ? 12.70800 6.79500   30.64500  1.000 24.98000 ?  104 PRO A HD2  1 
ATOM   1364 H  HD3  . PRO A 1 100 ? 13.24300 6.35900   32.07700  1.000 24.98000 ?  104 PRO A HD3  1 
ATOM   1365 N  N    . TRP A 1 101 ? 17.40700 7.62300   28.70500  1.000 18.64960 ?  105 TRP A N    1 
ATOM   1366 C  CA   . TRP A 1 101 ? 18.11600 8.46100   27.74300  1.000 18.53380 ?  105 TRP A CA   1 
ATOM   1367 C  C    . TRP A 1 101 ? 18.16400 9.92300   28.20000  1.000 17.56790 ?  105 TRP A C    1 
ATOM   1368 O  O    . TRP A 1 101 ? 17.63200 10.84200  27.56200  1.000 18.07059 ?  105 TRP A O    1 
ATOM   1369 C  CB   . TRP A 1 101 ? 17.56700 8.37100   26.32000  1.000 20.81039 ?  105 TRP A CB   1 
ATOM   1370 C  CG   . TRP A 1 101 ? 18.60300 8.90100   25.39500  1.000 23.92918 ?  105 TRP A CG   1 
ATOM   1371 C  CD1  . TRP A 1 101 ? 18.68800 10.16600  24.86700  1.000 24.09763 ?  105 TRP A CD1  1 
ATOM   1372 C  CD2  . TRP A 1 101 ? 19.75300 8.19500   24.93600  1.000 29.30088 ?  105 TRP A CD2  1 
ATOM   1373 N  NE1  . TRP A 1 101 ? 19.79400 10.26200  24.06000  1.000 27.67174 ?  105 TRP A NE1  1 
ATOM   1374 C  CE2  . TRP A 1 101 ? 20.46900 9.06700   24.09200  1.000 30.02992 ?  105 TRP A CE2  1 
ATOM   1375 C  CE3  . TRP A 1 101 ? 20.24000 6.89800   25.14300  1.000 31.80118 ?  105 TRP A CE3  1 
ATOM   1376 C  CZ2  . TRP A 1 101 ? 21.64900 8.68200   23.45700  1.000 32.63549 ?  105 TRP A CZ2  1 
ATOM   1377 C  CZ3  . TRP A 1 101 ? 21.40400 6.51900   24.51000  1.000 33.54876 ?  105 TRP A CZ3  1 
ATOM   1378 C  CH2  . TRP A 1 101 ? 22.09700 7.40500   23.67800  1.000 33.67246 ?  105 TRP A CH2  1 
ATOM   1379 H  H    . TRP A 1 101 ? 17.91800 7.02100   29.04600  1.000 22.38000 ?  105 TRP A H    1 
ATOM   1380 H  HA   . TRP A 1 101 ? 19.01800 8.10700   27.72100  1.000 22.24000 ?  105 TRP A HA   1 
ATOM   1381 H  HB2  . TRP A 1 101 ? 17.37700 7.44700   26.09300  1.000 24.97000 ?  105 TRP A HB2  1 
ATOM   1382 H  HB3  . TRP A 1 101 ? 16.76100 8.90500   26.23800  1.000 24.97000 ?  105 TRP A HB3  1 
ATOM   1383 H  HD1  . TRP A 1 101 ? 18.08600 10.85500  25.03100  1.000 28.92000 ?  105 TRP A HD1  1 
ATOM   1384 H  HE1  . TRP A 1 101 ? 20.02600 10.95600  23.60800  1.000 33.20000 ?  105 TRP A HE1  1 
ATOM   1385 H  HE3  . TRP A 1 101 ? 19.78700 6.30300   25.69600  1.000 38.16000 ?  105 TRP A HE3  1 
ATOM   1386 H  HZ2  . TRP A 1 101 ? 22.11400 9.26800   22.90400  1.000 39.16000 ?  105 TRP A HZ2  1 
ATOM   1387 H  HZ3  . TRP A 1 101 ? 21.73500 5.66000   24.63700  1.000 40.25000 ?  105 TRP A HZ3  1 
ATOM   1388 H  HH2  . TRP A 1 101 ? 22.88000 7.12100   23.26600  1.000 40.41000 ?  105 TRP A HH2  1 
ATOM   1389 N  N    . SER A 1 102 ? 18.88300 10.11200  29.29900  1.000 17.28365 ?  106 SER A N    1 
ATOM   1390 C  CA   . SER A 1 102 ? 19.16000 11.43300  29.86700  1.000 17.07573 ?  106 SER A CA   1 
ATOM   1391 C  C    . SER A 1 102 ? 20.66400 11.52000  30.10200  1.000 17.20996 ?  106 SER A C    1 
ATOM   1392 O  O    . SER A 1 102 ? 21.13200 11.58900  31.24700  1.000 17.16522 ?  106 SER A O    1 
ATOM   1393 C  CB   . SER A 1 102 ? 18.37900 11.62500  31.16400  1.000 17.15469 ?  106 SER A CB   1 
ATOM   1394 O  OG   . SER A 1 102 ? 16.98600 11.63500  30.89900  1.000 17.34682 ?  106 SER A OG   1 
ATOM   1395 H  H    A SER A 1 102 ? 19.23400 9.47100   29.75200  0.380 20.74000 ?  106 SER A H    1 
ATOM   1396 H  H    B SER A 1 102 ? 19.23400 9.47100   29.75200  0.620 20.74000 ?  106 SER A H    1 
ATOM   1397 H  HA   . SER A 1 102 ? 18.88800 12.13700  29.25800  1.000 20.49000 ?  106 SER A HA   1 
ATOM   1398 H  HB2  . SER A 1 102 ? 18.58300 10.89400  31.77000  1.000 20.58000 ?  106 SER A HB2  1 
ATOM   1399 H  HB3  . SER A 1 102 ? 18.63300 12.47000  31.56700  1.000 20.58000 ?  106 SER A HB3  1 
ATOM   1400 H  HG   . SER A 1 102 ? 16.75600 10.91000  30.54200  1.000 20.81000 ?  106 SER A HG   1 
ATOM   1401 N  N    . PRO A 1 103 ? 21.45800 11.48500  29.02300  1.000 18.16534 ?  107 PRO A N    1 
ATOM   1402 C  CA   . PRO A 1 103 ? 22.90800 11.28900  29.18600  1.000 18.52064 ?  107 PRO A CA   1 
ATOM   1403 C  C    . PRO A 1 103 ? 23.63100 12.45500  29.83100  1.000 17.52579 ?  107 PRO A C    1 
ATOM   1404 O  O    . PRO A 1 103 ? 24.66300 12.23900  30.47200  1.000 19.37074 ?  107 PRO A O    1 
ATOM   1405 C  CB   . PRO A 1 103 ? 23.39900 11.01600  27.75300  1.000 20.29454 ?  107 PRO A CB   1 
ATOM   1406 C  CG   . PRO A 1 103 ? 22.36200 11.64700  26.88400  1.000 20.28138 ?  107 PRO A CG   1 
ATOM   1407 C  CD   . PRO A 1 103 ? 21.06000 11.48900  27.60500  1.000 18.79173 ?  107 PRO A CD   1 
ATOM   1408 H  HA   . PRO A 1 103 ? 23.06500 10.50100  29.72900  1.000 22.22000 ?  107 PRO A HA   1 
ATOM   1409 H  HB2  . PRO A 1 103 ? 24.26700 11.42400  27.61400  1.000 24.35000 ?  107 PRO A HB2  1 
ATOM   1410 H  HB3  . PRO A 1 103 ? 23.45200 10.06000  27.59500  1.000 24.35000 ?  107 PRO A HB3  1 
ATOM   1411 H  HG2  . PRO A 1 103 ? 22.57100 12.58500  26.75600  1.000 24.34000 ?  107 PRO A HG2  1 
ATOM   1412 H  HG3  . PRO A 1 103 ? 22.33500 11.19300  26.02700  1.000 24.34000 ?  107 PRO A HG3  1 
ATOM   1413 H  HD2  . PRO A 1 103 ? 20.46700 12.23200  27.41400  1.000 22.55000 ?  107 PRO A HD2  1 
ATOM   1414 H  HD3  . PRO A 1 103 ? 20.63100 10.65300  27.36500  1.000 22.55000 ?  107 PRO A HD3  1 
ATOM   1415 N  N    . ILE A 1 104 ? 23.14300 13.67700  29.68900  1.000 16.32301 ?  108 ILE A N    1 
ATOM   1416 C  CA   . ILE A 1 104 ? 23.76800 14.82400  30.33600  1.000 16.28880 ?  108 ILE A CA   1 
ATOM   1417 C  C    . ILE A 1 104 ? 23.19200 15.05800  31.72500  1.000 15.79137 ?  108 ILE A C    1 
ATOM   1418 O  O    . ILE A 1 104 ? 23.93600 15.17100  32.70300  1.000 15.95718 ?  108 ILE A O    1 
ATOM   1419 C  CB   . ILE A 1 104 ? 23.65100 16.08800  29.45400  1.000 16.72832 ?  108 ILE A CB   1 
ATOM   1420 C  CG1  . ILE A 1 104 ? 24.17100 15.84500  28.03000  1.000 17.34155 ?  108 ILE A CG1  1 
ATOM   1421 C  CG2  . ILE A 1 104 ? 24.34700 17.25700  30.15200  1.000 18.02321 ?  108 ILE A CG2  1 
ATOM   1422 C  CD1  . ILE A 1 104 ? 25.63600 15.41800  27.94700  1.000 17.98374 ?  108 ILE A CD1  1 
ATOM   1423 H  H    . ILE A 1 104 ? 22.44700 13.87100  29.22200  1.000 19.58000 ?  108 ILE A H    1 
ATOM   1424 H  HA   . ILE A 1 104 ? 24.71300 14.62900  30.43200  1.000 19.55000 ?  108 ILE A HA   1 
ATOM   1425 H  HB   . ILE A 1 104 ? 22.71400 16.31400  29.34900  1.000 20.07000 ?  108 ILE A HB   1 
ATOM   1426 H  HG12 . ILE A 1 104 ? 23.63900 15.14300  27.62400  1.000 20.81000 ?  108 ILE A HG12 1 
ATOM   1427 H  HG13 . ILE A 1 104 ? 24.07700 16.66700  27.52400  1.000 20.81000 ?  108 ILE A HG13 1 
ATOM   1428 H  HG21 . ILE A 1 104 ? 24.39600 18.00600  29.53800  1.000 21.62000 ?  108 ILE A HG21 1 
ATOM   1429 H  HG22 . ILE A 1 104 ? 23.83500 17.50500  30.93700  1.000 21.62000 ?  108 ILE A HG22 1 
ATOM   1430 H  HG23 . ILE A 1 104 ? 25.24000 16.98200  30.41200  1.000 21.62000 ?  108 ILE A HG23 1 
ATOM   1431 H  HD11 . ILE A 1 104 ? 25.89200 15.34900  27.01400  1.000 21.57000 ?  108 ILE A HD11 1 
ATOM   1432 H  HD12 . ILE A 1 104 ? 26.18500 16.08300  28.39200  1.000 21.57000 ?  108 ILE A HD12 1 
ATOM   1433 H  HD13 . ILE A 1 104 ? 25.74000 14.55800  28.38300  1.000 21.57000 ?  108 ILE A HD13 1 
ATOM   1434 N  N    A SER A 1 105 ? 21.86700 15.12000  31.85600  0.740 15.84400 ?  109 SER A N    1 
ATOM   1435 N  N    B SER A 1 105 ? 21.85900 15.14800  31.81100  0.260 15.83611 ?  109 SER A N    1 
ATOM   1436 C  CA   A SER A 1 105 ? 21.27900 15.45500  33.14900  0.740 16.23879 ?  109 SER A CA   1 
ATOM   1437 C  CA   B SER A 1 105 ? 21.20000 15.39800  33.08800  0.260 15.86769 ?  109 SER A CA   1 
ATOM   1438 C  C    A SER A 1 105 ? 21.58000 14.40800  34.21300  0.740 15.53871 ?  109 SER A C    1 
ATOM   1439 C  C    B SER A 1 105 ? 21.70500 14.44800  34.16100  0.260 15.50975 ?  109 SER A C    1 
ATOM   1440 O  O    A SER A 1 105 ? 21.60400 14.74300  35.40800  0.740 14.97022 ?  109 SER A O    1 
ATOM   1441 O  O    B SER A 1 105 ? 21.97700 14.86600  35.29500  0.260 14.95179 ?  109 SER A O    1 
ATOM   1442 C  CB   A SER A 1 105 ? 19.76400 15.68500  32.98700  0.740 16.37565 ?  109 SER A CB   1 
ATOM   1443 C  CB   B SER A 1 105 ? 19.68400 15.20700  32.93400  0.260 16.04929 ?  109 SER A CB   1 
ATOM   1444 O  OG   A SER A 1 105 ? 19.15800 14.56200  32.40700  0.740 15.79663 ?  109 SER A OG   1 
ATOM   1445 O  OG   B SER A 1 105 ? 19.11700 16.19700  32.10200  0.260 16.12299 ?  109 SER A OG   1 
ATOM   1446 H  H    A SER A 1 105 ? 21.30000 14.97600  31.22600  0.740 19.01000 ?  109 SER A H    1 
ATOM   1447 H  H    B SER A 1 105 ? 21.32000 15.06900  31.14600  0.260 19.00000 ?  109 SER A H    1 
ATOM   1448 H  HA   A SER A 1 105 ? 21.66900 16.28400  33.46700  0.740 19.48000 ?  109 SER A HA   1 
ATOM   1449 H  HA   B SER A 1 105 ? 21.38400 16.31100  33.35700  0.260 19.04000 ?  109 SER A HA   1 
ATOM   1450 H  HB2  A SER A 1 105 ? 19.37200 15.84100  33.86100  0.740 19.65000 ?  109 SER A HB2  1 
ATOM   1451 H  HB2  B SER A 1 105 ? 19.51600 14.33600  32.54100  0.260 19.26000 ?  109 SER A HB2  1 
ATOM   1452 H  HB3  A SER A 1 105 ? 19.61900 16.45500  32.41600  0.740 19.65000 ?  109 SER A HB3  1 
ATOM   1453 H  HB3  B SER A 1 105 ? 19.27100 15.26200  33.81000  0.260 19.26000 ?  109 SER A HB3  1 
ATOM   1454 H  HG   A SER A 1 105 ? 19.42800 14.46600  31.61700  0.740 18.95000 ?  109 SER A HG   1 
ATOM   1455 H  HG   B SER A 1 105 ? 18.30500 16.03000  31.97000  0.260 19.34000 ?  109 SER A HG   1 
ATOM   1456 N  N    . GLU A 1 106 ? 21.85200 13.16500  33.81900  1.000 15.85980 ?  110 GLU A N    1 
ATOM   1457 C  CA   . GLU A 1 106 ? 22.20300 12.18500  34.83500  1.000 16.84676 ?  110 GLU A CA   1 
ATOM   1458 C  C    . GLU A 1 106 ? 23.55300 12.49600  35.48600  1.000 15.93875 ?  110 GLU A C    1 
ATOM   1459 O  O    . GLU A 1 106 ? 23.79700 12.07600  36.62000  1.000 17.52052 ?  110 GLU A O    1 
ATOM   1460 C  CB   . GLU A 1 106 ? 22.19500 10.77000  34.27400  1.000 19.03912 ?  110 GLU A CB   1 
ATOM   1461 C  CG   . GLU A 1 106 ? 23.30000 10.50100  33.30100  1.000 20.48930 ?  110 GLU A CG   1 
ATOM   1462 C  CD   . GLU A 1 106 ? 23.18000 9.15900   32.64200  1.000 23.74758 ?  110 GLU A CD   1 
ATOM   1463 O  OE1  . GLU A 1 106 ? 22.14400 8.47900   32.79200  1.000 24.44504 ?  110 GLU A OE1  1 
ATOM   1464 O  OE2  . GLU A 1 106 ? 24.15800 8.78100   31.94000  1.000 26.52686 -1 110 GLU A OE2  1 
ATOM   1465 H  H    A GLU A 1 106 ? 21.84000 12.88000  33.00800  0.740 19.03000 ?  110 GLU A H    1 
ATOM   1466 H  H    B GLU A 1 106 ? 21.75500 12.84900  33.02500  0.260 19.03000 ?  110 GLU A H    1 
ATOM   1467 H  HA   . GLU A 1 106 ? 21.52000 12.21900  35.52200  1.000 20.21000 ?  110 GLU A HA   1 
ATOM   1468 H  HB2  . GLU A 1 106 ? 22.28900 10.14300  35.00900  1.000 22.84000 ?  110 GLU A HB2  1 
ATOM   1469 H  HB3  . GLU A 1 106 ? 21.35400 10.62100  33.81600  1.000 22.84000 ?  110 GLU A HB3  1 
ATOM   1470 H  HG2  . GLU A 1 106 ? 23.28100 11.17800  32.60700  1.000 24.58000 ?  110 GLU A HG2  1 
ATOM   1471 H  HG3  . GLU A 1 106 ? 24.14800 10.53000  33.77000  1.000 24.58000 ?  110 GLU A HG3  1 
ATOM   1472 N  N    A LYS A 1 107 ? 24.43500 13.21400  34.77700  0.460 15.34131 ?  111 LYS A N    1 
ATOM   1473 N  N    B LYS A 1 107 ? 24.44100 13.21200  34.78500  0.540 15.54397 ?  111 LYS A N    1 
ATOM   1474 C  CA   A LYS A 1 107 ? 25.76400 13.57100  35.27000  0.460 15.22025 ?  111 LYS A CA   1 
ATOM   1475 C  CA   B LYS A 1 107 ? 25.75200 13.54900  35.32800  0.540 15.74926 ?  111 LYS A CA   1 
ATOM   1476 C  C    A LYS A 1 107 ? 25.74900 14.78800  36.18800  0.460 14.96232 ?  111 LYS A C    1 
ATOM   1477 C  C    B LYS A 1 107 ? 25.71300 14.73500  36.27900  0.540 15.12287 ?  111 LYS A C    1 
ATOM   1478 O  O    A LYS A 1 107 ? 26.78000 15.09100  36.80200  0.460 14.97285 ?  111 LYS A O    1 
ATOM   1479 O  O    B LYS A 1 107 ? 26.69800 14.96900  36.99600  0.540 15.14392 ?  111 LYS A O    1 
ATOM   1480 C  CB   A LYS A 1 107 ? 26.71400 13.80900  34.08400  0.460 15.33605 ?  111 LYS A CB   1 
ATOM   1481 C  CB   B LYS A 1 107 ? 26.74100 13.84400  34.19700  0.540 16.46250 ?  111 LYS A CB   1 
ATOM   1482 C  CG   A LYS A 1 107 ? 26.96300 12.56100  33.21300  0.460 15.89927 ?  111 LYS A CG   1 
ATOM   1483 C  CG   B LYS A 1 107 ? 26.81500 12.75500  33.13800  0.540 17.56000 ?  111 LYS A CG   1 
ATOM   1484 C  CD   A LYS A 1 107 ? 27.46400 12.90400  31.79500  0.460 17.13627 ?  111 LYS A CD   1 
ATOM   1485 C  CD   B LYS A 1 107 ? 27.03900 11.38500  33.75500  0.540 19.02070 ?  111 LYS A CD   1 
ATOM   1486 C  CE   A LYS A 1 107 ? 27.73900 11.65300  30.94300  0.460 17.95742 ?  111 LYS A CE   1 
ATOM   1487 C  CE   B LYS A 1 107 ? 27.13700 10.31500  32.69000  0.540 20.32612 ?  111 LYS A CE   1 
ATOM   1488 N  NZ   A LYS A 1 107 ? 26.59400 10.70300  30.92500  0.460 18.62592 ?  111 LYS A NZ   1 
ATOM   1489 N  NZ   B LYS A 1 107 ? 27.06800 8.94900   33.25000  0.540 21.16833 ?  111 LYS A NZ   1 
ATOM   1490 H  H    A LYS A 1 107 ? 24.28000 13.51200  33.98500  0.460 18.41000 ?  111 LYS A H    1 
ATOM   1491 H  H    B LYS A 1 107 ? 24.30200 13.51300  33.99200  0.540 18.65000 ?  111 LYS A H    1 
ATOM   1492 H  HA   A LYS A 1 107 ? 26.12000 12.83000  35.78500  0.460 18.26000 ?  111 LYS A HA   1 
ATOM   1493 H  HA   B LYS A 1 107 ? 26.08200 12.77900  35.81800  0.540 18.90000 ?  111 LYS A HA   1 
ATOM   1494 H  HB2  A LYS A 1 107 ? 26.33200 14.49400  33.51400  0.460 18.40000 ?  111 LYS A HB2  1 
ATOM   1495 H  HB2  B LYS A 1 107 ? 26.47400 14.66600  33.75700  0.540 19.75000 ?  111 LYS A HB2  1 
ATOM   1496 H  HB3  A LYS A 1 107 ? 27.57200 14.10300  34.42800  0.460 18.40000 ?  111 LYS A HB3  1 
ATOM   1497 H  HB3  B LYS A 1 107 ? 27.62800 13.94500  34.57900  0.540 19.75000 ?  111 LYS A HB3  1 
ATOM   1498 H  HG2  A LYS A 1 107 ? 27.63400 12.00700  33.64000  0.460 19.07000 ?  111 LYS A HG2  1 
ATOM   1499 H  HG2  B LYS A 1 107 ? 25.98100 12.73300  32.64300  0.540 21.07000 ?  111 LYS A HG2  1 
ATOM   1500 H  HG3  A LYS A 1 107 ? 26.13300 12.06800  33.12400  0.460 19.07000 ?  111 LYS A HG3  1 
ATOM   1501 H  HG3  B LYS A 1 107 ? 27.55300 12.94200  32.53800  0.540 21.07000 ?  111 LYS A HG3  1 
ATOM   1502 H  HD2  A LYS A 1 107 ? 26.79100 13.43400  31.34100  0.460 20.56000 ?  111 LYS A HD2  1 
ATOM   1503 H  HD2  B LYS A 1 107 ? 27.86600 11.39000  34.26100  0.540 22.83000 ?  111 LYS A HD2  1 
ATOM   1504 H  HD3  A LYS A 1 107 ? 28.29100 13.40700  31.86500  0.460 20.56000 ?  111 LYS A HD3  1 
ATOM   1505 H  HD3  B LYS A 1 107 ? 26.29500 11.16900  34.33900  0.540 22.83000 ?  111 LYS A HD3  1 
ATOM   1506 H  HE2  A LYS A 1 107 ? 27.91500 11.92600  30.02900  0.460 21.55000 ?  111 LYS A HE2  1 
ATOM   1507 H  HE2  B LYS A 1 107 ? 26.40200 10.42100  32.06500  0.540 24.39000 ?  111 LYS A HE2  1 
ATOM   1508 H  HE3  A LYS A 1 107 ? 28.50900 11.18800  31.30500  0.460 21.55000 ?  111 LYS A HE3  1 
ATOM   1509 H  HE3  B LYS A 1 107 ? 27.98300 10.40700  32.22500  0.540 24.39000 ?  111 LYS A HE3  1 
ATOM   1510 H  HZ1  A LYS A 1 107 ? 26.80700 9.97900   30.45200  0.460 22.35000 ?  111 LYS A HZ1  1 
ATOM   1511 H  HZ1  B LYS A 1 107 ? 27.16800 8.34900   32.60100  0.540 25.40000 ?  111 LYS A HZ1  1 
ATOM   1512 H  HZ2  A LYS A 1 107 ? 26.39100 10.45600  31.75600  0.460 22.35000 ?  111 LYS A HZ2  1 
ATOM   1513 H  HZ2  B LYS A 1 107 ? 27.71400 8.83500   33.85200  0.540 25.40000 ?  111 LYS A HZ2  1 
ATOM   1514 H  HZ3  A LYS A 1 107 ? 25.88300 11.09000  30.55700  0.460 22.35000 ?  111 LYS A HZ3  1 
ATOM   1515 H  HZ3  B LYS A 1 107 ? 26.28000 8.82100   33.64400  0.540 25.40000 ?  111 LYS A HZ3  1 
ATOM   1516 N  N    . TYR A 1 108 ? 24.60300 15.47500  36.30000  1.000 14.86231 ?  112 TYR A N    1 
ATOM   1517 C  CA   . TYR A 1 108 ? 24.44200 16.67700  37.10700  1.000 14.82546 ?  112 TYR A CA   1 
ATOM   1518 C  C    . TYR A 1 108 ? 23.26900 16.54200  38.07600  1.000 14.82020 ?  112 TYR A C    1 
ATOM   1519 O  O    . TYR A 1 108 ? 22.82700 17.54100  38.64800  1.000 15.21761 ?  112 TYR A O    1 
ATOM   1520 C  CB   . TYR A 1 108 ? 24.29500 17.92700  36.22000  1.000 15.04917 ?  112 TYR A CB   1 
ATOM   1521 C  CG   . TYR A 1 108 ? 25.52400 18.20200  35.35100  1.000 14.26487 ?  112 TYR A CG   1 
ATOM   1522 C  CD1  . TYR A 1 108 ? 25.69500 17.56300  34.13600  1.000 14.42015 ?  112 TYR A CD1  1 
ATOM   1523 C  CD2  . TYR A 1 108 ? 26.50200 19.09100  35.75100  1.000 14.13064 ?  112 TYR A CD2  1 
ATOM   1524 C  CE1  . TYR A 1 108 ? 26.81900 17.78600  33.36400  1.000 14.37014 ?  112 TYR A CE1  1 
ATOM   1525 C  CE2  . TYR A 1 108 ? 27.63000 19.32900  34.98200  1.000 14.47279 ?  112 TYR A CE2  1 
ATOM   1526 C  CZ   . TYR A 1 108 ? 27.77900 18.66900  33.76800  1.000 13.80429 ?  112 TYR A CZ   1 
ATOM   1527 O  OH   . TYR A 1 108 ? 28.88000 18.85500  32.94000  1.000 14.66755 ?  112 TYR A OH   1 
ATOM   1528 H  H    A TYR A 1 108 ? 23.87700 15.24900  35.89900  0.460 17.83000 ?  112 TYR A H    1 
ATOM   1529 H  H    B TYR A 1 108 ? 23.90300 15.29000  35.83600  0.540 17.83000 ?  112 TYR A H    1 
ATOM   1530 H  HA   . TYR A 1 108 ? 25.24400 16.80800  37.63700  1.000 17.79000 ?  112 TYR A HA   1 
ATOM   1531 H  HB2  . TYR A 1 108 ? 23.53400 17.80500  35.63000  1.000 18.06000 ?  112 TYR A HB2  1 
ATOM   1532 H  HB3  . TYR A 1 108 ? 24.15300 18.70000  36.78900  1.000 18.06000 ?  112 TYR A HB3  1 
ATOM   1533 H  HD1  . TYR A 1 108 ? 25.04200 16.97400  33.83400  1.000 17.30000 ?  112 TYR A HD1  1 
ATOM   1534 H  HD2  . TYR A 1 108 ? 26.40100 19.54300  36.55700  1.000 16.95000 ?  112 TYR A HD2  1 
ATOM   1535 H  HE1  . TYR A 1 108 ? 26.92200 17.32900  32.56100  1.000 17.24000 ?  112 TYR A HE1  1 
ATOM   1536 H  HE2  . TYR A 1 108 ? 28.28200 19.92400  35.27600  1.000 17.36000 ?  112 TYR A HE2  1 
ATOM   1537 H  HH   . TYR A 1 108 ? 29.44100 19.35500  33.31500  1.000 17.60000 ?  112 TYR A HH   1 
ATOM   1538 N  N    . LEU A 1 109 ? 22.80500 15.31000  38.32900  1.000 15.91770 ?  113 LEU A N    1 
ATOM   1539 C  CA   . LEU A 1 109 ? 21.71100 15.09400  39.26900  1.000 16.64673 ?  113 LEU A CA   1 
ATOM   1540 C  C    . LEU A 1 109 ? 22.01600 15.72400  40.63000  1.000 16.38354 ?  113 LEU A C    1 
ATOM   1541 O  O    . LEU A 1 109 ? 21.13300 16.33500  41.25100  1.000 16.39670 ?  113 LEU A O    1 
ATOM   1542 C  CB   . LEU A 1 109 ? 21.47700 13.59100  39.43800  1.000 17.02046 ?  113 LEU A CB   1 
ATOM   1543 C  CG   . LEU A 1 109 ? 20.48000 13.18600  40.51100  1.000 17.72318 ?  113 LEU A CG   1 
ATOM   1544 C  CD1  . LEU A 1 109 ? 19.09400 13.70200  40.14900  1.000 18.19692 ?  113 LEU A CD1  1 
ATOM   1545 C  CD2  . LEU A 1 109 ? 20.45100 11.68500  40.74100  1.000 18.63118 ?  113 LEU A CD2  1 
ATOM   1546 H  H    . LEU A 1 109 ? 23.10800 14.59000  37.96900  1.000 19.10000 ?  113 LEU A H    1 
ATOM   1547 H  HA   . LEU A 1 109 ? 20.90500 15.50200  38.91600  1.000 19.97000 ?  113 LEU A HA   1 
ATOM   1548 H  HB2  . LEU A 1 109 ? 21.14900 13.24000  38.59500  1.000 20.42000 ?  113 LEU A HB2  1 
ATOM   1549 H  HB3  . LEU A 1 109 ? 22.32400 13.17700  39.66300  1.000 20.42000 ?  113 LEU A HB3  1 
ATOM   1550 H  HG   . LEU A 1 109 ? 20.76000 13.58400  41.35000  1.000 21.26000 ?  113 LEU A HG   1 
ATOM   1551 H  HD11 . LEU A 1 109 ? 18.46100 13.40800  40.82200  1.000 21.83000 ?  113 LEU A HD11 1 
ATOM   1552 H  HD12 . LEU A 1 109 ? 19.11700 14.67200  40.11800  1.000 21.83000 ?  113 LEU A HD12 1 
ATOM   1553 H  HD13 . LEU A 1 109 ? 18.84200 13.35000  39.28100  1.000 21.83000 ?  113 LEU A HD13 1 
ATOM   1554 H  HD21 . LEU A 1 109 ? 19.80000 11.48300  41.43200  1.000 22.35000 ?  113 LEU A HD21 1 
ATOM   1555 H  HD22 . LEU A 1 109 ? 20.20400 11.24300  39.91400  1.000 22.35000 ?  113 LEU A HD22 1 
ATOM   1556 H  HD23 . LEU A 1 109 ? 21.33200 11.39100  41.02200  1.000 22.35000 ?  113 LEU A HD23 1 
ATOM   1557 N  N    . THR A 1 110 ? 23.24400 15.56900  41.12100  1.000 16.68358 ?  114 THR A N    1 
ATOM   1558 C  CA   . THR A 1 110 ? 23.59400 16.02000  42.45900  1.000 16.42829 ?  114 THR A CA   1 
ATOM   1559 C  C    . THR A 1 110 ? 23.96400 17.49000  42.50400  1.000 16.49671 ?  114 THR A C    1 
ATOM   1560 O  O    . THR A 1 110 ? 24.21100 18.01200  43.59400  1.000 18.10217 ?  114 THR A O    1 
ATOM   1561 C  CB   . THR A 1 110 ? 24.72900 15.16700  43.00400  1.000 17.00993 ?  114 THR A CB   1 
ATOM   1562 O  OG1  . THR A 1 110 ? 25.81300 15.13500  42.04800  1.000 17.23628 ?  114 THR A OG1  1 
ATOM   1563 C  CG2  . THR A 1 110 ? 24.25900 13.75700  43.27500  1.000 18.42063 ?  114 THR A CG2  1 
ATOM   1564 H  H    . THR A 1 110 ? 23.89500 15.20400  40.69300  1.000 20.02000 ?  114 THR A H    1 
ATOM   1565 H  HA   . THR A 1 110 ? 22.83100 15.90100  43.04700  1.000 19.71000 ?  114 THR A HA   1 
ATOM   1566 H  HB   . THR A 1 110 ? 25.04400 15.54600  43.84000  1.000 20.41000 ?  114 THR A HB   1 
ATOM   1567 H  HG1  . THR A 1 110 ? 26.46100 14.70500  42.36300  1.000 20.68000 ?  114 THR A HG1  1 
ATOM   1568 H  HG21 . THR A 1 110 ? 24.98400 13.23200  43.64900  1.000 22.10000 ?  114 THR A HG21 1 
ATOM   1569 H  HG22 . THR A 1 110 ? 23.52100 13.76900  43.90500  1.000 22.10000 ?  114 THR A HG22 1 
ATOM   1570 H  HG23 . THR A 1 110 ? 23.96300 13.34200  42.45000  1.000 22.10000 ?  114 THR A HG23 1 
ATOM   1571 N  N    . THR A 1 111 ? 23.98500 18.17700  41.36000  1.000 15.88612 ?  115 THR A N    1 
ATOM   1572 C  CA   . THR A 1 111 ? 24.38800 19.57200  41.30400  1.000 15.64661 ?  115 THR A CA   1 
ATOM   1573 C  C    . THR A 1 111 ? 23.33100 20.50800  40.73800  1.000 15.59134 ?  115 THR A C    1 
ATOM   1574 O  O    . THR A 1 111 ? 23.33100 21.70100  41.10800  1.000 16.42039 ?  115 THR A O    1 
ATOM   1575 C  CB   . THR A 1 111 ? 25.67700 19.76100  40.47700  1.000 15.57555 ?  115 THR A CB   1 
ATOM   1576 O  OG1  . THR A 1 111 ? 25.46200 19.42100  39.09500  1.000 15.64135 ?  115 THR A OG1  1 
ATOM   1577 C  CG2  . THR A 1 111 ? 26.79800 18.89500  40.99300  1.000 15.76242 ?  115 THR A CG2  1 
ATOM   1578 H  H    . THR A 1 111 ? 23.76800 17.84700  40.59600  1.000 19.06000 ?  115 THR A H    1 
ATOM   1579 H  HA   . THR A 1 111 ? 24.57800 19.84400  42.21500  1.000 18.77000 ?  115 THR A HA   1 
ATOM   1580 H  HB   . THR A 1 111 ? 25.93200 20.69400  40.55000  1.000 18.69000 ?  115 THR A HB   1 
ATOM   1581 H  HG1  . THR A 1 111 ? 24.89200 19.93800  38.75700  1.000 18.77000 ?  115 THR A HG1  1 
ATOM   1582 H  HG21 . THR A 1 111 ? 27.60100 19.04600  40.47100  1.000 18.91000 ?  115 THR A HG21 1 
ATOM   1583 H  HG22 . THR A 1 111 ? 26.98100 19.10900  41.92200  1.000 18.91000 ?  115 THR A HG22 1 
ATOM   1584 H  HG23 . THR A 1 111 ? 26.55100 17.95900  40.92800  1.000 18.91000 ?  115 THR A HG23 1 
ATOM   1585 N  N    . GLY A 1 112 ? 22.44600 20.01100  39.86600  1.000 15.36763 ?  116 GLY A N    1 
ATOM   1586 C  CA   . GLY A 1 112 ? 21.59600 20.87200  39.06400  1.000 15.62293 ?  116 GLY A CA   1 
ATOM   1587 C  C    . GLY A 1 112 ? 22.29200 21.32100  37.78300  1.000 15.43869 ?  116 GLY A C    1 
ATOM   1588 O  O    . GLY A 1 112 ? 23.50200 21.14600  37.60300  1.000 15.39132 ?  116 GLY A O    1 
ATOM   1589 H  H    . GLY A 1 112 ? 22.32500 19.17200  39.72500  1.000 18.44000 ?  116 GLY A H    1 
ATOM   1590 H  HA2  . GLY A 1 112 ? 20.78600 20.39400  38.82400  1.000 18.75000 ?  116 GLY A HA2  1 
ATOM   1591 H  HA3  . GLY A 1 112 ? 21.35700 21.66000  39.57700  1.000 18.75000 ?  116 GLY A HA3  1 
ATOM   1592 N  N    A MET A 1 113 ? 21.50200 21.90500  36.87600  0.390 16.01508 ?  117 MET A N    1 
ATOM   1593 N  N    B MET A 1 113 ? 21.49300 21.90700  36.87700  0.610 15.22288 ?  117 MET A N    1 
ATOM   1594 C  CA   A MET A 1 113 ? 22.00900 22.50700  35.65100  0.390 16.36249 ?  117 MET A CA   1 
ATOM   1595 C  CA   B MET A 1 113 ? 21.95200 22.45200  35.60200  0.610 14.74914 ?  117 MET A CA   1 
ATOM   1596 C  C    A MET A 1 113 ? 21.21500 23.77800  35.38300  0.390 15.98086 ?  117 MET A C    1 
ATOM   1597 C  C    B MET A 1 113 ? 21.18900 23.75100  35.34200  0.610 15.15182 ?  117 MET A C    1 
ATOM   1598 O  O    A MET A 1 113 ? 20.11200 23.96000  35.89700  0.390 16.76517 ?  117 MET A O    1 
ATOM   1599 O  O    B MET A 1 113 ? 20.06300 23.91800  35.80900  0.610 16.23089 ?  117 MET A O    1 
ATOM   1600 C  CB   A MET A 1 113 ? 21.86200 21.56800  34.44600  0.390 17.47052 ?  117 MET A CB   1 
ATOM   1601 C  CB   B MET A 1 113 ? 21.63100 21.49800  34.43700  0.610 15.11497 ?  117 MET A CB   1 
ATOM   1602 C  CG   A MET A 1 113 ? 22.70800 20.32100  34.53800  0.390 17.98637 ?  117 MET A CG   1 
ATOM   1603 C  CG   B MET A 1 113 ? 22.32400 20.14700  34.53000  0.610 14.61491 ?  117 MET A CG   1 
ATOM   1604 S  SD   A MET A 1 113 ? 22.65000 19.32000  33.03900  0.390 19.13914 ?  117 MET A SD   1 
ATOM   1605 S  SD   B MET A 1 113 ? 21.78200 18.95800  33.28000  0.610 15.93875 ?  117 MET A SD   1 
ATOM   1606 C  CE   A MET A 1 113 ? 23.66900 20.23400  31.91200  0.390 21.13938 ?  117 MET A CE   1 
ATOM   1607 C  CE   B MET A 1 113 ? 22.08100 19.88700  31.76900  0.610 16.70727 ?  117 MET A CE   1 
ATOM   1608 H  H    A MET A 1 113 ? 20.64700 21.96400  36.95500  0.390 19.21000 ?  117 MET A H    1 
ATOM   1609 H  H    B MET A 1 113 ? 20.64600 22.00200  36.98800  0.610 18.26000 ?  117 MET A H    1 
ATOM   1610 H  HA   A MET A 1 113 ? 22.95000 22.71000  35.76500  0.390 19.63000 ?  117 MET A HA   1 
ATOM   1611 H  HA   B MET A 1 113 ? 22.90900 22.60300  35.64300  0.610 17.69000 ?  117 MET A HA   1 
ATOM   1612 H  HB2  A MET A 1 113 ? 20.93500 21.29300  34.37600  0.390 20.96000 ?  117 MET A HB2  1 
ATOM   1613 H  HB2  B MET A 1 113 ? 20.67500 21.33800  34.42100  0.610 18.13000 ?  117 MET A HB2  1 
ATOM   1614 H  HB3  A MET A 1 113 ? 22.12700 22.04700  33.64400  0.390 20.96000 ?  117 MET A HB3  1 
ATOM   1615 H  HB3  B MET A 1 113 ? 21.91100 21.91600  33.60700  0.610 18.13000 ?  117 MET A HB3  1 
ATOM   1616 H  HG2  A MET A 1 113 ? 23.63100 20.57600  34.69200  0.390 21.58000 ?  117 MET A HG2  1 
ATOM   1617 H  HG2  B MET A 1 113 ? 23.27900 20.27800  34.41900  0.610 17.53000 ?  117 MET A HG2  1 
ATOM   1618 H  HG3  A MET A 1 113 ? 22.38800 19.77600  35.27400  0.390 21.58000 ?  117 MET A HG3  1 
ATOM   1619 H  HG3  B MET A 1 113 ? 22.14100 19.76300  35.40200  0.610 17.53000 ?  117 MET A HG3  1 
ATOM   1620 H  HE1  A MET A 1 113 ? 24.26300 19.61900  31.45400  0.390 25.36000 ?  117 MET A HE1  1 
ATOM   1621 H  HE1  B MET A 1 113 ? 21.90800 19.31400  31.00600  0.610 20.05000 ?  117 MET A HE1  1 
ATOM   1622 H  HE2  A MET A 1 113 ? 23.10100 20.68700  31.26900  0.390 25.36000 ?  117 MET A HE2  1 
ATOM   1623 H  HE2  B MET A 1 113 ? 21.48800 20.65400  31.74700  0.610 20.05000 ?  117 MET A HE2  1 
ATOM   1624 H  HE3  A MET A 1 113 ? 24.18700 20.88400  32.41100  0.390 25.36000 ?  117 MET A HE3  1 
ATOM   1625 H  HE3  B MET A 1 113 ? 23.00500 20.18300  31.75700  0.610 20.05000 ?  117 MET A HE3  1 
ATOM   1626 N  N    . THR A 1 114 ? 21.76900 24.65700  34.55400  1.000 15.63345 ?  118 THR A N    1 
ATOM   1627 C  CA   . THR A 1 114 ? 21.03700 25.86900  34.19500  1.000 15.57555 ?  118 THR A CA   1 
ATOM   1628 C  C    . THR A 1 114 ? 20.00400 25.57500  33.09900  1.000 15.49923 ?  118 THR A C    1 
ATOM   1629 O  O    . THR A 1 114 ? 20.08500 24.58300  32.37600  1.000 15.38606 ?  118 THR A O    1 
ATOM   1630 C  CB   . THR A 1 114 ? 21.95200 26.99000  33.71000  1.000 17.84424 ?  118 THR A CB   1 
ATOM   1631 O  OG1  . THR A 1 114 ? 22.49900 26.62500  32.44800  1.000 18.16534 ?  118 THR A OG1  1 
ATOM   1632 C  CG2  . THR A 1 114 ? 23.07900 27.26600  34.70700  1.000 18.77594 ?  118 THR A CG2  1 
ATOM   1633 H  H    A THR A 1 114 ? 22.54600 24.57900  34.19500  0.390 18.76000 ?  118 THR A H    1 
ATOM   1634 H  H    B THR A 1 114 ? 22.56100 24.59500  34.22500  0.610 18.76000 ?  118 THR A H    1 
ATOM   1635 H  HA   . THR A 1 114 ? 20.58800 26.18100  34.99600  1.000 18.69000 ?  118 THR A HA   1 
ATOM   1636 H  HB   . THR A 1 114 ? 21.44000 27.80900  33.62400  1.000 21.41000 ?  118 THR A HB   1 
ATOM   1637 H  HG1  . THR A 1 114 ? 22.94700 27.26200  32.13500  1.000 21.80000 ?  118 THR A HG1  1 
ATOM   1638 H  HG21 . THR A 1 114 ? 23.61500 28.01500  34.40200  1.000 22.53000 ?  118 THR A HG21 1 
ATOM   1639 H  HG22 . THR A 1 114 ? 22.70700 27.47900  35.57700  1.000 22.53000 ?  118 THR A HG22 1 
ATOM   1640 H  HG23 . THR A 1 114 ? 23.64800 26.48500  34.79000  1.000 22.53000 ?  118 THR A HG23 1 
ATOM   1641 N  N    . VAL A 1 115 ? 19.05700 26.50100  32.93100  1.000 15.79926 ?  119 VAL A N    1 
ATOM   1642 C  CA   . VAL A 1 115 ? 18.09100 26.38300  31.83900  1.000 16.32827 ?  119 VAL A CA   1 
ATOM   1643 C  C    . VAL A 1 115 ? 18.79500 26.29000  30.49200  1.000 15.84927 ?  119 VAL A C    1 
ATOM   1644 O  O    . VAL A 1 115 ? 18.41800 25.47700  29.63300  1.000 16.35722 ?  119 VAL A O    1 
ATOM   1645 C  CB   . VAL A 1 115 ? 17.08500 27.54800  31.88500  1.000 17.02573 ?  119 VAL A CB   1 
ATOM   1646 C  CG1  . VAL A 1 115 ? 16.24100 27.60500  30.60900  1.000 17.16258 ?  119 VAL A CG1  1 
ATOM   1647 C  CG2  . VAL A 1 115 ? 16.18400 27.42500  33.10900  1.000 17.59685 ?  119 VAL A CG2  1 
ATOM   1648 H  H    . VAL A 1 115 ? 18.95400 27.19500  33.42800  1.000 18.96000 ?  119 VAL A H    1 
ATOM   1649 H  HA   . VAL A 1 115 ? 17.59700 25.55700  31.96200  1.000 19.59000 ?  119 VAL A HA   1 
ATOM   1650 H  HB   . VAL A 1 115 ? 17.58400 28.37800  31.94800  1.000 20.43000 ?  119 VAL A HB   1 
ATOM   1651 H  HG11 . VAL A 1 115 ? 15.50300 28.22000  30.74600  1.000 20.59000 ?  119 VAL A HG11 1 
ATOM   1652 H  HG12 . VAL A 1 115 ? 16.79700 27.91400  29.87600  1.000 20.59000 ?  119 VAL A HG12 1 
ATOM   1653 H  HG13 . VAL A 1 115 ? 15.90100 26.71800  30.41500  1.000 20.59000 ?  119 VAL A HG13 1 
ATOM   1654 H  HG21 . VAL A 1 115 ? 15.56200 28.16900  33.12000  1.000 21.11000 ?  119 VAL A HG21 1 
ATOM   1655 H  HG22 . VAL A 1 115 ? 15.69700 26.58800  33.06000  1.000 21.11000 ?  119 VAL A HG22 1 
ATOM   1656 H  HG23 . VAL A 1 115 ? 16.73300 27.44200  33.90900  1.000 21.11000 ?  119 VAL A HG23 1 
ATOM   1657 N  N    . ALA A 1 116 ? 19.81600 27.12300  30.27300  1.000 16.70990 ?  120 ALA A N    1 
ATOM   1658 C  CA   . ALA A 1 116 ? 20.56400 27.04900  29.02100  1.000 16.75464 ?  120 ALA A CA   1 
ATOM   1659 C  C    . ALA A 1 116 ? 21.21600 25.67900  28.85000  1.000 16.58620 ?  120 ALA A C    1 
ATOM   1660 O  O    . ALA A 1 116 ? 21.22200 25.11700  27.74700  1.000 17.07573 ?  120 ALA A O    1 
ATOM   1661 C  CB   . ALA A 1 116 ? 21.61600 28.15400  28.95800  1.000 17.75213 ?  120 ALA A CB   1 
ATOM   1662 H  H    . ALA A 1 116 ? 20.08900 27.72700  30.82200  1.000 20.05000 ?  120 ALA A H    1 
ATOM   1663 H  HA   . ALA A 1 116 ? 19.94700 27.18600  28.28500  1.000 20.10000 ?  120 ALA A HA   1 
ATOM   1664 H  HB1  . ALA A 1 116 ? 22.11100 28.07200  28.12800  1.000 21.30000 ?  120 ALA A HB1  1 
ATOM   1665 H  HB2  . ALA A 1 116 ? 21.17200 29.01500  28.99500  1.000 21.30000 ?  120 ALA A HB2  1 
ATOM   1666 H  HB3  . ALA A 1 116 ? 22.21800 28.06000  29.71300  1.000 21.30000 ?  120 ALA A HB3  1 
ATOM   1667 N  N    . GLU A 1 117 ? 21.80000 25.13700  29.92000  1.000 16.63884 ?  121 GLU A N    1 
ATOM   1668 C  CA   . GLU A 1 117 ? 22.42400 23.82200  29.82800  1.000 16.26511 ?  121 GLU A CA   1 
ATOM   1669 C  C    . GLU A 1 117 ? 21.39900 22.73300  29.54300  1.000 15.10971 ?  121 GLU A C    1 
ATOM   1670 O  O    . GLU A 1 117 ? 21.67100 21.81500  28.75900  1.000 15.60450 ?  121 GLU A O    1 
ATOM   1671 C  CB   . GLU A 1 117 ? 23.18700 23.51500  31.11400  1.000 16.65726 ?  121 GLU A CB   1 
ATOM   1672 C  CG   . GLU A 1 117 ? 24.41500 24.37400  31.27400  1.000 16.94414 ?  121 GLU A CG   1 
ATOM   1673 C  CD   . GLU A 1 117 ? 25.14300 24.14300  32.57300  1.000 18.08112 ?  121 GLU A CD   1 
ATOM   1674 O  OE1  . GLU A 1 117 ? 24.53300 23.93800  33.64500  1.000 17.92847 ?  121 GLU A OE1  1 
ATOM   1675 O  OE2  . GLU A 1 117 ? 26.38000 24.17700  32.52200  1.000 19.48655 -1 121 GLU A OE2  1 
ATOM   1676 H  H    . GLU A 1 117 ? 21.84600 25.50500  30.69600  1.000 19.96000 ?  121 GLU A H    1 
ATOM   1677 H  HA   . GLU A 1 117 ? 23.05900 23.83200  29.09500  1.000 19.52000 ?  121 GLU A HA   1 
ATOM   1678 H  HB2  . GLU A 1 117 ? 22.60500 23.67600  31.87300  1.000 19.99000 ?  121 GLU A HB2  1 
ATOM   1679 H  HB3  . GLU A 1 117 ? 23.46800 22.58700  31.10200  1.000 19.99000 ?  121 GLU A HB3  1 
ATOM   1680 H  HG2  . GLU A 1 117 ? 25.03000 24.17900  30.55000  1.000 20.33000 ?  121 GLU A HG2  1 
ATOM   1681 H  HG3  . GLU A 1 117 ? 24.15100 25.30700  31.24400  1.000 20.33000 ?  121 GLU A HG3  1 
ATOM   1682 N  N    . LEU A 1 118 ? 20.22200 22.81200  30.16400  1.000 14.80177 ?  122 LEU A N    1 
ATOM   1683 C  CA   . LEU A 1 118 ? 19.18200 21.84000  29.87700  1.000 14.75703 ?  122 LEU A CA   1 
ATOM   1684 C  C    . LEU A 1 118 ? 18.76400 21.94900  28.41700  1.000 14.60965 ?  122 LEU A C    1 
ATOM   1685 O  O    . LEU A 1 118 ? 18.52900 20.93900  27.75600  1.000 14.77546 ?  122 LEU A O    1 
ATOM   1686 C  CB   . LEU A 1 118 ? 17.98000 22.08500  30.79900  1.000 15.28341 ?  122 LEU A CB   1 
ATOM   1687 C  CG   . LEU A 1 118 ? 18.19300 21.73000  32.26500  1.000 16.67568 ?  122 LEU A CG   1 
ATOM   1688 C  CD1  . LEU A 1 118 ? 17.00200 22.27300  33.05100  1.000 18.32062 ?  122 LEU A CD1  1 
ATOM   1689 C  CD2  . LEU A 1 118 ? 18.34200 20.24900  32.49300  1.000 18.17850 ?  122 LEU A CD2  1 
ATOM   1690 H  H    . LEU A 1 118 ? 20.00900 23.40900  30.74500  1.000 17.76000 ?  122 LEU A H    1 
ATOM   1691 H  HA   . LEU A 1 118 ? 19.50900 20.94200  30.04500  1.000 17.71000 ?  122 LEU A HA   1 
ATOM   1692 H  HB2  . LEU A 1 118 ? 17.75500 23.02800  30.76000  1.000 18.33000 ?  122 LEU A HB2  1 
ATOM   1693 H  HB3  . LEU A 1 118 ? 17.23600 21.55200  30.47700  1.000 18.33000 ?  122 LEU A HB3  1 
ATOM   1694 H  HG   . LEU A 1 118 ? 19.02300 22.12600  32.57300  1.000 20.01000 ?  122 LEU A HG   1 
ATOM   1695 H  HD11 . LEU A 1 118 ? 17.10300 22.03100  33.98500  1.000 21.98000 ?  122 LEU A HD11 1 
ATOM   1696 H  HD12 . LEU A 1 118 ? 16.97800 23.23900  32.96000  1.000 21.98000 ?  122 LEU A HD12 1 
ATOM   1697 H  HD13 . LEU A 1 118 ? 16.18600 21.88700  32.69500  1.000 21.98000 ?  122 LEU A HD13 1 
ATOM   1698 H  HD21 . LEU A 1 118 ? 18.48200 20.08900  33.44000  1.000 21.81000 ?  122 LEU A HD21 1 
ATOM   1699 H  HD22 . LEU A 1 118 ? 17.53400 19.80100  32.19800  1.000 21.81000 ?  122 LEU A HD22 1 
ATOM   1700 H  HD23 . LEU A 1 118 ? 19.10300 19.92600  31.98600  1.000 21.81000 ?  122 LEU A HD23 1 
ATOM   1701 N  N    . SER A 1 119 ? 18.67000 23.17700  27.90000  1.000 15.09918 ?  123 SER A N    1 
ATOM   1702 C  CA   . SER A 1 119 ? 18.26900 23.37500  26.51400  1.000 15.15971 ?  123 SER A CA   1 
ATOM   1703 C  C    . SER A 1 119 ? 19.29900 22.78600  25.57100  1.000 15.15182 ?  123 SER A C    1 
ATOM   1704 O  O    . SER A 1 119 ? 18.94200 22.10800  24.59900  1.000 15.17287 ?  123 SER A O    1 
ATOM   1705 C  CB   . SER A 1 119 ? 18.08400 24.86400  26.24400  1.000 15.44396 ?  123 SER A CB   1 
ATOM   1706 O  OG   . SER A 1 119 ? 17.03400 25.40500  27.03000  1.000 16.17299 ?  123 SER A OG   1 
ATOM   1707 H  H    . SER A 1 119 ? 18.83200 23.90300  28.33000  1.000 18.12000 ?  123 SER A H    1 
ATOM   1708 H  HA   . SER A 1 119 ? 17.42100 22.93000  26.35700  1.000 18.19000 ?  123 SER A HA   1 
ATOM   1709 H  HB2  . SER A 1 119 ? 18.90900 25.32700  26.46000  1.000 18.53000 ?  123 SER A HB2  1 
ATOM   1710 H  HB3  . SER A 1 119 ? 17.87000 24.98800  25.30600  1.000 18.53000 ?  123 SER A HB3  1 
ATOM   1711 H  HG   . SER A 1 119 ? 17.22600 25.34400  27.84600  1.000 19.41000 ?  123 SER A HG   1 
ATOM   1712 N  N    . ALA A 1 120 ? 20.58700 23.07200  25.82300  1.000 15.60713 ?  124 ALA A N    1 
ATOM   1713 C  CA   . ALA A 1 120 ? 21.64500 22.49400  24.99900  1.000 16.49145 ?  124 ALA A CA   1 
ATOM   1714 C  C    . ALA A 1 120 ? 21.61900 20.96900  25.06300  1.000 15.82295 ?  124 ALA A C    1 
ATOM   1715 O  O    . ALA A 1 120 ? 21.81900 20.30400  24.04000  1.000 16.73359 ?  124 ALA A O    1 
ATOM   1716 C  CB   . ALA A 1 120 ? 23.01200 23.04700  25.42200  1.000 17.34682 ?  124 ALA A CB   1 
ATOM   1717 H  H    . ALA A 1 120 ? 20.86400 23.58700  26.45300  1.000 18.73000 ?  124 ALA A H    1 
ATOM   1718 H  HA   . ALA A 1 120 ? 21.50300 22.75300  24.07500  1.000 19.79000 ?  124 ALA A HA   1 
ATOM   1719 H  HB1  . ALA A 1 120 ? 23.69900 22.65200  24.86300  1.000 20.81000 ?  124 ALA A HB1  1 
ATOM   1720 H  HB2  . ALA A 1 120 ? 23.01000 24.01100  25.31200  1.000 20.81000 ?  124 ALA A HB2  1 
ATOM   1721 H  HB3  . ALA A 1 120 ? 23.17000 22.82100  26.35200  1.000 20.81000 ?  124 ALA A HB3  1 
ATOM   1722 N  N    . ALA A 1 121 ? 21.38800 20.38900  26.25600  1.000 15.29920 ?  125 ALA A N    1 
ATOM   1723 C  CA   . ALA A 1 121 ? 21.35700 18.93100  26.36800  1.000 15.34131 ?  125 ALA A CA   1 
ATOM   1724 C  C    . ALA A 1 121 ? 20.17700 18.34000  25.60700  1.000 15.08602 ?  125 ALA A C    1 
ATOM   1725 O  O    . ALA A 1 121 ? 20.30900 17.29100  24.96000  1.000 15.44396 ?  125 ALA A O    1 
ATOM   1726 C  CB   . ALA A 1 121 ? 21.29500 18.51100  27.83500  1.000 15.63609 ?  125 ALA A CB   1 
ATOM   1727 H  H    . ALA A 1 121 ? 21.25200 20.81100  26.99300  1.000 18.36000 ?  125 ALA A H    1 
ATOM   1728 H  HA   . ALA A 1 121 ? 22.17600 18.58000  25.98600  1.000 18.40000 ?  125 ALA A HA   1 
ATOM   1729 H  HB1  . ALA A 1 121 ? 21.27400 17.54200  27.88500  1.000 18.76000 ?  125 ALA A HB1  1 
ATOM   1730 H  HB2  . ALA A 1 121 ? 22.08000 18.84900  28.29400  1.000 18.76000 ?  125 ALA A HB2  1 
ATOM   1731 H  HB3  . ALA A 1 121 ? 20.49300 18.88100  28.23600  1.000 18.76000 ?  125 ALA A HB3  1 
ATOM   1732 N  N    . ALA A 1 122 ? 19.00800 18.98600  25.71000  1.000 15.08602 ?  126 ALA A N    1 
ATOM   1733 C  CA   . ALA A 1 122 ? 17.82800 18.54500  24.96700  1.000 14.37541 ?  126 ALA A CA   1 
ATOM   1734 C  C    . ALA A 1 122 ? 18.08900 18.55100  23.46300  1.000 14.31487 ?  126 ALA A C    1 
ATOM   1735 O  O    . ALA A 1 122 ? 17.70000 17.61800  22.75200  1.000 15.08076 ?  126 ALA A O    1 
ATOM   1736 C  CB   . ALA A 1 122 ? 16.64100 19.43600  25.30300  1.000 14.34909 ?  126 ALA A CB   1 
ATOM   1737 H  H    . ALA A 1 122 ? 18.87500 19.67900  26.20200  1.000 18.10000 ?  126 ALA A H    1 
ATOM   1738 H  HA   . ALA A 1 122 ? 17.61100 17.63700  25.23200  1.000 17.25000 ?  126 ALA A HA   1 
ATOM   1739 H  HB1  . ALA A 1 122 ? 15.87100 19.14200  24.79300  1.000 17.22000 ?  126 ALA A HB1  1 
ATOM   1740 H  HB2  . ALA A 1 122 ? 16.45400 19.36800  26.25300  1.000 17.22000 ?  126 ALA A HB2  1 
ATOM   1741 H  HB3  . ALA A 1 122 ? 16.86000 20.35300  25.07400  1.000 17.22000 ?  126 ALA A HB3  1 
ATOM   1742 N  N    . VAL A 1 123 ? 18.76700 19.58400  22.96300  1.000 14.02010 ?  127 VAL A N    1 
ATOM   1743 C  CA   . VAL A 1 123 ? 19.02900 19.67900  21.52900  1.000 14.47805 ?  127 VAL A CA   1 
ATOM   1744 C  C    . VAL A 1 123 ? 20.13400 18.72000  21.10000  1.000 14.89126 ?  127 VAL A C    1 
ATOM   1745 O  O    . VAL A 1 123 ? 19.99000 17.98800  20.11800  1.000 15.74136 ?  127 VAL A O    1 
ATOM   1746 C  CB   . VAL A 1 123 ? 19.36100 21.12400  21.11100  1.000 14.24644 ?  127 VAL A CB   1 
ATOM   1747 C  CG1  . VAL A 1 123 ? 19.77800 21.18000  19.63500  1.000 15.12813 ?  127 VAL A CG1  1 
ATOM   1748 C  CG2  . VAL A 1 123 ? 18.19800 22.06100  21.38500  1.000 15.00443 ?  127 VAL A CG2  1 
ATOM   1749 H  H    . VAL A 1 123 ? 19.08300 20.23600  23.42800  1.000 16.82000 ?  127 VAL A H    1 
ATOM   1750 H  HA   . VAL A 1 123 ? 18.21200 19.41900  21.07600  1.000 17.37000 ?  127 VAL A HA   1 
ATOM   1751 H  HB   . VAL A 1 123 ? 20.11000 21.43000  21.64600  1.000 17.09000 ?  127 VAL A HB   1 
ATOM   1752 H  HG11 . VAL A 1 123 ? 19.74900 22.10100  19.33400  1.000 18.15000 ?  127 VAL A HG11 1 
ATOM   1753 H  HG12 . VAL A 1 123 ? 20.68000 20.83200  19.54800  1.000 18.15000 ?  127 VAL A HG12 1 
ATOM   1754 H  HG13 . VAL A 1 123 ? 19.16400 20.64100  19.11300  1.000 18.15000 ?  127 VAL A HG13 1 
ATOM   1755 H  HG21 . VAL A 1 123 ? 18.46800 22.96900  21.17800  1.000 18.00000 ?  127 VAL A HG21 1 
ATOM   1756 H  HG22 . VAL A 1 123 ? 17.44700 21.80400  20.82700  1.000 18.00000 ?  127 VAL A HG22 1 
ATOM   1757 H  HG23 . VAL A 1 123 ? 17.95200 21.99400  22.32100  1.000 18.00000 ?  127 VAL A HG23 1 
ATOM   1758 N  N    . GLN A 1 124 ? 21.25500 18.71700  21.81700  1.000 15.23077 ?  128 GLN A N    1 
ATOM   1759 C  CA   . GLN A 1 124 ? 22.49600 18.15200  21.29900  1.000 15.95191 ?  128 GLN A CA   1 
ATOM   1760 C  C    . GLN A 1 124 ? 22.71200 16.70800  21.70200  1.000 15.83874 ?  128 GLN A C    1 
ATOM   1761 O  O    . GLN A 1 124 ? 23.50500 16.02000  21.05300  1.000 15.94402 ?  128 GLN A O    1 
ATOM   1762 C  CB   . GLN A 1 124 ? 23.68900 19.00800  21.75400  1.000 17.24417 ?  128 GLN A CB   1 
ATOM   1763 C  CG   . GLN A 1 124 ? 23.59900 20.44900  21.31500  1.000 18.06006 ?  128 GLN A CG   1 
ATOM   1764 C  CD   . GLN A 1 124 ? 24.71800 21.30100  21.83800  1.000 19.23389 ?  128 GLN A CD   1 
ATOM   1765 O  OE1  . GLN A 1 124 ? 25.24900 21.06400  22.93600  1.000 21.86841 ?  128 GLN A OE1  1 
ATOM   1766 N  NE2  . GLN A 1 124 ? 25.06100 22.32900  21.07600  1.000 19.32074 ?  128 GLN A NE2  1 
ATOM   1767 H  H    . GLN A 1 124 ? 21.32300 19.03800  22.61200  1.000 18.28000 ?  128 GLN A H    1 
ATOM   1768 H  HA   . GLN A 1 124 ? 22.47000 18.17400  20.33000  1.000 19.14000 ?  128 GLN A HA   1 
ATOM   1769 H  HB2  . GLN A 1 124 ? 23.73100 18.99600  22.72300  1.000 20.69000 ?  128 GLN A HB2  1 
ATOM   1770 H  HB3  . GLN A 1 124 ? 24.50200 18.63400  21.38100  1.000 20.69000 ?  128 GLN A HB3  1 
ATOM   1771 H  HG2  . GLN A 1 124 ? 23.62700 20.48300  20.34600  1.000 21.67000 ?  128 GLN A HG2  1 
ATOM   1772 H  HG3  . GLN A 1 124 ? 22.76400 20.82300  21.63700  1.000 21.67000 ?  128 GLN A HG3  1 
ATOM   1773 H  HE21 . GLN A 1 124 ? 24.64900 22.47000  20.33500  1.000 23.18000 ?  128 GLN A HE21 1 
ATOM   1774 H  HE22 . GLN A 1 124 ? 25.69600 22.85400  21.32300  1.000 23.18000 ?  128 GLN A HE22 1 
ATOM   1775 N  N    . TYR A 1 125 ? 22.00200 16.23700  22.72900  1.000 15.92823 ?  129 TYR A N    1 
ATOM   1776 C  CA   . TYR A 1 125 ? 22.06500 14.86500  23.20300  1.000 16.75464 ?  129 TYR A CA   1 
ATOM   1777 C  C    . TYR A 1 125 ? 20.66800 14.26200  23.29300  1.000 15.98350 ?  129 TYR A C    1 
ATOM   1778 O  O    . TYR A 1 125 ? 20.53000 13.12100  23.74500  1.000 17.17574 ?  129 TYR A O    1 
ATOM   1779 C  CB   . TYR A 1 125 ? 22.77100 14.78200  24.56800  1.000 17.04678 ?  129 TYR A CB   1 
ATOM   1780 C  CG   . TYR A 1 125 ? 24.23000 15.12700  24.44300  1.000 18.12059 ?  129 TYR A CG   1 
ATOM   1781 C  CD1  . TYR A 1 125 ? 24.65300 16.44500  24.51900  1.000 19.17072 ?  129 TYR A CD1  1 
ATOM   1782 C  CD2  . TYR A 1 125 ? 25.17500 14.14500  24.19600  1.000 19.22862 ?  129 TYR A CD2  1 
ATOM   1783 C  CE1  . TYR A 1 125 ? 25.99400 16.77800  24.37300  1.000 20.51562 ?  129 TYR A CE1  1 
ATOM   1784 C  CE2  . TYR A 1 125 ? 26.52200 14.46300  24.06200  1.000 20.29191 ?  129 TYR A CE2  1 
ATOM   1785 C  CZ   . TYR A 1 125 ? 26.92000 15.77900  24.15500  1.000 20.91567 ?  129 TYR A CZ   1 
ATOM   1786 O  OH   . TYR A 1 125 ? 28.25800 16.08700  23.99500  1.000 23.67126 ?  129 TYR A OH   1 
ATOM   1787 H  H    . TYR A 1 125 ? 21.45300 16.71900  23.18400  1.000 19.11000 ?  129 TYR A H    1 
ATOM   1788 H  HA   . TYR A 1 125 ? 22.60400 14.32800  22.60100  1.000 20.10000 ?  129 TYR A HA   1 
ATOM   1789 H  HB2  . TYR A 1 125 ? 22.35800 15.40800  25.18300  1.000 20.45000 ?  129 TYR A HB2  1 
ATOM   1790 H  HB3  . TYR A 1 125 ? 22.69700 13.87900  24.91500  1.000 20.45000 ?  129 TYR A HB3  1 
ATOM   1791 H  HD1  . TYR A 1 125 ? 24.02900 17.11800  24.67100  1.000 23.00000 ?  129 TYR A HD1  1 
ATOM   1792 H  HD2  . TYR A 1 125 ? 24.90400 13.25900  24.11800  1.000 23.07000 ?  129 TYR A HD2  1 
ATOM   1793 H  HE1  . TYR A 1 125 ? 26.26500 17.66600  24.42100  1.000 24.62000 ?  129 TYR A HE1  1 
ATOM   1794 H  HE2  . TYR A 1 125 ? 27.14900 13.79200  23.91100  1.000 24.35000 ?  129 TYR A HE2  1 
ATOM   1795 H  HH   . TYR A 1 125 ? 28.35400 16.91900  23.92400  1.000 28.40000 ?  129 TYR A HH   1 
ATOM   1796 N  N    A SER A 1 126 ? 19.62500 14.98300  22.87100  0.290 15.39658 ?  130 SER A N    1 
ATOM   1797 N  N    B SER A 1 126 ? 19.63600 15.00400  22.89200  0.710 15.10444 ?  130 SER A N    1 
ATOM   1798 C  CA   A SER A 1 126 ? 18.24800 14.48800  22.95500  0.290 15.28341 ?  130 SER A CA   1 
ATOM   1799 C  CA   B SER A 1 126 ? 18.26400 14.51800  22.95300  0.710 15.35184 ?  130 SER A CA   1 
ATOM   1800 C  C    A SER A 1 126 ? 17.86100 14.11700  24.38500  0.290 14.91231 ?  130 SER A C    1 
ATOM   1801 C  C    B SER A 1 126 ? 17.86400 14.12600  24.37300  0.710 14.60701 ?  130 SER A C    1 
ATOM   1802 O  O    A SER A 1 126 ? 17.06400 13.20400  24.61000  0.290 14.72019 ?  130 SER A O    1 
ATOM   1803 O  O    B SER A 1 126 ? 17.04800 13.22500  24.57200  0.710 14.15170 ?  130 SER A O    1 
ATOM   1804 C  CB   A SER A 1 126 ? 18.01700 13.30300  22.01600  0.290 15.44396 ?  130 SER A CB   1 
ATOM   1805 C  CB   B SER A 1 126 ? 18.07200 13.36600  21.98200  0.710 16.02034 ?  130 SER A CB   1 
ATOM   1806 O  OG   A SER A 1 126 ? 17.87800 13.72700  20.67600  0.290 14.67281 ?  130 SER A OG   1 
ATOM   1807 O  OG   B SER A 1 126 ? 16.82000 13.51200  21.37700  0.710 14.78862 ?  130 SER A OG   1 
ATOM   1808 H  H    A SER A 1 126 ? 19.69100 15.76900  22.52900  0.290 18.47000 ?  130 SER A H    1 
ATOM   1809 H  H    B SER A 1 126 ? 19.70800 15.80100  22.57700  0.710 18.12000 ?  130 SER A H    1 
ATOM   1810 H  HA   A SER A 1 126 ? 17.66100 15.20700  22.67400  0.290 18.33000 ?  130 SER A HA   1 
ATOM   1811 H  HA   B SER A 1 126 ? 17.66200 15.23200  22.69100  0.710 18.42000 ?  130 SER A HA   1 
ATOM   1812 H  HB2  A SER A 1 126 ? 18.77600 12.70100  22.07700  0.290 18.53000 ?  130 SER A HB2  1 
ATOM   1813 H  HB2  B SER A 1 126 ? 18.76700 13.39000  21.30500  0.710 19.22000 ?  130 SER A HB2  1 
ATOM   1814 H  HB3  A SER A 1 126 ? 17.20700 12.84300  22.28500  0.290 18.53000 ?  130 SER A HB3  1 
ATOM   1815 H  HB3  B SER A 1 126 ? 18.10700 12.52400  22.46300  0.710 19.22000 ?  130 SER A HB3  1 
ATOM   1816 H  HG   A SER A 1 126 ? 17.79500 13.06100  20.17100  0.290 17.60000 ?  130 SER A HG   1 
ATOM   1817 H  HG   B SER A 1 126 ? 16.70900 12.91300  20.79800  0.710 17.74000 ?  130 SER A HG   1 
ATOM   1818 N  N    . ASP A 1 127 ? 18.40600 14.82800  25.36200  1.000 15.05444 ?  131 ASP A N    1 
ATOM   1819 C  CA   . ASP A 1 127 ? 18.22900 14.46500  26.77100  1.000 14.47279 ?  131 ASP A CA   1 
ATOM   1820 C  C    . ASP A 1 127 ? 16.76300 14.54000  27.19700  1.000 13.98589 ?  131 ASP A C    1 
ATOM   1821 O  O    . ASP A 1 127 ? 16.13800 15.60400  27.13900  1.000 14.80704 ?  131 ASP A O    1 
ATOM   1822 C  CB   . ASP A 1 127 ? 19.11000 15.41000  27.58900  1.000 14.99390 ?  131 ASP A CB   1 
ATOM   1823 C  CG   . ASP A 1 127 ? 19.30600 14.96400  29.03200  1.000 15.45975 ?  131 ASP A CG   1 
ATOM   1824 O  OD1  . ASP A 1 127 ? 18.31000 14.99000  29.80000  1.000 15.23077 ?  131 ASP A OD1  1 
ATOM   1825 O  OD2  . ASP A 1 127 ? 20.45500 14.60500  29.41500  1.000 15.77821 -1 131 ASP A OD2  1 
ATOM   1826 H  H    . ASP A 1 127 ? 18.88800 15.53000  25.24400  1.000 18.06000 ?  131 ASP A H    1 
ATOM   1827 H  HA   . ASP A 1 127 ? 18.49600 13.54500  26.92700  1.000 17.36000 ?  131 ASP A HA   1 
ATOM   1828 H  HB2  . ASP A 1 127 ? 19.98500 15.46200  27.17300  1.000 17.99000 ?  131 ASP A HB2  1 
ATOM   1829 H  HB3  . ASP A 1 127 ? 18.69800 16.28800  27.60400  1.000 17.99000 ?  131 ASP A HB3  1 
ATOM   1830 N  N    . ASN A 1 128 ? 16.22100 13.40800  27.65000  1.000 14.21223 ?  132 ASN A N    1 
ATOM   1831 C  CA   . ASN A 1 128 ? 14.79000 13.34900  27.95700  1.000 14.75966 ?  132 ASN A CA   1 
ATOM   1832 C  C    . ASN A 1 128 ? 14.42600 14.03400  29.26900  1.000 14.72808 ?  132 ASN A C    1 
ATOM   1833 O  O    . ASN A 1 128 ? 13.40900 14.73400  29.33200  1.000 15.19656 ?  132 ASN A O    1 
ATOM   1834 C  CB   . ASN A 1 128 ? 14.31500 11.89700  27.99000  1.000 15.07812 ?  132 ASN A CB   1 
ATOM   1835 C  CG   . ASN A 1 128 ? 14.01700 11.36900  26.61200  1.000 15.00969 ?  132 ASN A CG   1 
ATOM   1836 O  OD1  . ASN A 1 128 ? 13.47000 12.07700  25.76600  1.000 15.51502 ?  132 ASN A OD1  1 
ATOM   1837 N  ND2  . ASN A 1 128 ? 14.33500 10.10800  26.38400  1.000 16.66516 ?  132 ASN A ND2  1 
ATOM   1838 H  H    . ASN A 1 128 ? 16.65000 12.67500  27.78500  1.000 17.05000 ?  132 ASN A H    1 
ATOM   1839 H  HA   . ASN A 1 128 ? 14.32600 13.81800  27.24600  1.000 17.71000 ?  132 ASN A HA   1 
ATOM   1840 H  HB2  . ASN A 1 128 ? 15.00800 11.34400  28.38300  1.000 18.09000 ?  132 ASN A HB2  1 
ATOM   1841 H  HB3  . ASN A 1 128 ? 13.50400 11.83900  28.51900  1.000 18.09000 ?  132 ASN A HB3  1 
ATOM   1842 H  HD21 . ASN A 1 128 ? 14.18500 9.75900   25.61300  1.000 20.00000 ?  132 ASN A HD21 1 
ATOM   1843 H  HD22 . ASN A 1 128 ? 14.69300 9.63600   27.00700  1.000 20.00000 ?  132 ASN A HD22 1 
ATOM   1844 N  N    . ALA A 1 129 ? 15.21400 13.84400  30.33200  1.000 14.59386 ?  133 ALA A N    1 
ATOM   1845 C  CA   . ALA A 1 129 ? 14.90900 14.56500  31.56500  1.000 14.92547 ?  133 ALA A CA   1 
ATOM   1846 C  C    . ALA A 1 129 ? 14.95300 16.06900  31.33400  1.000 14.35435 ?  133 ALA A C    1 
ATOM   1847 O  O    . ALA A 1 129 ? 14.09000 16.81500  31.82200  1.000 14.75966 ?  133 ALA A O    1 
ATOM   1848 C  CB   . ALA A 1 129 ? 15.88700 14.17600  32.67300  1.000 15.22288 ?  133 ALA A CB   1 
ATOM   1849 H  H    . ALA A 1 129 ? 15.89900 13.32500  30.36300  1.000 17.51000 ?  133 ALA A H    1 
ATOM   1850 H  HA   . ALA A 1 129 ? 14.01700 14.31700  31.85500  1.000 17.91000 ?  133 ALA A HA   1 
ATOM   1851 H  HB1  . ALA A 1 129 ? 15.67100 14.67700  33.47500  1.000 18.26000 ?  133 ALA A HB1  1 
ATOM   1852 H  HB2  . ALA A 1 129 ? 15.80800 13.22500  32.84500  1.000 18.26000 ?  133 ALA A HB2  1 
ATOM   1853 H  HB3  . ALA A 1 129 ? 16.79000 14.38600  32.38500  1.000 18.26000 ?  133 ALA A HB3  1 
ATOM   1854 N  N    . ALA A 1 130 ? 15.95900 16.53300  30.58900  1.000 14.42015 ?  134 ALA A N    1 
ATOM   1855 C  CA   . ALA A 1 130 ? 16.04000 17.95100  30.27200  1.000 14.34119 ?  134 ALA A CA   1 
ATOM   1856 C  C    . ALA A 1 130 ? 14.80200 18.42100  29.53100  1.000 14.17802 ?  134 ALA A C    1 
ATOM   1857 O  O    . ALA A 1 130 ? 14.25200 19.48800  29.82500  1.000 15.05444 ?  134 ALA A O    1 
ATOM   1858 C  CB   . ALA A 1 130 ? 17.29600 18.22900  29.45700  1.000 14.54648 ?  134 ALA A CB   1 
ATOM   1859 H  H    . ALA A 1 130 ? 16.59400 16.05300  30.26300  1.000 17.30000 ?  134 ALA A H    1 
ATOM   1860 H  HA   . ALA A 1 130 ? 16.09900 18.45300  31.10000  1.000 17.21000 ?  134 ALA A HA   1 
ATOM   1861 H  HB1  . ALA A 1 130 ? 17.31900 19.17100  29.22500  1.000 17.45000 ?  134 ALA A HB1  1 
ATOM   1862 H  HB2  . ALA A 1 130 ? 18.07400 18.00000  29.98800  1.000 17.45000 ?  134 ALA A HB2  1 
ATOM   1863 H  HB3  . ALA A 1 130 ? 17.27500 17.69000  28.65100  1.000 17.45000 ?  134 ALA A HB3  1 
ATOM   1864 N  N    . ALA A 1 131 ? 14.37500 17.64800  28.53600  1.000 14.56754 ?  135 ALA A N    1 
ATOM   1865 C  CA   . ALA A 1 131 ? 13.19800 18.03000  27.76800  1.000 14.40962 ?  135 ALA A CA   1 
ATOM   1866 C  C    . ALA A 1 131 ? 11.96000 18.13600  28.66000  1.000 14.52279 ?  135 ALA A C    1 
ATOM   1867 O  O    . ALA A 1 131 ? 11.17800 19.08100  28.52300  1.000 14.98601 ?  135 ALA A O    1 
ATOM   1868 C  CB   . ALA A 1 131 ? 12.96200 17.02600  26.64200  1.000 14.64912 ?  135 ALA A CB   1 
ATOM   1869 H  H    . ALA A 1 131 ? 14.74300 16.91100  28.29000  1.000 17.48000 ?  135 ALA A H    1 
ATOM   1870 H  HA   . ALA A 1 131 ? 13.35400 18.90000  27.36900  1.000 17.29000 ?  135 ALA A HA   1 
ATOM   1871 H  HB1  . ALA A 1 131 ? 12.16900 17.28600  26.14800  1.000 17.58000 ?  135 ALA A HB1  1 
ATOM   1872 H  HB2  . ALA A 1 131 ? 13.73300 17.02500  26.05400  1.000 17.58000 ?  135 ALA A HB2  1 
ATOM   1873 H  HB3  . ALA A 1 131 ? 12.83800 16.14400  27.02700  1.000 17.58000 ?  135 ALA A HB3  1 
ATOM   1874 N  N    . ASN A 1 132 ? 11.75200 17.17400  29.56800  1.000 14.36488 ?  136 ASN A N    1 
ATOM   1875 C  CA   . ASN A 1 132 ? 10.55900 17.24400  30.40600  1.000 14.73335 ?  136 ASN A CA   1 
ATOM   1876 C  C    . ASN A 1 132 ? 10.63300 18.42200  31.36600  1.000 15.09128 ?  136 ASN A C    1 
ATOM   1877 O  O    . ASN A 1 132 ? 9.60800  19.05400  31.66100  1.000 15.94928 ?  136 ASN A O    1 
ATOM   1878 C  CB   . ASN A 1 132 ? 10.34600 15.95300  31.18000  1.000 15.00180 ?  136 ASN A CB   1 
ATOM   1879 C  CG   . ASN A 1 132 ? 9.65500  14.86900  30.37200  1.000 15.90980 ?  136 ASN A CG   1 
ATOM   1880 O  OD1  . ASN A 1 132 ? 9.10100  15.10700  29.29000  1.000 16.20194 ?  136 ASN A OD1  1 
ATOM   1881 N  ND2  . ASN A 1 132 ? 9.62900  13.67500  30.93600  1.000 18.45748 ?  136 ASN A ND2  1 
ATOM   1882 H  H    . ASN A 1 132 ? 12.26600 16.50000  29.71000  1.000 17.24000 ?  136 ASN A H    1 
ATOM   1883 H  HA   . ASN A 1 132 ? 9.79300  17.36100  29.82300  1.000 17.68000 ?  136 ASN A HA   1 
ATOM   1884 H  HB2  . ASN A 1 132 ? 11.21000 15.61000  31.45900  1.000 18.00000 ?  136 ASN A HB2  1 
ATOM   1885 H  HB3  . ASN A 1 132 ? 9.79600  16.14000  31.95700  1.000 18.00000 ?  136 ASN A HB3  1 
ATOM   1886 H  HD21 . ASN A 1 132 ? 9.25300  13.01600  30.53100  1.000 22.15000 ?  136 ASN A HD21 1 
ATOM   1887 H  HD22 . ASN A 1 132 ? 9.98900  13.55600  31.70800  1.000 22.15000 ?  136 ASN A HD22 1 
ATOM   1888 N  N    . LEU A 1 133 ? 11.82500 18.72100  31.89000  1.000 15.07023 ?  137 LEU A N    1 
ATOM   1889 C  CA   . LEU A 1 133 ? 11.95900 19.87200  32.78100  1.000 15.13866 ?  137 LEU A CA   1 
ATOM   1890 C  C    . LEU A 1 133 ? 11.62100 21.16400  32.04600  1.000 15.39658 ?  137 LEU A C    1 
ATOM   1891 O  O    . LEU A 1 133 ? 10.93000 22.03700  32.57800  1.000 16.98098 ?  137 LEU A O    1 
ATOM   1892 C  CB   . LEU A 1 133 ? 13.36400 19.91200  33.38600  1.000 15.95718 ?  137 LEU A CB   1 
ATOM   1893 C  CG   . LEU A 1 133 ? 13.65300 18.84800  34.43500  1.000 16.59936 ?  137 LEU A CG   1 
ATOM   1894 C  CD1  . LEU A 1 133 ? 15.15300 18.71700  34.68100  1.000 17.51263 ?  137 LEU A CD1  1 
ATOM   1895 C  CD2  . LEU A 1 133 ? 12.94000 19.15800  35.74600  1.000 17.26523 ?  137 LEU A CD2  1 
ATOM   1896 H  H    . LEU A 1 133 ? 12.55300 18.28500  31.74800  1.000 18.08000 ?  137 LEU A H    1 
ATOM   1897 H  HA   . LEU A 1 133 ? 11.33700 19.78400  33.52000  1.000 18.17000 ?  137 LEU A HA   1 
ATOM   1898 H  HB2  . LEU A 1 133 ? 14.00800 19.79400  32.66900  1.000 19.15000 ?  137 LEU A HB2  1 
ATOM   1899 H  HB3  . LEU A 1 133 ? 13.49100 20.77600  33.80700  1.000 19.15000 ?  137 LEU A HB3  1 
ATOM   1900 H  HG   . LEU A 1 133 ? 13.31900 18.00100  34.10100  1.000 19.92000 ?  137 LEU A HG   1 
ATOM   1901 H  HD11 . LEU A 1 133 ? 15.30200 18.06700  35.38500  1.000 21.01000 ?  137 LEU A HD11 1 
ATOM   1902 H  HD12 . LEU A 1 133 ? 15.58300 18.42300  33.86300  1.000 21.01000 ?  137 LEU A HD12 1 
ATOM   1903 H  HD13 . LEU A 1 133 ? 15.50600 19.58100  34.94800  1.000 21.01000 ?  137 LEU A HD13 1 
ATOM   1904 H  HD21 . LEU A 1 133 ? 13.19500 18.49700  36.40800  1.000 20.71000 ?  137 LEU A HD21 1 
ATOM   1905 H  HD22 . LEU A 1 133 ? 13.19900 20.04300  36.04500  1.000 20.71000 ?  137 LEU A HD22 1 
ATOM   1906 H  HD23 . LEU A 1 133 ? 11.98100 19.12600  35.59900  1.000 20.71000 ?  137 LEU A HD23 1 
ATOM   1907 N  N    . LEU A 1 134 ? 12.11800 21.31300  30.82200  1.000 15.12287 ?  138 LEU A N    1 
ATOM   1908 C  CA   . LEU A 1 134 ? 11.85000 22.52500  30.06300  1.000 15.99402 ?  138 LEU A CA   1 
ATOM   1909 C  C    . LEU A 1 134 ? 10.39500 22.59800  29.62800  1.000 15.66240 ?  138 LEU A C    1 
ATOM   1910 O  O    . LEU A 1 134 ? 9.80000  23.67800  29.62400  1.000 16.42565 ?  138 LEU A O    1 
ATOM   1911 C  CB   . LEU A 1 134 ? 12.79000 22.57300  28.86100  1.000 15.83348 ?  138 LEU A CB   1 
ATOM   1912 C  CG   . LEU A 1 134 ? 14.27400 22.75900  29.20400  1.000 16.04140 ?  138 LEU A CG   1 
ATOM   1913 C  CD1  . LEU A 1 134 ? 15.07400 22.52900  27.93300  1.000 16.59673 ?  138 LEU A CD1  1 
ATOM   1914 C  CD2  . LEU A 1 134 ? 14.53000 24.11000  29.81800  1.000 17.09942 ?  138 LEU A CD2  1 
ATOM   1915 H  H    . LEU A 1 134 ? 12.60700 20.73500  30.41400  1.000 18.15000 ?  138 LEU A H    1 
ATOM   1916 H  HA   . LEU A 1 134 ? 12.02000 23.30300  30.61800  1.000 19.19000 ?  138 LEU A HA   1 
ATOM   1917 H  HB2  . LEU A 1 134 ? 12.70600 21.73800  28.37400  1.000 19.00000 ?  138 LEU A HB2  1 
ATOM   1918 H  HB3  . LEU A 1 134 ? 12.52600 23.31500  28.29500  1.000 19.00000 ?  138 LEU A HB3  1 
ATOM   1919 H  HG   . LEU A 1 134 ? 14.56100 22.12100  29.87600  1.000 19.25000 ?  138 LEU A HG   1 
ATOM   1920 H  HD11 . LEU A 1 134 ? 16.01500 22.66200  28.12500  1.000 19.91000 ?  138 LEU A HD11 1 
ATOM   1921 H  HD12 . LEU A 1 134 ? 14.92300 21.62200  27.62600  1.000 19.91000 ?  138 LEU A HD12 1 
ATOM   1922 H  HD13 . LEU A 1 134 ? 14.78100 23.16000  27.25700  1.000 19.91000 ?  138 LEU A HD13 1 
ATOM   1923 H  HD21 . LEU A 1 134 ? 15.48200 24.21000  29.97700  1.000 20.52000 ?  138 LEU A HD21 1 
ATOM   1924 H  HD22 . LEU A 1 134 ? 14.22300 24.79800  29.20600  1.000 20.52000 ?  138 LEU A HD22 1 
ATOM   1925 H  HD23 . LEU A 1 134 ? 14.04600 24.17400  30.65600  1.000 20.52000 ?  138 LEU A HD23 1 
ATOM   1926 N  N    . LEU A 1 135 ? 9.80100  21.46600  29.25800  1.000 15.09918 ?  139 LEU A N    1 
ATOM   1927 C  CA   . LEU A 1 135 ? 8.37800  21.45800  28.94600  1.000 15.83874 ?  139 LEU A CA   1 
ATOM   1928 C  C    . LEU A 1 135 ? 7.57900  21.99200  30.12100  1.000 16.79675 ?  139 LEU A C    1 
ATOM   1929 O  O    . LEU A 1 135 ? 6.65600  22.79200  29.94000  1.000 17.98374 ?  139 LEU A O    1 
ATOM   1930 C  CB   . LEU A 1 135 ? 7.93000  20.04200  28.62100  1.000 16.94677 ?  139 LEU A CB   1 
ATOM   1931 C  CG   . LEU A 1 135 ? 7.99600  19.63000  27.17400  1.000 18.30483 ?  139 LEU A CG   1 
ATOM   1932 C  CD1  . LEU A 1 135 ? 7.62800  18.14900  27.10300  1.000 19.28652 ?  139 LEU A CD1  1 
ATOM   1933 C  CD2  . LEU A 1 135 ? 7.04800  20.47800  26.29100  1.000 17.38103 ?  139 LEU A CD2  1 
ATOM   1934 H  H    . LEU A 1 135 ? 10.19300 20.70400  29.18000  1.000 18.12000 ?  139 LEU A H    1 
ATOM   1935 H  HA   . LEU A 1 135 ? 8.21600  22.01700  28.17100  1.000 19.00000 ?  139 LEU A HA   1 
ATOM   1936 H  HB2  . LEU A 1 135 ? 8.49300  19.42700  29.11700  1.000 20.33000 ?  139 LEU A HB2  1 
ATOM   1937 H  HB3  . LEU A 1 135 ? 7.00700  19.94700  28.90200  1.000 20.33000 ?  139 LEU A HB3  1 
ATOM   1938 H  HG   . LEU A 1 135 ? 8.88800  19.77500  26.82200  1.000 21.96000 ?  139 LEU A HG   1 
ATOM   1939 H  HD11 . LEU A 1 135 ? 7.71800  17.84500  26.18600  1.000 23.14000 ?  139 LEU A HD11 1 
ATOM   1940 H  HD12 . LEU A 1 135 ? 8.22600  17.64700  27.67800  1.000 23.14000 ?  139 LEU A HD12 1 
ATOM   1941 H  HD13 . LEU A 1 135 ? 6.71100  18.03700  27.40000  1.000 23.14000 ?  139 LEU A HD13 1 
ATOM   1942 H  HD21 . LEU A 1 135 ? 7.01800  20.09300  25.40100  1.000 20.85000 ?  139 LEU A HD21 1 
ATOM   1943 H  HD22 . LEU A 1 135 ? 6.16200  20.47300  26.68400  1.000 20.85000 ?  139 LEU A HD22 1 
ATOM   1944 H  HD23 . LEU A 1 135 ? 7.38600  21.38600  26.24700  1.000 20.85000 ?  139 LEU A HD23 1 
ATOM   1945 N  N    . LYS A 1 136 ? 7.91700  21.55900  31.33800  1.000 18.07848 ?  140 LYS A N    1 
ATOM   1946 C  CA   . LYS A 1 136 ? 7.19600  22.05200  32.50900  1.000 20.68932 ?  140 LYS A CA   1 
ATOM   1947 C  C    . LYS A 1 136 ? 7.32000  23.56300  32.61400  1.000 21.39467 ?  140 LYS A C    1 
ATOM   1948 O  O    . LYS A 1 136 ? 6.33900  24.25800  32.90400  1.000 22.56060 ?  140 LYS A O    1 
ATOM   1949 C  CB   . LYS A 1 136 ? 7.72700  21.37300  33.77100  1.000 23.53440 ?  140 LYS A CB   1 
ATOM   1950 C  CG   . LYS A 1 136 ? 7.01400  21.77100  35.05600  1.000 27.57173 ?  140 LYS A CG   1 
ATOM   1951 C  CD   . LYS A 1 136 ? 7.79000  21.24800  36.25800  1.000 31.12478 ?  140 LYS A CD   1 
ATOM   1952 C  CE   . LYS A 1 136 ? 7.46100  22.01800  37.53300  1.000 34.61468 ?  140 LYS A CE   1 
ATOM   1953 N  NZ   . LYS A 1 136 ? 8.01400  23.40900  37.51800  1.000 36.90706 ?  140 LYS A NZ   1 
ATOM   1954 H  H    . LYS A 1 136 ? 8.54400  20.99600  31.50700  1.000 21.69000 ?  140 LYS A H    1 
ATOM   1955 H  HA   . LYS A 1 136 ? 6.25500  21.82900  32.42700  1.000 24.82000 ?  140 LYS A HA   1 
ATOM   1956 H  HB2  . LYS A 1 136 ? 7.63000  20.41300  33.66900  1.000 28.24000 ?  140 LYS A HB2  1 
ATOM   1957 H  HB3  . LYS A 1 136 ? 8.66400  21.60200  33.87400  1.000 28.24000 ?  140 LYS A HB3  1 
ATOM   1958 H  HG2  . LYS A 1 136 ? 6.96000  22.73800  35.11500  1.000 33.08000 ?  140 LYS A HG2  1 
ATOM   1959 H  HG3  . LYS A 1 136 ? 6.12300  21.38800  35.06900  1.000 33.08000 ?  140 LYS A HG3  1 
ATOM   1960 H  HD2  . LYS A 1 136 ? 7.56600  20.31500  36.40100  1.000 37.35000 ?  140 LYS A HD2  1 
ATOM   1961 H  HD3  . LYS A 1 136 ? 8.74100  21.33700  36.08700  1.000 37.35000 ?  140 LYS A HD3  1 
ATOM   1962 H  HE2  . LYS A 1 136 ? 6.49800  22.07800  37.62800  1.000 41.53000 ?  140 LYS A HE2  1 
ATOM   1963 H  HE3  . LYS A 1 136 ? 7.84100  21.55100  38.29300  1.000 41.53000 ?  140 LYS A HE3  1 
ATOM   1964 H  HZ1  . LYS A 1 136 ? 7.80700  23.82700  38.27600  1.000 44.29000 ?  140 LYS A HZ1  1 
ATOM   1965 H  HZ2  . LYS A 1 136 ? 8.90000  23.38400  37.43400  1.000 44.29000 ?  140 LYS A HZ2  1 
ATOM   1966 H  HZ3  . LYS A 1 136 ? 7.67200  23.86500  36.83400  1.000 44.29000 ?  140 LYS A HZ3  1 
ATOM   1967 N  N    . GLU A 1 137 ? 8.51700  24.09500  32.34500  1.000 21.73155 ?  141 GLU A N    1 
ATOM   1968 C  CA   . GLU A 1 137 ? 8.71500  25.53600  32.40400  1.000 24.31081 ?  141 GLU A CA   1 
ATOM   1969 C  C    . GLU A 1 137 ? 7.78500  26.28700  31.46900  1.000 22.74483 ?  141 GLU A C    1 
ATOM   1970 O  O    . GLU A 1 137 ? 7.37400  27.41000  31.78800  1.000 23.35017 ?  141 GLU A O    1 
ATOM   1971 C  CB   . GLU A 1 137 ? 10.16600 25.88200  32.04900  1.000 28.27707 ?  141 GLU A CB   1 
ATOM   1972 C  CG   . GLU A 1 137 ? 11.19800 25.40800  33.03800  1.000 32.84868 ?  141 GLU A CG   1 
ATOM   1973 C  CD   . GLU A 1 137 ? 11.45800 26.41300  34.14000  1.000 36.52280 ?  141 GLU A CD   1 
ATOM   1974 O  OE1  . GLU A 1 137 ? 11.09300 27.60400  33.98700  1.000 37.61767 ?  141 GLU A OE1  1 
ATOM   1975 O  OE2  . GLU A 1 137 ? 12.03300 26.00100  35.17400  1.000 38.55989 -1 141 GLU A OE2  1 
ATOM   1976 H  H    . GLU A 1 137 ? 9.21800  23.64600  32.12900  1.000 26.07000 ?  141 GLU A H    1 
ATOM   1977 H  HA   . GLU A 1 137 ? 8.53100  25.82300  33.31200  1.000 29.17000 ?  141 GLU A HA   1 
ATOM   1978 H  HB2  . GLU A 1 137 ? 10.37700 25.47700  31.19300  1.000 33.93000 ?  141 GLU A HB2  1 
ATOM   1979 H  HB3  . GLU A 1 137 ? 10.24500 26.84700  31.98800  1.000 33.93000 ?  141 GLU A HB3  1 
ATOM   1980 H  HG2  . GLU A 1 137 ? 10.88700 24.58600  33.44900  1.000 39.42000 ?  141 GLU A HG2  1 
ATOM   1981 H  HG3  . GLU A 1 137 ? 12.03400 25.25000  32.57200  1.000 39.42000 ?  141 GLU A HG3  1 
ATOM   1982 N  N    . LEU A 1 138 ? 7.47100  25.70800  30.30800  1.000 20.77881 ?  142 LEU A N    1 
ATOM   1983 C  CA   . LEU A 1 138 ? 6.65800  26.36400  29.29500  1.000 20.73143 ?  142 LEU A CA   1 
ATOM   1984 C  C    . LEU A 1 138 ? 5.16600  26.10000  29.45800  1.000 20.09715 ?  142 LEU A C    1 
ATOM   1985 O  O    . LEU A 1 138 ? 4.37000  26.56300  28.63100  1.000 21.72892 ?  142 LEU A O    1 
ATOM   1986 C  CB   . LEU A 1 138 ? 7.06800  25.87100  27.89800  1.000 22.89748 ?  142 LEU A CB   1 
ATOM   1987 C  CG   . LEU A 1 138 ? 8.43300  26.25500  27.36500  1.000 25.55833 ?  142 LEU A CG   1 
ATOM   1988 C  CD1  . LEU A 1 138 ? 8.62500  25.58500  26.00400  1.000 26.87954 ?  142 LEU A CD1  1 
ATOM   1989 C  CD2  . LEU A 1 138 ? 8.60100  27.73600  27.23200  1.000 26.30052 ?  142 LEU A CD2  1 
ATOM   1990 H  H    . LEU A 1 138 ? 7.72600  24.91800  30.08300  1.000 24.93000 ?  142 LEU A H    1 
ATOM   1991 H  HA   . LEU A 1 138 ? 6.81400  27.31900  29.36000  1.000 24.88000 ?  142 LEU A HA   1 
ATOM   1992 H  HB2  . LEU A 1 138 ? 7.03900  24.90100  27.90900  1.000 27.47000 ?  142 LEU A HB2  1 
ATOM   1993 H  HB3  . LEU A 1 138 ? 6.41800  26.21400  27.26400  1.000 27.47000 ?  142 LEU A HB3  1 
ATOM   1994 H  HG   . LEU A 1 138 ? 9.11000  25.95800  27.99300  1.000 30.67000 ?  142 LEU A HG   1 
ATOM   1995 H  HD11 . LEU A 1 138 ? 9.54800  25.69400  25.72500  1.000 32.25000 ?  142 LEU A HD11 1 
ATOM   1996 H  HD12 . LEU A 1 138 ? 8.41300  24.64100  26.08400  1.000 32.25000 ?  142 LEU A HD12 1 
ATOM   1997 H  HD13 . LEU A 1 138 ? 8.03300  26.00300  25.36000  1.000 32.25000 ?  142 LEU A HD13 1 
ATOM   1998 H  HD21 . LEU A 1 138 ? 9.45100  27.92000  26.80400  1.000 31.56000 ?  142 LEU A HD21 1 
ATOM   1999 H  HD22 . LEU A 1 138 ? 7.87600  28.08900  26.69300  1.000 31.56000 ?  142 LEU A HD22 1 
ATOM   2000 H  HD23 . LEU A 1 138 ? 8.58200  28.13700  28.11500  1.000 31.56000 ?  142 LEU A HD23 1 
ATOM   2001 N  N    . GLY A 1 139 ? 4.76700  25.32600  30.45400  1.000 18.77594 ?  143 GLY A N    1 
ATOM   2002 C  CA   . GLY A 1 139 ? 3.37600  24.97200  30.59900  1.000 19.03912 ?  143 GLY A CA   1 
ATOM   2003 C  C    . GLY A 1 139 ? 2.97200  23.71700  29.86000  1.000 18.76804 ?  143 GLY A C    1 
ATOM   2004 O  O    . GLY A 1 139 ? 1.79400  23.56900  29.49500  1.000 22.54481 ?  143 GLY A O    1 
ATOM   2005 H  H    . GLY A 1 139 ? 5.28500  24.99600  31.05600  1.000 22.53000 ?  143 GLY A H    1 
ATOM   2006 H  HA2  . GLY A 1 139 ? 3.18500  24.83800  31.54100  1.000 22.84000 ?  143 GLY A HA2  1 
ATOM   2007 H  HA3  . GLY A 1 139 ? 2.83100  25.70300  30.26700  1.000 22.84000 ?  143 GLY A HA3  1 
ATOM   2008 N  N    . GLY A 1 140 ? 3.90700  22.80400  29.63300  1.000 16.55198 ?  144 GLY A N    1 
ATOM   2009 C  CA   . GLY A 1 140 ? 3.60300  21.50200  29.10900  1.000 16.00455 ?  144 GLY A CA   1 
ATOM   2010 C  C    . GLY A 1 140 ? 3.46200  21.47500  27.60400  1.000 15.55186 ?  144 GLY A C    1 
ATOM   2011 O  O    . GLY A 1 140 ? 3.73300  22.45900  26.90700  1.000 15.65451 ?  144 GLY A O    1 
ATOM   2012 H  H    . GLY A 1 140 ? 4.74500  22.92700  29.78200  1.000 19.86000 ?  144 GLY A H    1 
ATOM   2013 H  HA2  . GLY A 1 140 ? 4.31200  20.88800  29.35600  1.000 19.20000 ?  144 GLY A HA2  1 
ATOM   2014 H  HA3  . GLY A 1 140 ? 2.76900  21.19200  29.49500  1.000 19.20000 ?  144 GLY A HA3  1 
ATOM   2015 N  N    . PRO A 1 141 ? 3.03100  20.32200  27.07900  1.000 15.23867 ?  145 PRO A N    1 
ATOM   2016 C  CA   . PRO A 1 141 ? 2.83300  20.18600  25.62300  1.000 15.41764 ?  145 PRO A CA   1 
ATOM   2017 C  C    . PRO A 1 141 ? 1.96400  21.27600  25.01300  1.000 15.15971 ?  145 PRO A C    1 
ATOM   2018 O  O    . PRO A 1 141 ? 2.26200  21.73400  23.90100  1.000 14.81230 ?  145 PRO A O    1 
ATOM   2019 C  CB   . PRO A 1 141 ? 2.22900  18.78200  25.49400  1.000 16.12299 ?  145 PRO A CB   1 
ATOM   2020 C  CG   . PRO A 1 141 ? 2.74300  18.03200  26.72600  1.000 16.93887 ?  145 PRO A CG   1 
ATOM   2021 C  CD   . PRO A 1 141 ? 2.77400  19.06600  27.81100  1.000 16.11246 ?  145 PRO A CD   1 
ATOM   2022 H  HA   . PRO A 1 141 ? 3.69000  20.19700  25.16800  1.000 18.50000 ?  145 PRO A HA   1 
ATOM   2023 H  HB2  . PRO A 1 141 ? 1.26000  18.83600  25.49700  1.000 19.34000 ?  145 PRO A HB2  1 
ATOM   2024 H  HB3  . PRO A 1 141 ? 2.53600  18.36200  24.67600  1.000 19.34000 ?  145 PRO A HB3  1 
ATOM   2025 H  HG2  . PRO A 1 141 ? 2.13700  17.30900  26.95100  1.000 20.32000 ?  145 PRO A HG2  1 
ATOM   2026 H  HG3  . PRO A 1 141 ? 3.63000  17.68000  26.55400  1.000 20.32000 ?  145 PRO A HG3  1 
ATOM   2027 H  HD2  . PRO A 1 141 ? 1.92400  19.10500  28.27500  1.000 19.33000 ?  145 PRO A HD2  1 
ATOM   2028 H  HD3  . PRO A 1 141 ? 3.48800  18.88300  28.44200  1.000 19.33000 ?  145 PRO A HD3  1 
ATOM   2029 N  N    . ALA A 1 142 ? 0.90600  21.71800  25.69600  1.000 14.40699 ?  146 ALA A N    1 
ATOM   2030 C  CA   . ALA A 1 142 ? 0.08900  22.78700  25.13400  1.000 14.74124 ?  146 ALA A CA   1 
ATOM   2031 C  C    . ALA A 1 142 ? 0.85500  24.10400  25.06700  1.000 14.53069 ?  146 ALA A C    1 
ATOM   2032 O  O    . ALA A 1 142 ? 0.61000  24.90800  24.16200  1.000 14.77282 ?  146 ALA A O    1 
ATOM   2033 C  CB   . ALA A 1 142 ? -1.18900 22.96600  25.95300  1.000 15.40448 ?  146 ALA A CB   1 
ATOM   2034 H  H    . ALA A 1 142 ? 0.65000  21.42400  26.46300  1.000 17.29000 ?  146 ALA A H    1 
ATOM   2035 H  HA   . ALA A 1 142 ? -0.16400 22.53700  24.23200  1.000 17.68000 ?  146 ALA A HA   1 
ATOM   2036 H  HB1  . ALA A 1 142 ? -1.72300 23.67100  25.55500  1.000 18.48000 ?  146 ALA A HB1  1 
ATOM   2037 H  HB2  . ALA A 1 142 ? -1.68600 22.13300  25.94900  1.000 18.48000 ?  146 ALA A HB2  1 
ATOM   2038 H  HB3  . ALA A 1 142 ? -0.95100 23.20500  26.86200  1.000 18.48000 ?  146 ALA A HB3  1 
ATOM   2039 N  N    . GLY A 1 143 ? 1.76700  24.35400  26.01400  1.000 14.59649 ?  147 GLY A N    1 
ATOM   2040 C  CA   . GLY A 1 143 ? 2.54300  25.57800  25.95900  1.000 15.78610 ?  147 GLY A CA   1 
ATOM   2041 C  C    . GLY A 1 143 ? 3.52200  25.60000  24.80100  1.000 14.82020 ?  147 GLY A C    1 
ATOM   2042 O  O    . GLY A 1 143 ? 3.70300  26.63600  24.15800  1.000 15.53871 ?  147 GLY A O    1 
ATOM   2043 H  H    . GLY A 1 143 ? 1.94500  23.83900  26.67900  1.000 17.51000 ?  147 GLY A H    1 
ATOM   2044 H  HA2  . GLY A 1 143 ? 1.94200  26.33300  25.86400  1.000 18.94000 ?  147 GLY A HA2  1 
ATOM   2045 H  HA3  . GLY A 1 143 ? 3.04500  25.67500  26.78300  1.000 18.94000 ?  147 GLY A HA3  1 
ATOM   2046 N  N    . LEU A 1 144 ? 4.15500  24.46600  24.50400  1.000 13.98062 ?  148 LEU A N    1 
ATOM   2047 C  CA   . LEU A 1 144 ? 5.00300  24.41000  23.31500  1.000 14.33330 ?  148 LEU A CA   1 
ATOM   2048 C  C    . LEU A 1 144 ? 4.16500  24.56200  22.05100  1.000 13.83850 ?  148 LEU A C    1 
ATOM   2049 O  O    . LEU A 1 144 ? 4.55700  25.26500  21.11300  1.000 13.84113 ?  148 LEU A O    1 
ATOM   2050 C  CB   . LEU A 1 144 ? 5.81000  23.11800  23.28700  1.000 13.99641 ?  148 LEU A CB   1 
ATOM   2051 C  CG   . LEU A 1 144 ? 6.75600  22.99300  22.08900  1.000 14.24644 ?  148 LEU A CG   1 
ATOM   2052 C  CD1  . LEU A 1 144 ? 7.66500  24.21700  21.96900  1.000 15.24656 ?  148 LEU A CD1  1 
ATOM   2053 C  CD2  . LEU A 1 144 ? 7.58700  21.72900  22.15300  1.000 14.42541 ?  148 LEU A CD2  1 
ATOM   2054 H  H    . LEU A 1 144 ? 4.11200  23.73800  24.96000  1.000 16.77000 ?  148 LEU A H    1 
ATOM   2055 H  HA   . LEU A 1 144 ? 5.64200  25.14000  23.34900  1.000 17.20000 ?  148 LEU A HA   1 
ATOM   2056 H  HB2  . LEU A 1 144 ? 6.34800  23.07200  24.09300  1.000 16.79000 ?  148 LEU A HB2  1 
ATOM   2057 H  HB3  . LEU A 1 144 ? 5.19400  22.36900  23.25600  1.000 16.79000 ?  148 LEU A HB3  1 
ATOM   2058 H  HG   . LEU A 1 144 ? 6.20600  22.94200  21.29100  1.000 17.09000 ?  148 LEU A HG   1 
ATOM   2059 H  HD11 . LEU A 1 144 ? 8.32500  24.05400  21.27800  1.000 18.29000 ?  148 LEU A HD11 1 
ATOM   2060 H  HD12 . LEU A 1 144 ? 7.12600  24.98900  21.73600  1.000 18.29000 ?  148 LEU A HD12 1 
ATOM   2061 H  HD13 . LEU A 1 144 ? 8.10700  24.36700  22.82000  1.000 18.29000 ?  148 LEU A HD13 1 
ATOM   2062 H  HD21 . LEU A 1 144 ? 8.14000  21.67400  21.35700  1.000 17.31000 ?  148 LEU A HD21 1 
ATOM   2063 H  HD22 . LEU A 1 144 ? 8.14800  21.75900  22.94400  1.000 17.31000 ?  148 LEU A HD22 1 
ATOM   2064 H  HD23 . LEU A 1 144 ? 6.99400  20.96300  22.19700  1.000 17.31000 ?  148 LEU A HD23 1 
ATOM   2065 N  N    . THR A 1 145 ? 3.01600  23.89400  22.00700  1.000 13.26212 ?  149 THR A N    1 
ATOM   2066 C  CA   . THR A 1 145 ? 2.11900  24.03200  20.85900  1.000 12.66204 ?  149 THR A CA   1 
ATOM   2067 C  C    . THR A 1 145 ? 1.72200  25.48900  20.65900  1.000 12.99103 ?  149 THR A C    1 
ATOM   2068 O  O    . THR A 1 145 ? 1.74700  26.00300  19.53700  1.000 13.85956 ?  149 THR A O    1 
ATOM   2069 C  CB   . THR A 1 145 ? 0.90200  23.12100  21.04800  1.000 13.12263 ?  149 THR A CB   1 
ATOM   2070 O  OG1  . THR A 1 145 ? 1.35200  21.76200  21.13600  1.000 13.10420 ?  149 THR A OG1  1 
ATOM   2071 C  CG2  . THR A 1 145 ? -0.06800 23.23000  19.88300  1.000 13.47004 ?  149 THR A CG2  1 
ATOM   2072 H  H    . THR A 1 145 ? 2.73200  23.36200  22.62000  1.000 15.91000 ?  149 THR A H    1 
ATOM   2073 H  HA   . THR A 1 145 ? 2.56800  23.74400  20.04800  1.000 15.19000 ?  149 THR A HA   1 
ATOM   2074 H  HB   . THR A 1 145 ? 0.43200  23.38600  21.85500  1.000 15.74000 ?  149 THR A HB   1 
ATOM   2075 H  HG1  . THR A 1 145 ? 1.89400  21.68000  21.77300  1.000 15.72000 ?  149 THR A HG1  1 
ATOM   2076 H  HG21 . THR A 1 145 ? -0.76800 22.56500  19.97000  1.000 16.16000 ?  149 THR A HG21 1 
ATOM   2077 H  HG22 . THR A 1 145 ? -0.47200 24.11200  19.86800  1.000 16.16000 ?  149 THR A HG22 1 
ATOM   2078 H  HG23 . THR A 1 145 ? 0.40200  23.08600  19.04600  1.000 16.16000 ?  149 THR A HG23 1 
ATOM   2079 N  N    . ALA A 1 146 ? 1.41800  26.19200  21.75200  1.000 13.63321 ?  150 ALA A N    1 
ATOM   2080 C  CA   . ALA A 1 146 ? 1.07100  27.60600  21.65500  1.000 15.04917 ?  150 ALA A CA   1 
ATOM   2081 C  C    . ALA A 1 146 ? 2.22500  28.42800  21.09300  1.000 14.27013 ?  150 ALA A C    1 
ATOM   2082 O  O    . ALA A 1 146 ? 2.00200  29.36400  20.32300  1.000 14.70439 ?  150 ALA A O    1 
ATOM   2083 C  CB   . ALA A 1 146 ? 0.65300  28.12700  23.02800  1.000 16.01771 ?  150 ALA A CB   1 
ATOM   2084 H  H    . ALA A 1 146 ? 1.40700  25.87600  22.55200  1.000 16.36000 ?  150 ALA A H    1 
ATOM   2085 H  HA   . ALA A 1 146 ? 0.31900  27.70500  21.05000  1.000 18.05000 ?  150 ALA A HA   1 
ATOM   2086 H  HB1  . ALA A 1 146 ? 0.35200  29.04500  22.93900  1.000 19.22000 ?  150 ALA A HB1  1 
ATOM   2087 H  HB2  . ALA A 1 146 ? -0.06800 27.57400  23.36900  1.000 19.22000 ?  150 ALA A HB2  1 
ATOM   2088 H  HB3  . ALA A 1 146 ? 1.41400  28.08400  23.62700  1.000 19.22000 ?  150 ALA A HB3  1 
ATOM   2089 N  N    . PHE A 1 147 ? 3.47100  28.11000  21.46400  1.000 14.51753 ?  151 PHE A N    1 
ATOM   2090 C  CA   . PHE A 1 147 ? 4.59200  28.84900  20.89500  1.000 14.98338 ?  151 PHE A CA   1 
ATOM   2091 C  C    . PHE A 1 147 ? 4.63000  28.64400  19.38100  1.000 14.78072 ?  151 PHE A C    1 
ATOM   2092 O  O    . PHE A 1 147 ? 4.81900  29.58500  18.60200  1.000 14.98338 ?  151 PHE A O    1 
ATOM   2093 C  CB   . PHE A 1 147 ? 5.91900  28.41800  21.50800  1.000 15.56502 ?  151 PHE A CB   1 
ATOM   2094 C  CG   . PHE A 1 147 ? 7.09200  29.00900  20.78900  1.000 15.29131 ?  151 PHE A CG   1 
ATOM   2095 C  CD1  . PHE A 1 147 ? 7.36300  30.36800  20.87700  1.000 16.16773 ?  151 PHE A CD1  1 
ATOM   2096 C  CD2  . PHE A 1 147 ? 7.88200  28.22000  19.96000  1.000 15.55186 ?  151 PHE A CD2  1 
ATOM   2097 C  CE1  . PHE A 1 147 ? 8.41500  30.92000  20.18600  1.000 17.11258 ?  151 PHE A CE1  1 
ATOM   2098 C  CE2  . PHE A 1 147 ? 8.94500  28.77700  19.28200  1.000 16.48619 ?  151 PHE A CE2  1 
ATOM   2099 C  CZ   . PHE A 1 147 ? 9.20200  30.11900  19.38400  1.000 17.04415 ?  151 PHE A CZ   1 
ATOM   2100 H  H    . PHE A 1 147 ? 3.68200  27.49300  22.02400  1.000 17.42000 ?  151 PHE A H    1 
ATOM   2101 H  HA   . PHE A 1 147 ? 4.47500  29.79000  21.10100  1.000 17.98000 ?  151 PHE A HA   1 
ATOM   2102 H  HB2  . PHE A 1 147 ? 5.95200  28.71100  22.43300  1.000 18.68000 ?  151 PHE A HB2  1 
ATOM   2103 H  HB3  . PHE A 1 147 ? 5.99200  27.45200  21.46300  1.000 18.68000 ?  151 PHE A HB3  1 
ATOM   2104 H  HD1  . PHE A 1 147 ? 6.82700  30.91100  21.40900  1.000 19.40000 ?  151 PHE A HD1  1 
ATOM   2105 H  HD2  . PHE A 1 147 ? 7.69300  27.31400  19.86400  1.000 18.66000 ?  151 PHE A HD2  1 
ATOM   2106 H  HE1  . PHE A 1 147 ? 8.59600  31.82900  20.25800  1.000 20.53000 ?  151 PHE A HE1  1 
ATOM   2107 H  HE2  . PHE A 1 147 ? 9.48900  28.24000  18.75200  1.000 19.78000 ?  151 PHE A HE2  1 
ATOM   2108 H  HZ   . PHE A 1 147 ? 9.91100  30.49200  18.91200  1.000 20.45000 ?  151 PHE A HZ   1 
ATOM   2109 N  N    . MET A 1 148 ? 4.46300  27.40300  18.95000  1.000 13.85166 ?  152 MET A N    1 
ATOM   2110 C  CA   . MET A 1 148 ? 4.45600  27.12500  17.51700  1.000 13.27528 ?  152 MET A CA   1 
ATOM   2111 C  C    . MET A 1 148 ? 3.31500  27.85900  16.81200  1.000 13.46214 ?  152 MET A C    1 
ATOM   2112 O  O    . MET A 1 148 ? 3.51600  28.42100  15.73700  1.000 13.75954 ?  152 MET A O    1 
ATOM   2113 C  CB   . MET A 1 148 ? 4.45500  25.62500  17.26500  1.000 12.90418 ?  152 MET A CB   1 
ATOM   2114 C  CG   . MET A 1 148 ? 5.70000  24.95100  17.84700  1.000 13.63321 ?  152 MET A CG   1 
ATOM   2115 S  SD   . MET A 1 148 ? 7.25700  25.49300  17.10800  1.000 14.08327 ?  152 MET A SD   1 
ATOM   2116 C  CE   . MET A 1 148 ? 7.15500  24.56200  15.56500  1.000 14.70966 ?  152 MET A CE   1 
ATOM   2117 H  H    . MET A 1 148 ? 4.35400  26.71400  19.45300  1.000 16.62000 ?  152 MET A H    1 
ATOM   2118 H  HA   . MET A 1 148 ? 5.28100  27.45200  17.12500  1.000 15.93000 ?  152 MET A HA   1 
ATOM   2119 H  HB2  . MET A 1 148 ? 3.67300  25.23100  17.68300  1.000 15.48000 ?  152 MET A HB2  1 
ATOM   2120 H  HB3  . MET A 1 148 ? 4.43800  25.46100  16.30900  1.000 15.48000 ?  152 MET A HB3  1 
ATOM   2121 H  HG2  . MET A 1 148 ? 5.74300  25.14600  18.79600  1.000 16.36000 ?  152 MET A HG2  1 
ATOM   2122 H  HG3  . MET A 1 148 ? 5.62800  23.99400  17.70700  1.000 16.36000 ?  152 MET A HG3  1 
ATOM   2123 H  HE1  . MET A 1 148 ? 7.94200  24.74900  15.03000  1.000 17.65000 ?  152 MET A HE1  1 
ATOM   2124 H  HE2  . MET A 1 148 ? 7.11200  23.61400  15.77000  1.000 17.65000 ?  152 MET A HE2  1 
ATOM   2125 H  HE3  . MET A 1 148 ? 6.35700  24.83200  15.08500  1.000 17.65000 ?  152 MET A HE3  1 
ATOM   2126 N  N    . ARG A 1 149 ? 2.12500  27.90300  17.40600  1.000 13.84113 ?  153 ARG A N    1 
ATOM   2127 C  CA   . ARG A 1 149 ? 1.05400  28.70500  16.82100  1.000 13.88851 ?  153 ARG A CA   1 
ATOM   2128 C  C    . ARG A 1 149 ? 1.45300  30.16800  16.71000  1.000 14.98864 ?  153 ARG A C    1 
ATOM   2129 O  O    . ARG A 1 149 ? 1.07300  30.85200  15.75000  1.000 16.00718 ?  153 ARG A O    1 
ATOM   2130 C  CB   . ARG A 1 149 ? -0.21300 28.59300  17.67600  1.000 14.46752 ?  153 ARG A CB   1 
ATOM   2131 C  CG   . ARG A 1 149 ? -0.84900 27.22400  17.71900  1.000 14.35435 ?  153 ARG A CG   1 
ATOM   2132 C  CD   . ARG A 1 149 ? -1.49200 26.81000  16.39700  1.000 14.10169 ?  153 ARG A CD   1 
ATOM   2133 N  NE   . ARG A 1 149 ? -2.00700 25.45700  16.53200  1.000 13.16737 ?  153 ARG A NE   1 
ATOM   2134 C  CZ   . ARG A 1 149 ? -1.27500 24.35800  16.43300  1.000 12.71205 ?  153 ARG A CZ   1 
ATOM   2135 N  NH1  . ARG A 1 149 ? -0.07800 24.37200  15.87100  1.000 13.43056 ?  153 ARG A NH1  1 
ATOM   2136 N  NH2  . ARG A 1 149 ? -1.74800 23.22800  16.92900  1.000 13.30423 ?  153 ARG A NH2  1 
ATOM   2137 H  H    . ARG A 1 149 ? 1.91600  27.48800  18.12900  1.000 16.61000 ?  153 ARG A H    1 
ATOM   2138 H  HA   . ARG A 1 149 ? 0.86800  28.36100  15.93300  1.000 16.66000 ?  153 ARG A HA   1 
ATOM   2139 H  HB2  . ARG A 1 149 ? 0.01200  28.83600  18.58800  1.000 17.36000 ?  153 ARG A HB2  1 
ATOM   2140 H  HB3  . ARG A 1 149 ? -0.87500 29.20700  17.32200  1.000 17.36000 ?  153 ARG A HB3  1 
ATOM   2141 H  HG2  . ARG A 1 149 ? -0.16800 26.56900  17.93700  1.000 17.22000 ?  153 ARG A HG2  1 
ATOM   2142 H  HG3  . ARG A 1 149 ? -1.54100 27.22100  18.39900  1.000 17.22000 ?  153 ARG A HG3  1 
ATOM   2143 H  HD2  . ARG A 1 149 ? -2.22400 27.40800  16.18200  1.000 16.92000 ?  153 ARG A HD2  1 
ATOM   2144 H  HD3  . ARG A 1 149 ? -0.83100 26.82700  15.68700  1.000 16.92000 ?  153 ARG A HD3  1 
ATOM   2145 H  HE   . ARG A 1 149 ? -2.84800 25.36400  16.68700  1.000 15.80000 ?  153 ARG A HE   1 
ATOM   2146 H  HH11 . ARG A 1 149 ? 0.24200  25.10700  15.55900  1.000 16.11000 ?  153 ARG A HH11 1 
ATOM   2147 H  HH12 . ARG A 1 149 ? 0.38000  23.64600  15.81800  1.000 16.11000 ?  153 ARG A HH12 1 
ATOM   2148 H  HH21 . ARG A 1 149 ? -2.52000 23.21400  17.30800  1.000 15.96000 ?  153 ARG A HH21 1 
ATOM   2149 H  HH22 . ARG A 1 149 ? -1.28400 22.50600  16.87300  1.000 15.96000 ?  153 ARG A HH22 1 
ATOM   2150 N  N    . SER A 1 150 ? 2.22000  30.67200  17.68300  1.000 15.40974 ?  154 SER A N    1 
ATOM   2151 C  CA   . SER A 1 150 ? 2.57300  32.09100  17.70000  1.000 16.62831 ?  154 SER A CA   1 
ATOM   2152 C  C    . SER A 1 150 ? 3.50600  32.47700  16.55400  1.000 16.67305 ?  154 SER A C    1 
ATOM   2153 O  O    . SER A 1 150 ? 3.60000  33.66500  16.21900  1.000 18.74435 ?  154 SER A O    1 
ATOM   2154 C  CB   . SER A 1 150 ? 3.18200  32.48100  19.04700  1.000 17.79424 ?  154 SER A CB   1 
ATOM   2155 O  OG   . SER A 1 150 ? 4.55900  32.14600  19.11100  1.000 17.56000 ?  154 SER A OG   1 
ATOM   2156 H  H    . SER A 1 150 ? 2.54300  30.21800  18.33700  1.000 18.49000 ?  154 SER A H    1 
ATOM   2157 H  HA   . SER A 1 150 ? 1.75900  32.60800  17.59600  1.000 19.95000 ?  154 SER A HA   1 
ATOM   2158 H  HB2  . SER A 1 150 ? 3.08700  33.43900  19.16800  1.000 21.35000 ?  154 SER A HB2  1 
ATOM   2159 H  HB3  . SER A 1 150 ? 2.71200  32.01000  19.75200  1.000 21.35000 ?  154 SER A HB3  1 
ATOM   2160 H  HG   . SER A 1 150 ? 4.86300  32.32500  19.87400  1.000 21.07000 ?  154 SER A HG   1 
ATOM   2161 N  N    . ILE A 1 151 ? 4.21300  31.51400  15.96900  1.000 16.37302 ?  155 ILE A N    1 
ATOM   2162 C  CA   . ILE A 1 151 ? 5.06500  31.78200  14.81700  1.000 16.19142 ?  155 ILE A CA   1 
ATOM   2163 C  C    . ILE A 1 151 ? 4.36300  31.42600  13.50400  1.000 15.85190 ?  155 ILE A C    1 
ATOM   2164 O  O    . ILE A 1 151 ? 4.97400  31.50200  12.43300  1.000 17.50736 ?  155 ILE A O    1 
ATOM   2165 C  CB   . ILE A 1 151 ? 6.46200  31.13800  14.92200  1.000 16.91255 ?  155 ILE A CB   1 
ATOM   2166 C  CG1  . ILE A 1 151 ? 6.40300  29.61900  14.83000  1.000 15.99402 ?  155 ILE A CG1  1 
ATOM   2167 C  CG2  . ILE A 1 151 ? 7.15600  31.60800  16.21700  1.000 18.03637 ?  155 ILE A CG2  1 
ATOM   2168 C  CD1  . ILE A 1 151 ? 7.75900  28.95400  14.72100  1.000 15.94402 ?  155 ILE A CD1  1 
ATOM   2169 H  H    . ILE A 1 151 ? 4.21500  30.69200  16.22300  1.000 19.64000 ?  155 ILE A H    1 
ATOM   2170 H  HA   . ILE A 1 151 ? 5.23100  32.73800  14.80500  1.000 19.43000 ?  155 ILE A HA   1 
ATOM   2171 H  HB   . ILE A 1 151 ? 6.98700  31.43300  14.16200  1.000 20.29000 ?  155 ILE A HB   1 
ATOM   2172 H  HG12 . ILE A 1 151 ? 5.97000  29.27600  15.62800  1.000 19.19000 ?  155 ILE A HG12 1 
ATOM   2173 H  HG13 . ILE A 1 151 ? 5.89000  29.37500  14.04400  1.000 19.19000 ?  155 ILE A HG13 1 
ATOM   2174 H  HG21 . ILE A 1 151 ? 8.07700  31.30200  16.21000  1.000 21.64000 ?  155 ILE A HG21 1 
ATOM   2175 H  HG22 . ILE A 1 151 ? 7.13000  32.57700  16.25600  1.000 21.64000 ?  155 ILE A HG22 1 
ATOM   2176 H  HG23 . ILE A 1 151 ? 6.68900  31.23300  16.97900  1.000 21.64000 ?  155 ILE A HG23 1 
ATOM   2177 H  HD11 . ILE A 1 151 ? 7.63400  28.00400  14.57300  1.000 19.13000 ?  155 ILE A HD11 1 
ATOM   2178 H  HD12 . ILE A 1 151 ? 8.24200  29.34400  13.97500  1.000 19.13000 ?  155 ILE A HD12 1 
ATOM   2179 H  HD13 . ILE A 1 151 ? 8.24900  29.09900  15.54500  1.000 19.13000 ?  155 ILE A HD13 1 
ATOM   2180 N  N    . GLY A 1 152 ? 3.08900  31.03900  13.56500  1.000 15.41764 ?  156 GLY A N    1 
ATOM   2181 C  CA   . GLY A 1 152 ? 2.30500  30.76500  12.37600  1.000 15.61503 ?  156 GLY A CA   1 
ATOM   2182 C  C    . GLY A 1 152 ? 2.21700  29.31100  11.96100  1.000 14.58596 ?  156 GLY A C    1 
ATOM   2183 O  O    . GLY A 1 152 ? 1.74200  29.03200  10.86000  1.000 17.57579 ?  156 GLY A O    1 
ATOM   2184 H  H    . GLY A 1 152 ? 2.65500  30.92800  14.29900  1.000 18.49000 ?  156 GLY A H    1 
ATOM   2185 H  HA2  . GLY A 1 152 ? 1.40000  31.08000  12.52700  1.000 18.74000 ?  156 GLY A HA2  1 
ATOM   2186 H  HA3  . GLY A 1 152 ? 2.69100  31.25600  11.63500  1.000 18.74000 ?  156 GLY A HA3  1 
ATOM   2187 N  N    . ASP A 1 153 ? 2.65900  28.38400  12.79500  1.000 13.26212 ?  157 ASP A N    1 
ATOM   2188 C  CA   . ASP A 1 153 ? 2.60500  26.95700  12.50800  1.000 12.86996 ?  157 ASP A CA   1 
ATOM   2189 C  C    . ASP A 1 153 ? 1.29400  26.42500  13.05000  1.000 13.23843 ?  157 ASP A C    1 
ATOM   2190 O  O    . ASP A 1 153 ? 1.10000  26.35500  14.26400  1.000 13.69901 ?  157 ASP A O    1 
ATOM   2191 C  CB   . ASP A 1 153 ? 3.80800  26.27700  13.15900  1.000 13.56742 ?  157 ASP A CB   1 
ATOM   2192 C  CG   . ASP A 1 153 ? 3.93700  24.80700  12.81800  1.000 12.55150 ?  157 ASP A CG   1 
ATOM   2193 O  OD1  . ASP A 1 153 ? 2.91100  24.14000  12.55500  1.000 12.96734 ?  157 ASP A OD1  1 
ATOM   2194 O  OD2  . ASP A 1 153 ? 5.09100  24.31000  12.83300  1.000 13.11210 -1 157 ASP A OD2  1 
ATOM   2195 H  H    . ASP A 1 153 ? 3.00700  28.56000  13.56200  1.000 15.91000 ?  157 ASP A H    1 
ATOM   2196 H  HA   . ASP A 1 153 ? 2.62800  26.78600  11.55400  1.000 15.44000 ?  157 ASP A HA   1 
ATOM   2197 H  HB2  . ASP A 1 153 ? 4.61700  26.72100  12.86000  1.000 16.27000 ?  157 ASP A HB2  1 
ATOM   2198 H  HB3  . ASP A 1 153 ? 3.72500  26.35100  14.12200  1.000 16.27000 ?  157 ASP A HB3  1 
ATOM   2199 N  N    . THR A 1 154 ? 0.38600  26.06000  12.14500  1.000 13.93062 ?  158 THR A N    1 
ATOM   2200 C  CA   . THR A 1 154 ? -0.92400 25.53400  12.52000  1.000 13.92535 ?  158 THR A CA   1 
ATOM   2201 C  C    . THR A 1 154 ? -0.97600 24.01500  12.43600  1.000 13.41477 ?  158 THR A C    1 
ATOM   2202 O  O    . THR A 1 154 ? -2.03500 23.42500  12.67300  1.000 14.38330 ?  158 THR A O    1 
ATOM   2203 C  CB   . THR A 1 154 ? -1.99800 26.13800  11.60500  1.000 16.38091 ?  158 THR A CB   1 
ATOM   2204 O  OG1  . THR A 1 154 ? -1.63900 25.88000  10.24300  1.000 17.92057 ?  158 THR A OG1  1 
ATOM   2205 C  CG2  . THR A 1 154 ? -2.14500 27.65100  11.82300  1.000 18.13112 ?  158 THR A CG2  1 
ATOM   2206 H  H    . THR A 1 154 ? 0.50900  26.10800  11.29500  1.000 16.72000 ?  158 THR A H    1 
ATOM   2207 H  HA   . THR A 1 154 ? -1.12700 25.79200  13.43300  1.000 16.71000 ?  158 THR A HA   1 
ATOM   2208 H  HB   . THR A 1 154 ? -2.85700 25.73600  11.80800  1.000 19.65000 ?  158 THR A HB   1 
ATOM   2209 H  HG1  . THR A 1 154 ? -1.62900 25.05300  10.10100  1.000 21.50000 ?  158 THR A HG1  1 
ATOM   2210 H  HG21 . THR A 1 154 ? -2.84000 28.00400  11.24600  1.000 21.75000 ?  158 THR A HG21 1 
ATOM   2211 H  HG22 . THR A 1 154 ? -2.38000 27.83200  12.74600  1.000 21.75000 ?  158 THR A HG22 1 
ATOM   2212 H  HG23 . THR A 1 154 ? -1.30900 28.09800  11.61800  1.000 21.75000 ?  158 THR A HG23 1 
ATOM   2213 N  N    . THR A 1 155 ? 0.14600  23.36600  12.11600  1.000 13.01209 ?  159 THR A N    1 
ATOM   2214 C  CA   . THR A 1 155 ? 0.22000  21.91400  11.95700  1.000 12.58309 ?  159 THR A CA   1 
ATOM   2215 C  C    . THR A 1 155 ? 0.78300  21.21500  13.19200  1.000 11.77773 ?  159 THR A C    1 
ATOM   2216 O  O    . THR A 1 155 ? 0.23900  20.19700  13.64100  1.000 12.39096 ?  159 THR A O    1 
ATOM   2217 C  CB   . THR A 1 155 ? 1.08900  21.57300  10.73900  1.000 12.99366 ?  159 THR A CB   1 
ATOM   2218 O  OG1  . THR A 1 155 ? 0.62900  22.31300  9.60200   1.000 14.62544 ?  159 THR A OG1  1 
ATOM   2219 C  CG2  . THR A 1 155 ? 1.07800  20.08000  10.44200  1.000 13.07525 ?  159 THR A CG2  1 
ATOM   2220 H  H    . THR A 1 155 ? 0.90000  23.75800  11.98200  1.000 15.61000 ?  159 THR A H    1 
ATOM   2221 H  HA   . THR A 1 155 ? -0.67100 21.56400  11.79900  1.000 15.09000 ?  159 THR A HA   1 
ATOM   2222 H  HB   . THR A 1 155 ? 2.01000  21.81500  10.92600  1.000 15.59000 ?  159 THR A HB   1 
ATOM   2223 H  HG1  . THR A 1 155 ? 1.00400  22.03200  8.90500   1.000 17.55000 ?  159 THR A HG1  1 
ATOM   2224 H  HG21 . THR A 1 155 ? 1.54000  19.90400  9.60700   1.000 15.69000 ?  159 THR A HG21 1 
ATOM   2225 H  HG22 . THR A 1 155 ? 1.52400  19.59600  11.15500  1.000 15.69000 ?  159 THR A HG22 1 
ATOM   2226 H  HG23 . THR A 1 155 ? 0.16500  19.76300  10.36900  1.000 15.69000 ?  159 THR A HG23 1 
ATOM   2227 N  N    . PHE A 1 156 ? 1.85900  21.75500  13.75000  1.000 12.17778 ?  160 PHE A N    1 
ATOM   2228 C  CA   . PHE A 1 156 ? 2.53200  21.14000  14.88400  1.000 11.81457 ?  160 PHE A CA   1 
ATOM   2229 C  C    . PHE A 1 156 ? 1.54600  20.88000  16.01500  1.000 11.95406 ?  160 PHE A C    1 
ATOM   2230 O  O    . PHE A 1 156 ? 0.75900  21.76100  16.39400  1.000 12.32779 ?  160 PHE A O    1 
ATOM   2231 C  CB   . PHE A 1 156 ? 3.60200  22.12800  15.36800  1.000 12.42781 ?  160 PHE A CB   1 
ATOM   2232 C  CG   . PHE A 1 156 ? 4.39900  21.67900  16.57300  1.000 12.35938 ?  160 PHE A CG   1 
ATOM   2233 C  CD1  . PHE A 1 156 ? 3.88000  21.81300  17.84900  1.000 12.80417 ?  160 PHE A CD1  1 
ATOM   2234 C  CD2  . PHE A 1 156 ? 5.67500  21.14300  16.42200  1.000 12.69363 ?  160 PHE A CD2  1 
ATOM   2235 C  CE1  . PHE A 1 156 ? 4.60700  21.41800  18.95900  1.000 13.17000 ?  160 PHE A CE1  1 
ATOM   2236 C  CE2  . PHE A 1 156 ? 6.40800  20.75300  17.53300  1.000 13.32791 ?  160 PHE A CE2  1 
ATOM   2237 C  CZ   . PHE A 1 156 ? 5.87100  20.89900  18.80000  1.000 13.15421 ?  160 PHE A CZ   1 
ATOM   2238 H  H    . PHE A 1 156 ? 2.22500  22.48800  13.48700  1.000 14.61000 ?  160 PHE A H    1 
ATOM   2239 H  HA   . PHE A 1 156 ? 2.93100  20.29300  14.63100  1.000 14.17000 ?  160 PHE A HA   1 
ATOM   2240 H  HB2  . PHE A 1 156 ? 4.23000  22.27800  14.64400  1.000 14.91000 ?  160 PHE A HB2  1 
ATOM   2241 H  HB3  . PHE A 1 156 ? 3.16500  22.96100  15.60400  1.000 14.91000 ?  160 PHE A HB3  1 
ATOM   2242 H  HD1  . PHE A 1 156 ? 3.03000  22.17200  17.96300  1.000 15.36000 ?  160 PHE A HD1  1 
ATOM   2243 H  HD2  . PHE A 1 156 ? 6.03800  21.04700  15.57200  1.000 15.23000 ?  160 PHE A HD2  1 
ATOM   2244 H  HE1  . PHE A 1 156 ? 4.24300  21.50500  19.81100  1.000 15.80000 ?  160 PHE A HE1  1 
ATOM   2245 H  HE2  . PHE A 1 156 ? 7.25900  20.39400  17.42700  1.000 15.99000 ?  160 PHE A HE2  1 
ATOM   2246 H  HZ   . PHE A 1 156 ? 6.36500  20.64500  19.54500  1.000 15.78000 ?  160 PHE A HZ   1 
ATOM   2247 N  N    . ARG A 1 157 ? 1.66200  19.70400  16.63000  1.000 11.89616 ?  161 ARG A N    1 
ATOM   2248 C  CA   . ARG A 1 157 ? 0.98400  19.48700  17.90800  1.000 12.01723 ?  161 ARG A CA   1 
ATOM   2249 C  C    . ARG A 1 157 ? 1.85000  18.60200  18.78200  1.000 12.17778 ?  161 ARG A C    1 
ATOM   2250 O  O    . ARG A 1 157 ? 2.30200  17.53100  18.36200  1.000 12.69363 ?  161 ARG A O    1 
ATOM   2251 C  CB   . ARG A 1 157 ? -0.41700 18.89300  17.75000  1.000 13.04367 ?  161 ARG A CB   1 
ATOM   2252 C  CG   . ARG A 1 157 ? -0.45300 17.61200  16.98200  1.000 12.82522 ?  161 ARG A CG   1 
ATOM   2253 C  CD   . ARG A 1 157 ? -1.88000 17.15100  16.72400  1.000 13.51215 ?  161 ARG A CD   1 
ATOM   2254 N  NE   . ARG A 1 157 ? -2.54100 16.75600  17.96100  1.000 13.40161 ?  161 ARG A NE   1 
ATOM   2255 C  CZ   . ARG A 1 157 ? -3.78700 16.28600  18.02100  1.000 14.36225 ?  161 ARG A CZ   1 
ATOM   2256 N  NH1  . ARG A 1 157 ? -4.51500 16.13900  16.93000  1.000 14.63597 ?  161 ARG A NH1  1 
ATOM   2257 N  NH2  . ARG A 1 157 ? -4.31500 15.95200  19.19900  1.000 15.19656 ?  161 ARG A NH2  1 
ATOM   2258 H  H    . ARG A 1 157 ? 2.11500  19.03500  16.33600  1.000 14.27000 ?  161 ARG A H    1 
ATOM   2259 H  HA   . ARG A 1 157 ? 0.87400  20.34300  18.35000  1.000 14.42000 ?  161 ARG A HA   1 
ATOM   2260 H  HB2  . ARG A 1 157 ? -0.78200 18.71900  18.63100  1.000 15.65000 ?  161 ARG A HB2  1 
ATOM   2261 H  HB3  . ARG A 1 157 ? -0.97400 19.53300  17.28000  1.000 15.65000 ?  161 ARG A HB3  1 
ATOM   2262 H  HG2  . ARG A 1 157 ? -0.01400 17.73800  16.12700  1.000 15.39000 ?  161 ARG A HG2  1 
ATOM   2263 H  HG3  . ARG A 1 157 ? 0.00200  16.92100  17.49000  1.000 15.39000 ?  161 ARG A HG3  1 
ATOM   2264 H  HD2  . ARG A 1 157 ? -2.38500 17.87600  16.32500  1.000 16.21000 ?  161 ARG A HD2  1 
ATOM   2265 H  HD3  . ARG A 1 157 ? -1.86800 16.38700  16.12600  1.000 16.21000 ?  161 ARG A HD3  1 
ATOM   2266 H  HE   . ARG A 1 157 ? -2.10200 16.83100  18.69600  1.000 16.08000 ?  161 ARG A HE   1 
ATOM   2267 H  HH11 . ARG A 1 157 ? -4.18700 16.34800  16.16300  1.000 17.56000 ?  161 ARG A HH11 1 
ATOM   2268 H  HH12 . ARG A 1 157 ? -5.31700 15.83400  16.98600  1.000 17.56000 ?  161 ARG A HH12 1 
ATOM   2269 H  HH21 . ARG A 1 157 ? -3.85200 16.04000  19.91800  1.000 18.23000 ?  161 ARG A HH21 1 
ATOM   2270 H  HH22 . ARG A 1 157 ? -5.11900 15.64800  19.24000  1.000 18.23000 ?  161 ARG A HH22 1 
ATOM   2271 N  N    . LEU A 1 158 ? 2.08900  19.06500  20.00500  1.000 12.76206 ?  162 LEU A N    1 
ATOM   2272 C  CA   . LEU A 1 158 ? 2.62200  18.21100  21.05100  1.000 12.18041 ?  162 LEU A CA   1 
ATOM   2273 C  C    . LEU A 1 158 ? 1.49500  17.98900  22.04800  1.000 11.86458 ?  162 LEU A C    1 
ATOM   2274 O  O    . LEU A 1 158 ? 0.77300  18.93600  22.41000  1.000 13.32265 ?  162 LEU A O    1 
ATOM   2275 C  CB   . LEU A 1 158 ? 3.86100  18.77500  21.75400  1.000 12.44097 ?  162 LEU A CB   1 
ATOM   2276 C  CG   . LEU A 1 158 ? 4.71400  17.66500  22.39800  1.000 12.93839 ?  162 LEU A CG   1 
ATOM   2277 C  CD1  . LEU A 1 158 ? 5.44700  16.86500  21.31700  1.000 13.39371 ?  162 LEU A CD1  1 
ATOM   2278 C  CD2  . LEU A 1 158 ? 5.68800  18.22800  23.42200  1.000 14.52543 ?  162 LEU A CD2  1 
ATOM   2279 H  H    . LEU A 1 158 ? 1.94700  19.87700  20.25100  1.000 15.31000 ?  162 LEU A H    1 
ATOM   2280 H  HA   . LEU A 1 158 ? 2.92300  17.37300  20.66800  1.000 14.61000 ?  162 LEU A HA   1 
ATOM   2281 H  HB2  . LEU A 1 158 ? 4.40900  19.24300  21.10500  1.000 14.93000 ?  162 LEU A HB2  1 
ATOM   2282 H  HB3  . LEU A 1 158 ? 3.57900  19.38600  22.45300  1.000 14.93000 ?  162 LEU A HB3  1 
ATOM   2283 H  HG   . LEU A 1 158 ? 4.12700  17.06000  22.87600  1.000 15.52000 ?  162 LEU A HG   1 
ATOM   2284 H  HD11 . LEU A 1 158 ? 6.02200  16.21100  21.74400  1.000 16.07000 ?  162 LEU A HD11 1 
ATOM   2285 H  HD12 . LEU A 1 158 ? 4.79200  16.41700  20.75900  1.000 16.07000 ?  162 LEU A HD12 1 
ATOM   2286 H  HD13 . LEU A 1 158 ? 5.97900  17.47400  20.78100  1.000 16.07000 ?  162 LEU A HD13 1 
ATOM   2287 H  HD21 . LEU A 1 158 ? 6.22800  17.50400  23.77500  1.000 17.43000 ?  162 LEU A HD21 1 
ATOM   2288 H  HD22 . LEU A 1 158 ? 6.25600  18.88500  22.99000  1.000 17.43000 ?  162 LEU A HD22 1 
ATOM   2289 H  HD23 . LEU A 1 158 ? 5.18500  18.64500  24.13900  1.000 17.43000 ?  162 LEU A HD23 1 
ATOM   2290 N  N    . ASP A 1 159 ? 1.34000  16.73500  22.47000  1.000 11.85932 ?  163 ASP A N    1 
ATOM   2291 C  CA   . ASP A 1 159 ? 0.22800  16.28900  23.29100  1.000 12.17778 ?  163 ASP A CA   1 
ATOM   2292 C  C    . ASP A 1 159 ? 0.66800  15.62600  24.58000  1.000 13.09368 ?  163 ASP A C    1 
ATOM   2293 O  O    . ASP A 1 159 ? -0.06400 15.68500  25.57200  1.000 14.34646 ?  163 ASP A O    1 
ATOM   2294 C  CB   . ASP A 1 159 ? -0.61500 15.29500  22.48700  1.000 12.34622 ?  163 ASP A CB   1 
ATOM   2295 C  CG   . ASP A 1 159 ? -1.27400 15.92400  21.29700  1.000 12.39359 ?  163 ASP A CG   1 
ATOM   2296 O  OD1  . ASP A 1 159 ? -0.61800 16.09600  20.25100  1.000 12.27779 ?  163 ASP A OD1  1 
ATOM   2297 O  OD2  . ASP A 1 159 ? -2.47100 16.24900  21.39000  1.000 14.23855 -1 163 ASP A OD2  1 
ATOM   2298 H  H    . ASP A 1 159 ? 1.89100  16.10200  22.28300  1.000 14.23000 ?  163 ASP A H    1 
ATOM   2299 H  HA   . ASP A 1 159 ? -0.33100 17.04600  23.52900  1.000 14.61000 ?  163 ASP A HA   1 
ATOM   2300 H  HB2  . ASP A 1 159 ? -0.04300 14.58000  22.16900  1.000 14.81000 ?  163 ASP A HB2  1 
ATOM   2301 H  HB3  . ASP A 1 159 ? -1.31000 14.93500  23.05900  1.000 14.81000 ?  163 ASP A HB3  1 
ATOM   2302 N  N    . ARG A 1 160 ? 1.82900  14.98000  24.58400  1.000 13.06736 ?  164 ARG A N    1 
ATOM   2303 C  CA   . ARG A 1 160 ? 2.30500  14.16100  25.69300  1.000 13.37266 ?  164 ARG A CA   1 
ATOM   2304 C  C    . ARG A 1 160 ? 3.74300  14.51500  26.04100  1.000 13.38845 ?  164 ARG A C    1 
ATOM   2305 O  O    . ARG A 1 160 ? 4.37900  15.34400  25.39000  1.000 14.12275 ?  164 ARG A O    1 
ATOM   2306 C  CB   . ARG A 1 160 ? 2.13800  12.67800  25.35200  1.000 13.43319 ?  164 ARG A CB   1 
ATOM   2307 C  CG   . ARG A 1 160 ? 0.67900  12.23000  25.27600  1.000 13.59900 ?  164 ARG A CG   1 
ATOM   2308 C  CD   . ARG A 1 160 ? 0.54100  10.82300  24.75300  1.000 14.05432 ?  164 ARG A CD   1 
ATOM   2309 N  NE   . ARG A 1 160 ? 0.89900  10.77900  23.33600  1.000 13.22264 ?  164 ARG A NE   1 
ATOM   2310 C  CZ   . ARG A 1 160 ? 1.10500  9.67400   22.64400  1.000 13.25948 ?  164 ARG A CZ   1 
ATOM   2311 N  NH1  . ARG A 1 160 ? 0.84100  8.48400   23.15100  1.000 13.74902 ?  164 ARG A NH1  1 
ATOM   2312 N  NH2  . ARG A 1 160 ? 1.59800  9.76900   21.41200  1.000 13.23317 ?  164 ARG A NH2  1 
ATOM   2313 H  H    . ARG A 1 160 ? 2.38300  15.00300  23.92600  1.000 15.68000 ?  164 ARG A H    1 
ATOM   2314 H  HA   . ARG A 1 160 ? 1.78600  14.35800  26.48800  1.000 16.05000 ?  164 ARG A HA   1 
ATOM   2315 H  HB2  . ARG A 1 160 ? 2.54600  12.50700  24.48900  1.000 16.12000 ?  164 ARG A HB2  1 
ATOM   2316 H  HB3  . ARG A 1 160 ? 2.57600  12.14800  26.03700  1.000 16.12000 ?  164 ARG A HB3  1 
ATOM   2317 H  HG2  . ARG A 1 160 ? 0.29000  12.26100  26.16400  1.000 16.31000 ?  164 ARG A HG2  1 
ATOM   2318 H  HG3  . ARG A 1 160 ? 0.19500  12.82200  24.68100  1.000 16.31000 ?  164 ARG A HG3  1 
ATOM   2319 H  HD2  . ARG A 1 160 ? 1.13500  10.23300  25.24300  1.000 16.86000 ?  164 ARG A HD2  1 
ATOM   2320 H  HD3  . ARG A 1 160 ? -0.37700 10.52700  24.85200  1.000 16.86000 ?  164 ARG A HD3  1 
ATOM   2321 H  HE   . ARG A 1 160 ? 0.98100  11.52900  22.92300  1.000 15.86000 ?  164 ARG A HE   1 
ATOM   2322 H  HH11 . ARG A 1 160 ? 0.52800  8.41600   23.94900  1.000 16.49000 ?  164 ARG A HH11 1 
ATOM   2323 H  HH12 . ARG A 1 160 ? 0.98200  7.77600   22.68300  1.000 16.49000 ?  164 ARG A HH12 1 
ATOM   2324 H  HH21 . ARG A 1 160 ? 1.77700  10.54100  21.07900  1.000 15.88000 ?  164 ARG A HH21 1 
ATOM   2325 H  HH22 . ARG A 1 160 ? 1.73700  9.05800   20.94900  1.000 15.88000 ?  164 ARG A HH22 1 
ATOM   2326 N  N    . TRP A 1 161 ? 4.22700  13.88200  27.10300  1.000 14.26224 ?  165 TRP A N    1 
ATOM   2327 C  CA   . TRP A 1 161 ? 5.55300  14.08300  27.66000  1.000 14.85178 ?  165 TRP A CA   1 
ATOM   2328 C  C    . TRP A 1 161 ? 6.46700  12.92600  27.26800  1.000 14.87810 ?  165 TRP A C    1 
ATOM   2329 O  O    . TRP A 1 161 ? 6.02800  11.93900  26.67900  1.000 14.96758 ?  165 TRP A O    1 
ATOM   2330 C  CB   . TRP A 1 161 ? 5.44000  14.17000  29.17700  1.000 15.58608 ?  165 TRP A CB   1 
ATOM   2331 C  CG   . TRP A 1 161 ? 4.56600  15.26900  29.68700  1.000 16.65726 ?  165 TRP A CG   1 
ATOM   2332 C  CD1  . TRP A 1 161 ? 3.20000  15.31200  29.67700  1.000 17.27839 ?  165 TRP A CD1  1 
ATOM   2333 C  CD2  . TRP A 1 161 ? 4.99700  16.46800  30.30900  1.000 16.18615 ?  165 TRP A CD2  1 
ATOM   2334 N  NE1  . TRP A 1 161 ? 2.76000  16.46400  30.27000  1.000 18.20481 ?  165 TRP A NE1  1 
ATOM   2335 C  CE2  . TRP A 1 161 ? 3.84400  17.19500  30.67000  1.000 16.84412 ?  165 TRP A CE2  1 
ATOM   2336 C  CE3  . TRP A 1 161 ? 6.25200  17.00200  30.60700  1.000 16.73359 ?  165 TRP A CE3  1 
ATOM   2337 C  CZ2  . TRP A 1 161 ? 3.91400  18.42300  31.30000  1.000 17.63633 ?  165 TRP A CZ2  1 
ATOM   2338 C  CZ3  . TRP A 1 161 ? 6.31900  18.21500  31.24100  1.000 17.84688 ?  165 TRP A CZ3  1 
ATOM   2339 C  CH2  . TRP A 1 161 ? 5.16100  18.91400  31.57600  1.000 18.19955 ?  165 TRP A CH2  1 
ATOM   2340 H  H    . TRP A 1 161 ? 3.77600  13.29600  27.54300  1.000 17.11000 ?  165 TRP A H    1 
ATOM   2341 H  HA   . TRP A 1 161 ? 5.94100  14.90300  27.31700  1.000 17.82000 ?  165 TRP A HA   1 
ATOM   2342 H  HB2  . TRP A 1 161 ? 5.07500  13.33300  29.50600  1.000 18.70000 ?  165 TRP A HB2  1 
ATOM   2343 H  HB3  . TRP A 1 161 ? 6.32700  14.31100  29.54300  1.000 18.70000 ?  165 TRP A HB3  1 
ATOM   2344 H  HD1  . TRP A 1 161 ? 2.65000  14.65300  29.31900  1.000 20.73000 ?  165 TRP A HD1  1 
ATOM   2345 H  HE1  . TRP A 1 161 ? 1.93700  16.69200  30.37300  1.000 21.84000 ?  165 TRP A HE1  1 
ATOM   2346 H  HE3  . TRP A 1 161 ? 7.02800  16.54300  30.37900  1.000 20.08000 ?  165 TRP A HE3  1 
ATOM   2347 H  HZ2  . TRP A 1 161 ? 3.14500  18.89500  31.52700  1.000 21.16000 ?  165 TRP A HZ2  1 
ATOM   2348 H  HZ3  . TRP A 1 161 ? 7.14900  18.57700  31.45000  1.000 21.41000 ?  165 TRP A HZ3  1 
ATOM   2349 H  HH2  . TRP A 1 161 ? 5.23800  19.73900  31.99900  1.000 21.84000 ?  165 TRP A HH2  1 
ATOM   2350 N  N    . GLU A 1 162 ? 7.75500  13.04400  27.60200  1.000 15.33868 ?  166 GLU A N    1 
ATOM   2351 C  CA   . GLU A 1 162 ? 8.66400  11.90800  27.42600  1.000 15.41764 ?  166 GLU A CA   1 
ATOM   2352 C  C    . GLU A 1 162 ? 8.41000  10.90800  28.55600  1.000 16.28353 ?  166 GLU A C    1 
ATOM   2353 O  O    . GLU A 1 162 ? 8.26500  11.29900  29.69700  1.000 17.94952 ?  166 GLU A O    1 
ATOM   2354 C  CB   . GLU A 1 162 ? 10.12500 12.36800  27.49200  1.000 16.80465 ?  166 GLU A CB   1 
ATOM   2355 C  CG   . GLU A 1 162 ? 10.55800 13.18400  26.29400  1.000 17.79161 ?  166 GLU A CG   1 
ATOM   2356 C  CD   . GLU A 1 162 ? 10.71100 12.37400  25.01700  1.000 17.32576 ?  166 GLU A CD   1 
ATOM   2357 O  OE1  . GLU A 1 162 ? 10.43900 11.15100  25.02900  1.000 16.27037 ?  166 GLU A OE1  1 
ATOM   2358 O  OE2  . GLU A 1 162 ? 11.11700 12.96900  23.99100  1.000 18.26535 -1 166 GLU A OE2  1 
ATOM   2359 H  H    . GLU A 1 162 ? 8.11900  13.75400  27.92400  1.000 18.40000 ?  166 GLU A H    1 
ATOM   2360 H  HA   . GLU A 1 162 ? 8.51300  11.49300  26.56200  1.000 18.50000 ?  166 GLU A HA   1 
ATOM   2361 H  HB2  . GLU A 1 162 ? 10.24400 12.91600  28.28300  1.000 20.16000 ?  166 GLU A HB2  1 
ATOM   2362 H  HB3  . GLU A 1 162 ? 10.69600 11.58600  27.54100  1.000 20.16000 ?  166 GLU A HB3  1 
ATOM   2363 H  HG2  . GLU A 1 162 ? 9.89500  13.87100  26.12900  1.000 21.34000 ?  166 GLU A HG2  1 
ATOM   2364 H  HG3  . GLU A 1 162 ? 11.41700 13.59100  26.48900  1.000 21.34000 ?  166 GLU A HG3  1 
ATOM   2365 N  N    A LEU A 1 163 ? 8.30900  9.62600   28.23500  0.440 15.97823 ?  167 LEU A N    1 
ATOM   2366 N  N    B LEU A 1 163 ? 8.30100  9.62300   28.23800  0.560 15.75978 ?  167 LEU A N    1 
ATOM   2367 C  CA   A LEU A 1 163 ? 8.55500  8.99600   26.89500  0.440 15.31499 ?  167 LEU A CA   1 
ATOM   2368 C  CA   B LEU A 1 163 ? 8.54900  8.98200   26.91200  0.560 14.90705 ?  167 LEU A CA   1 
ATOM   2369 C  C    A LEU A 1 163 ? 7.26700  8.62000   26.14600  0.440 14.61754 ?  167 LEU A C    1 
ATOM   2370 C  C    B LEU A 1 163 ? 7.27300  8.62900   26.14900  0.560 14.27803 ?  167 LEU A C    1 
ATOM   2371 O  O    A LEU A 1 163 ? 7.37300  8.08900   25.04600  0.440 14.48332 ?  167 LEU A O    1 
ATOM   2372 O  O    B LEU A 1 163 ? 7.37700  8.09400   25.04600  0.560 14.10169 ?  167 LEU A O    1 
ATOM   2373 C  CB   A LEU A 1 163 ? 9.42100  7.75500   27.09200  0.440 16.55198 ?  167 LEU A CB   1 
ATOM   2374 C  CB   B LEU A 1 163 ? 9.32200  7.69600   27.14700  0.560 16.44408 ?  167 LEU A CB   1 
ATOM   2375 C  CG   A LEU A 1 163 ? 10.92000 7.99400   27.24600  0.440 17.11521 ?  167 LEU A CG   1 
ATOM   2376 C  CG   B LEU A 1 163 ? 10.62000 7.72400   27.93700  0.560 17.32576 ?  167 LEU A CG   1 
ATOM   2377 C  CD1  A LEU A 1 163 ? 11.27500 8.67800   28.57500  0.440 17.17311 ?  167 LEU A CD1  1 
ATOM   2378 C  CD1  B LEU A 1 163 ? 11.05500 6.34900   28.35100  0.560 18.68119 ?  167 LEU A CD1  1 
ATOM   2379 C  CD2  A LEU A 1 163 ? 11.71900 6.71300   27.11100  0.440 17.59685 ?  167 LEU A CD2  1 
ATOM   2380 C  CD2  B LEU A 1 163 ? 11.65700 8.37700   27.04100  0.560 16.86781 ?  167 LEU A CD2  1 
ATOM   2381 H  H    A LEU A 1 163 ? 8.08100  9.03000   28.81100  0.440 19.17000 ?  167 LEU A H    1 
ATOM   2382 H  H    B LEU A 1 163 ? 8.06300  9.03200   28.81600  0.560 18.91000 ?  167 LEU A H    1 
ATOM   2383 H  HA   A LEU A 1 163 ? 9.00900  9.64100   26.33000  0.440 18.37000 ?  167 LEU A HA   1 
ATOM   2384 H  HA   B LEU A 1 163 ? 9.04100  9.61200   26.36300  0.560 17.89000 ?  167 LEU A HA   1 
ATOM   2385 H  HB2  A LEU A 1 163 ? 9.12000  7.30300   27.89600  0.440 19.86000 ?  167 LEU A HB2  1 
ATOM   2386 H  HB2  B LEU A 1 163 ? 8.73100  7.09000   27.62000  0.560 19.73000 ?  167 LEU A HB2  1 
ATOM   2387 H  HB3  A LEU A 1 163 ? 9.30100  7.17800   26.32200  0.440 19.86000 ?  167 LEU A HB3  1 
ATOM   2388 H  HB3  B LEU A 1 163 ? 9.54300  7.33200   26.27600  0.560 19.73000 ?  167 LEU A HB3  1 
ATOM   2389 H  HG   A LEU A 1 163 ? 11.17100 8.59000   26.52300  0.440 20.53000 ?  167 LEU A HG   1 
ATOM   2390 H  HG   B LEU A 1 163 ? 10.51300 8.22100   28.76300  0.560 20.79000 ?  167 LEU A HG   1 
ATOM   2391 H  HD11 A LEU A 1 163 ? 12.10800 8.30900   28.90800  0.440 20.60000 ?  167 LEU A HD11 1 
ATOM   2392 H  HD11 B LEU A 1 163 ? 12.02300 6.32600   28.40300  0.560 22.41000 ?  167 LEU A HD11 1 
ATOM   2393 H  HD12 A LEU A 1 163 ? 11.37200 9.63100   28.42400  0.440 20.60000 ?  167 LEU A HD12 1 
ATOM   2394 H  HD12 B LEU A 1 163 ? 10.67200 6.14500   29.21800  0.560 22.41000 ?  167 LEU A HD12 1 
ATOM   2395 H  HD13 A LEU A 1 163 ? 10.56300 8.51600   29.21400  0.440 20.60000 ?  167 LEU A HD13 1 
ATOM   2396 H  HD13 B LEU A 1 163 ? 10.74300 5.70800   27.69300  0.560 22.41000 ?  167 LEU A HD13 1 
ATOM   2397 H  HD21 A LEU A 1 163 ? 12.66200 6.91800   27.21000  0.440 21.11000 ?  167 LEU A HD21 1 
ATOM   2398 H  HD21 B LEU A 1 163 ? 12.53900 8.22000   27.41300  0.560 20.24000 ?  167 LEU A HD21 1 
ATOM   2399 H  HD22 A LEU A 1 163 ? 11.44000 6.09300   27.80300  0.440 21.11000 ?  167 LEU A HD22 1 
ATOM   2400 H  HD22 B LEU A 1 163 ? 11.59800 7.99000   26.15400  0.560 20.24000 ?  167 LEU A HD22 1 
ATOM   2401 H  HD23 A LEU A 1 163 ? 11.55400 6.32900   26.23600  0.440 21.11000 ?  167 LEU A HD23 1 
ATOM   2402 H  HD23 B LEU A 1 163 ? 11.48200 9.33000   26.99800  0.560 20.24000 ?  167 LEU A HD23 1 
ATOM   2403 N  N    . GLU A 1 164 ? 6.10200  8.91000   26.72200  1.000 14.35698 ?  168 GLU A N    1 
ATOM   2404 C  CA   . GLU A 1 164 ? 4.85300  8.48400   26.10600  1.000 14.65702 ?  168 GLU A CA   1 
ATOM   2405 C  C    . GLU A 1 164 ? 4.64500  9.03600   24.70200  1.000 13.92799 ?  168 GLU A C    1 
ATOM   2406 O  O    . GLU A 1 164 ? 3.96000  8.39600   23.89200  1.000 14.76493 ?  168 GLU A O    1 
ATOM   2407 C  CB   . GLU A 1 164 ? 3.67900  8.90700   26.99900  1.000 16.70463 ?  168 GLU A CB   1 
ATOM   2408 C  CG   . GLU A 1 164 ? 3.56700  8.08500   28.26800  1.000 20.33139 ?  168 GLU A CG   1 
ATOM   2409 C  CD   . GLU A 1 164 ? 4.38700  8.59700   29.44100  1.000 23.21857 ?  168 GLU A CD   1 
ATOM   2410 O  OE1  . GLU A 1 164 ? 5.09600  9.62100   29.33400  1.000 23.13698 ?  168 GLU A OE1  1 
ATOM   2411 O  OE2  . GLU A 1 164 ? 4.28600  7.95500   30.51200  1.000 26.44528 -1 168 GLU A OE2  1 
ATOM   2412 H  H    . GLU A 1 164 ? 6.01300  9.34100   27.46100  1.000 17.23000 ?  168 GLU A H    1 
ATOM   2413 H  HA   . GLU A 1 164 ? 4.88000  7.51800   26.02800  1.000 17.59000 ?  168 GLU A HA   1 
ATOM   2414 H  HB2  . GLU A 1 164 ? 3.79700  9.83500   27.25500  1.000 20.04000 ?  168 GLU A HB2  1 
ATOM   2415 H  HB3  . GLU A 1 164 ? 2.85300  8.80200   26.50200  1.000 20.04000 ?  168 GLU A HB3  1 
ATOM   2416 H  HG2  . GLU A 1 164 ? 2.63700  8.07500   28.54700  1.000 24.39000 ?  168 GLU A HG2  1 
ATOM   2417 H  HG3  . GLU A 1 164 ? 3.86500  7.18200   28.07700  1.000 24.39000 ?  168 GLU A HG3  1 
ATOM   2418 N  N    . LEU A 1 165 ? 5.20400  10.20300  24.39400  1.000 13.70164 ?  169 LEU A N    1 
ATOM   2419 C  CA   . LEU A 1 165 ? 5.00200  10.82500  23.09300  1.000 13.49899 ?  169 LEU A CA   1 
ATOM   2420 C  C    . LEU A 1 165 ? 5.62600  10.04800  21.94400  1.000 13.97536 ?  169 LEU A C    1 
ATOM   2421 O  O    . LEU A 1 165 ? 5.39700  10.42600  20.79800  1.000 14.82546 ?  169 LEU A O    1 
ATOM   2422 C  CB   . LEU A 1 165 ? 5.48100  12.27800  23.11100  1.000 12.99630 ?  169 LEU A CB   1 
ATOM   2423 C  CG   . LEU A 1 165 ? 6.98900  12.50500  23.31400  1.000 13.40424 ?  169 LEU A CG   1 
ATOM   2424 C  CD1  . LEU A 1 165 ? 7.77400  12.36700  22.01300  1.000 14.62281 ?  169 LEU A CD1  1 
ATOM   2425 C  CD2  . LEU A 1 165 ? 7.19800  13.85500  23.91000  1.000 14.42278 ?  169 LEU A CD2  1 
ATOM   2426 H  H    . LEU A 1 165 ? 5.70600  10.65600  24.92500  1.000 16.44000 ?  169 LEU A H    1 
ATOM   2427 H  HA   . LEU A 1 165 ? 4.04900  10.85200  22.91300  1.000 16.19000 ?  169 LEU A HA   1 
ATOM   2428 H  HB2  . LEU A 1 165 ? 5.24400  12.68200  22.26200  1.000 15.59000 ?  169 LEU A HB2  1 
ATOM   2429 H  HB3  . LEU A 1 165 ? 5.02500  12.73400  23.83600  1.000 15.59000 ?  169 LEU A HB3  1 
ATOM   2430 H  HG   . LEU A 1 165 ? 7.33100  11.82300  23.91300  1.000 16.08000 ?  169 LEU A HG   1 
ATOM   2431 H  HD11 . LEU A 1 165 ? 8.67300  12.70600  22.15000  1.000 17.55000 ?  169 LEU A HD11 1 
ATOM   2432 H  HD12 . LEU A 1 165 ? 7.80800  11.43100  21.76200  1.000 17.55000 ?  169 LEU A HD12 1 
ATOM   2433 H  HD13 . LEU A 1 165 ? 7.33000  12.88000  21.32000  1.000 17.55000 ?  169 LEU A HD13 1 
ATOM   2434 H  HD21 . LEU A 1 165 ? 8.14200  13.97400  24.09800  1.000 17.31000 ?  169 LEU A HD21 1 
ATOM   2435 H  HD22 . LEU A 1 165 ? 6.90000  14.52900  23.27900  1.000 17.31000 ?  169 LEU A HD22 1 
ATOM   2436 H  HD23 . LEU A 1 165 ? 6.68600  13.92100  24.73100  1.000 17.31000 ?  169 LEU A HD23 1 
ATOM   2437 N  N    . ASN A 1 166 ? 6.41600  9.00500   22.20600  1.000 13.27528 ?  170 ASN A N    1 
ATOM   2438 C  CA   . ASN A 1 166 ? 7.09000  8.23700   21.16800  1.000 13.59374 ?  170 ASN A CA   1 
ATOM   2439 C  C    . ASN A 1 166 ? 6.29600  7.04800   20.63400  1.000 13.15947 ?  170 ASN A C    1 
ATOM   2440 O  O    . ASN A 1 166 ? 6.83600  6.27400   19.85100  1.000 14.21749 ?  170 ASN A O    1 
ATOM   2441 C  CB   . ASN A 1 166 ? 8.44000  7.74500   21.69100  1.000 15.02285 ?  170 ASN A CB   1 
ATOM   2442 C  CG   . ASN A 1 166 ? 9.35200  8.87900   22.04700  1.000 15.52028 ?  170 ASN A CG   1 
ATOM   2443 O  OD1  . ASN A 1 166 ? 9.78800  9.61900   21.17400  1.000 16.70990 ?  170 ASN A OD1  1 
ATOM   2444 N  ND2  . ASN A 1 166 ? 9.62800  9.04400   23.32700  1.000 17.25996 ?  170 ASN A ND2  1 
ATOM   2445 H  H    . ASN A 1 166 ? 6.57900  8.71900   23.00000  1.000 15.93000 ?  170 ASN A H    1 
ATOM   2446 H  HA   . ASN A 1 166 ? 7.23100  8.83400   20.41700  1.000 16.31000 ?  170 ASN A HA   1 
ATOM   2447 H  HB2  . ASN A 1 166 ? 8.29800  7.20900   22.48600  1.000 18.03000 ?  170 ASN A HB2  1 
ATOM   2448 H  HB3  . ASN A 1 166 ? 8.87200  7.21200   21.00500  1.000 18.03000 ?  170 ASN A HB3  1 
ATOM   2449 H  HD21 . ASN A 1 166 ? 10.14700 9.68300   23.57600  1.000 20.71000 ?  170 ASN A HD21 1 
ATOM   2450 H  HD22 . ASN A 1 166 ? 9.28900  8.51300   23.91200  1.000 20.71000 ?  170 ASN A HD22 1 
ATOM   2451 N  N    . SER A 1 167 ? 5.02000  6.88800   21.00500  1.000 13.30159 ?  171 SER A N    1 
ATOM   2452 C  CA   . SER A 1 167 ? 4.29600  5.66800   20.65100  1.000 13.15158 ?  171 SER A CA   1 
ATOM   2453 C  C    . SER A 1 167 ? 4.11600  5.48500   19.14200  1.000 12.60151 ?  171 SER A C    1 
ATOM   2454 O  O    . SER A 1 167 ? 4.01900  4.34700   18.66500  1.000 13.34897 ?  171 SER A O    1 
ATOM   2455 C  CB   . SER A 1 167 ? 2.95600  5.60800   21.39600  1.000 13.34107 ?  171 SER A CB   1 
ATOM   2456 O  OG   . SER A 1 167 ? 2.19100  6.77700   21.20600  1.000 13.53583 ?  171 SER A OG   1 
ATOM   2457 H  H    . SER A 1 167 ? 4.56100  7.46100   21.45300  1.000 15.96000 ?  171 SER A H    1 
ATOM   2458 H  HA   . SER A 1 167 ? 4.82600  4.91200   20.94600  1.000 15.78000 ?  171 SER A HA   1 
ATOM   2459 H  HB2  . SER A 1 167 ? 2.45000  4.84800   21.06600  1.000 16.01000 ?  171 SER A HB2  1 
ATOM   2460 H  HB3  . SER A 1 167 ? 3.13200  5.50200   22.34400  1.000 16.01000 ?  171 SER A HB3  1 
ATOM   2461 H  HG   . SER A 1 167 ? 2.01300  6.87400   20.39100  1.000 16.24000 ?  171 SER A HG   1 
ATOM   2462 N  N    . ALA A 1 168 ? 4.02900  6.57800   18.38600  1.000 12.23305 ?  172 ALA A N    1 
ATOM   2463 C  CA   . ALA A 1 168 ? 4.09500  6.54000   16.91700  1.000 12.05934 ?  172 ALA A CA   1 
ATOM   2464 C  C    . ALA A 1 168 ? 3.03000  5.62300   16.30100  1.000 12.19620 ?  172 ALA A C    1 
ATOM   2465 O  O    . ALA A 1 168 ? 3.26000  4.93500   15.30400  1.000 13.11736 ?  172 ALA A O    1 
ATOM   2466 C  CB   . ALA A 1 168 ? 5.50200  6.16300   16.44300  1.000 12.99103 ?  172 ALA A CB   1 
ATOM   2467 H  H    . ALA A 1 168 ? 3.92900  7.37100   18.70200  1.000 14.68000 ?  172 ALA A H    1 
ATOM   2468 H  HA   . ALA A 1 168 ? 3.89500  7.43200   16.59000  1.000 14.47000 ?  172 ALA A HA   1 
ATOM   2469 H  HB1  . ALA A 1 168 ? 5.51800  6.16000   15.47300  1.000 15.59000 ?  172 ALA A HB1  1 
ATOM   2470 H  HB2  . ALA A 1 168 ? 6.13500  6.81400   16.78200  1.000 15.59000 ?  172 ALA A HB2  1 
ATOM   2471 H  HB3  . ALA A 1 168 ? 5.72300  5.28000   16.78000  1.000 15.59000 ?  172 ALA A HB3  1 
ATOM   2472 N  N    . ILE A 1 169 ? 1.84500  5.61400   16.89900  1.000 12.56730 ?  173 ILE A N    1 
ATOM   2473 C  CA   . ILE A 1 169 ? 0.79800  4.68000   16.48500  1.000 12.23568 ?  173 ILE A CA   1 
ATOM   2474 C  C    . ILE A 1 169 ? 0.27600  5.08800   15.11300  1.000 11.95933 ?  173 ILE A C    1 
ATOM   2475 O  O    . ILE A 1 169 ? -0.05600 6.27100   14.90600  1.000 12.46202 ?  173 ILE A O    1 
ATOM   2476 C  CB   . ILE A 1 169 ? -0.33500 4.70100   17.52200  1.000 12.76732 ?  173 ILE A CB   1 
ATOM   2477 C  CG1  . ILE A 1 169 ? 0.13400  4.10000   18.84800  1.000 14.69387 ?  173 ILE A CG1  1 
ATOM   2478 C  CG2  . ILE A 1 169 ? -1.57300 3.99800   16.98600  1.000 13.59374 ?  173 ILE A CG2  1 
ATOM   2479 C  CD1  . ILE A 1 169 ? -0.76400 4.43400   20.03000  1.000 16.47040 ?  173 ILE A CD1  1 
ATOM   2480 H  H    . ILE A 1 169 ? 1.61900  6.13400   17.54500  1.000 15.07000 ?  173 ILE A H    1 
ATOM   2481 H  HA   . ILE A 1 169 ? 1.16200  3.78300   16.41900  1.000 14.68000 ?  173 ILE A HA   1 
ATOM   2482 H  HB   . ILE A 1 169 ? -0.57600 5.62500   17.69100  1.000 15.32000 ?  173 ILE A HB   1 
ATOM   2483 H  HG12 . ILE A 1 169 ? 0.15900  3.13400   18.76100  1.000 17.63000 ?  173 ILE A HG12 1 
ATOM   2484 H  HG13 . ILE A 1 169 ? 1.02100  4.43800   19.04700  1.000 17.63000 ?  173 ILE A HG13 1 
ATOM   2485 H  HG21 . ILE A 1 169 ? -2.19900 3.86300   17.71400  1.000 16.31000 ?  173 ILE A HG21 1 
ATOM   2486 H  HG22 . ILE A 1 169 ? -1.97800 4.55200   16.30000  1.000 16.31000 ?  173 ILE A HG22 1 
ATOM   2487 H  HG23 . ILE A 1 169 ? -1.31300 3.14300   16.61000  1.000 16.31000 ?  173 ILE A HG23 1 
ATOM   2488 H  HD11 . ILE A 1 169 ? -0.35200 4.10300   20.84400  1.000 19.76000 ?  173 ILE A HD11 1 
ATOM   2489 H  HD12 . ILE A 1 169 ? -0.87200 5.39700   20.08300  1.000 19.76000 ?  173 ILE A HD12 1 
ATOM   2490 H  HD13 . ILE A 1 169 ? -1.62700 4.01100   19.90000  1.000 19.76000 ?  173 ILE A HD13 1 
ATOM   2491 N  N    . PRO A 1 170 ? 0.16400  4.16000   14.16900  1.000 12.43833 ?  174 PRO A N    1 
ATOM   2492 C  CA   . PRO A 1 170 ? -0.33500 4.53700   12.83900  1.000 12.83312 ?  174 PRO A CA   1 
ATOM   2493 C  C    . PRO A 1 170 ? -1.69100 5.21300   12.90300  1.000 12.78048 ?  174 PRO A C    1 
ATOM   2494 O  O    . PRO A 1 170 ? -2.63200 4.70100   13.52400  1.000 13.23843 ?  174 PRO A O    1 
ATOM   2495 C  CB   . PRO A 1 170 ? -0.37500 3.20700   12.08800  1.000 13.96220 ?  174 PRO A CB   1 
ATOM   2496 C  CG   . PRO A 1 170 ? 0.70300  2.38600   12.74600  1.000 14.03853 ?  174 PRO A CG   1 
ATOM   2497 C  CD   . PRO A 1 170 ? 0.63700  2.76600   14.20200  1.000 13.39634 ?  174 PRO A CD   1 
ATOM   2498 H  HA   . PRO A 1 170 ? 0.28800  5.13900   12.40200  1.000 15.40000 ?  174 PRO A HA   1 
ATOM   2499 H  HB2  . PRO A 1 170 ? -1.24500 2.79100   12.19100  1.000 16.75000 ?  174 PRO A HB2  1 
ATOM   2500 H  HB3  . PRO A 1 170 ? -0.18400 3.34800   11.14800  1.000 16.75000 ?  174 PRO A HB3  1 
ATOM   2501 H  HG2  . PRO A 1 170 ? 0.52200  1.44100   12.62500  1.000 16.84000 ?  174 PRO A HG2  1 
ATOM   2502 H  HG3  . PRO A 1 170 ? 1.56800  2.60900   12.36700  1.000 16.84000 ?  174 PRO A HG3  1 
ATOM   2503 H  HD2  . PRO A 1 170 ? 0.00900  2.20000   14.67800  1.000 16.07000 ?  174 PRO A HD2  1 
ATOM   2504 H  HD3  . PRO A 1 170 ? 1.51300  2.70900   14.61400  1.000 16.07000 ?  174 PRO A HD3  1 
ATOM   2505 N  N    . GLY A 1 171 ? -1.77400 6.38100   12.26200  1.000 12.93839 ?  175 GLY A N    1 
ATOM   2506 C  CA   . GLY A 1 171 ? -2.99500 7.16100   12.18600  1.000 13.69638 ?  175 GLY A CA   1 
ATOM   2507 C  C    . GLY A 1 171 ? -3.24200 8.09500   13.35400  1.000 14.24908 ?  175 GLY A C    1 
ATOM   2508 O  O    . GLY A 1 171 ? -4.18000 8.88700   13.30000  1.000 16.17826 ?  175 GLY A O    1 
ATOM   2509 H  H    . GLY A 1 171 ? -1.11300 6.74800   11.85200  1.000 15.52000 ?  175 GLY A H    1 
ATOM   2510 H  HA2  . GLY A 1 171 ? -2.96600 7.70100   11.38000  1.000 16.43000 ?  175 GLY A HA2  1 
ATOM   2511 H  HA3  . GLY A 1 171 ? -3.74700 6.55200   12.13200  1.000 16.43000 ?  175 GLY A HA3  1 
ATOM   2512 N  N    . ASP A 1 172 ? -2.42100 8.04600   14.38900  1.000 12.94103 ?  176 ASP A N    1 
ATOM   2513 C  CA   . ASP A 1 172 ? -2.58800 8.87400   15.58200  1.000 13.06472 ?  176 ASP A CA   1 
ATOM   2514 C  C    . ASP A 1 172 ? -1.93100 10.22300  15.32700  1.000 13.20685 ?  176 ASP A C    1 
ATOM   2515 O  O    . ASP A 1 172 ? -0.73400 10.28500  15.03800  1.000 13.89114 ?  176 ASP A O    1 
ATOM   2516 C  CB   . ASP A 1 172 ? -1.93900 8.14100   16.76700  1.000 13.14894 ?  176 ASP A CB   1 
ATOM   2517 C  CG   . ASP A 1 172 ? -2.16500 8.79000   18.11500  1.000 13.75165 ?  176 ASP A CG   1 
ATOM   2518 O  OD1  . ASP A 1 172 ? -2.70600 9.89200   18.21300  1.000 14.34119 ?  176 ASP A OD1  1 
ATOM   2519 O  OD2  . ASP A 1 172 ? -1.76500 8.13400   19.10800  1.000 15.63609 -1 176 ASP A OD2  1 
ATOM   2520 H  H    . ASP A 1 172 ? -1.73700 7.52700   14.43000  1.000 15.53000 ?  176 ASP A H    1 
ATOM   2521 H  HA   . ASP A 1 172 ? -3.52300 9.03800   15.78400  1.000 15.67000 ?  176 ASP A HA   1 
ATOM   2522 H  HB2  . ASP A 1 172 ? -2.30400 7.24300   16.81100  1.000 15.77000 ?  176 ASP A HB2  1 
ATOM   2523 H  HB3  . ASP A 1 172 ? -0.98100 8.10200   16.61800  1.000 15.77000 ?  176 ASP A HB3  1 
ATOM   2524 N  N    . ALA A 1 173 ? -2.71200 11.29700  15.36700  1.000 12.50939 ?  177 ALA A N    1 
ATOM   2525 C  CA   . ALA A 1 173 ? -2.16600 12.62500  15.14500  1.000 13.29633 ?  177 ALA A CA   1 
ATOM   2526 C  C    . ALA A 1 173 ? -1.44300 13.19100  16.35800  1.000 12.44623 ?  177 ALA A C    1 
ATOM   2527 O  O    . ALA A 1 173 ? -0.78400 14.22300  16.22900  1.000 12.10145 ?  177 ALA A O    1 
ATOM   2528 C  CB   . ALA A 1 173 ? -3.25700 13.59800  14.70100  1.000 14.11222 ?  177 ALA A CB   1 
ATOM   2529 H  H    . ALA A 1 173 ? -3.55800 11.28000  15.52100  1.000 15.01000 ?  177 ALA A H    1 
ATOM   2530 H  HA   . ALA A 1 173 ? -1.52400 12.56100  14.42000  1.000 15.95000 ?  177 ALA A HA   1 
ATOM   2531 H  HB1  . ALA A 1 173 ? -2.86400 14.47500  14.57100  1.000 16.93000 ?  177 ALA A HB1  1 
ATOM   2532 H  HB2  . ALA A 1 173 ? -3.64200 13.28200  13.86800  1.000 16.93000 ?  177 ALA A HB2  1 
ATOM   2533 H  HB3  . ALA A 1 173 ? -3.94100 13.64000  15.38700  1.000 16.93000 ?  177 ALA A HB3  1 
ATOM   2534 N  N    . ARG A 1 174 ? -1.56200 12.59300  17.53800  1.000 12.29095 ?  178 ARG A N    1 
ATOM   2535 C  CA   . ARG A 1 174 ? -0.87400 13.17500  18.68000  1.000 12.29884 ?  178 ARG A CA   1 
ATOM   2536 C  C    . ARG A 1 174 ? 0.63400  13.23500  18.43700  1.000 11.35926 ?  178 ARG A C    1 
ATOM   2537 O  O    . ARG A 1 174 ? 1.23400  12.30200  17.90200  1.000 11.93827 ?  178 ARG A O    1 
ATOM   2538 C  CB   . ARG A 1 174 ? -1.13400 12.34800  19.92900  1.000 12.64625 ?  178 ARG A CB   1 
ATOM   2539 C  CG   . ARG A 1 174 ? -2.55600 12.43900  20.45000  1.000 13.30686 ?  178 ARG A CG   1 
ATOM   2540 C  CD   . ARG A 1 174 ? -2.76300 11.60000  21.68600  1.000 13.79639 ?  178 ARG A CD   1 
ATOM   2541 N  NE   . ARG A 1 174 ? -2.56400 10.18900  21.38900  1.000 14.27276 ?  178 ARG A NE   1 
ATOM   2542 C  CZ   . ARG A 1 174 ? -2.53900 9.22500   22.28800  1.000 14.55174 ?  178 ARG A CZ   1 
ATOM   2543 N  NH1  . ARG A 1 174 ? -2.71100 9.48200   23.56900  1.000 15.93875 ?  178 ARG A NH1  1 
ATOM   2544 N  NH2  . ARG A 1 174 ? -2.34700 7.97400   21.88800  1.000 15.16498 ?  178 ARG A NH2  1 
ATOM   2545 H  H    . ARG A 1 174 ? -2.01500 11.88000  17.69600  1.000 14.75000 ?  178 ARG A H    1 
ATOM   2546 H  HA   . ARG A 1 174 ? -1.20800 14.07500  18.81600  1.000 14.76000 ?  178 ARG A HA   1 
ATOM   2547 H  HB2  . ARG A 1 174 ? -0.95400 11.41700  19.72800  1.000 15.17000 ?  178 ARG A HB2  1 
ATOM   2548 H  HB3  . ARG A 1 174 ? -0.54300 12.65500  20.63400  1.000 15.17000 ?  178 ARG A HB3  1 
ATOM   2549 H  HG2  . ARG A 1 174 ? -2.75500 13.36200  20.67500  1.000 15.96000 ?  178 ARG A HG2  1 
ATOM   2550 H  HG3  . ARG A 1 174 ? -3.16700 12.12600  19.76600  1.000 15.96000 ?  178 ARG A HG3  1 
ATOM   2551 H  HD2  . ARG A 1 174 ? -2.12500 11.86400  22.36800  1.000 16.55000 ?  178 ARG A HD2  1 
ATOM   2552 H  HD3  . ARG A 1 174 ? -3.66800 11.72200  22.01300  1.000 16.55000 ?  178 ARG A HD3  1 
ATOM   2553 H  HE   . ARG A 1 174 ? -2.45500 9.96800   20.56600  1.000 17.13000 ?  178 ARG A HE   1 
ATOM   2554 H  HH11 . ARG A 1 174 ? -2.84300 10.29100  23.83100  1.000 19.12000 ?  178 ARG A HH11 1 
ATOM   2555 H  HH12 . ARG A 1 174 ? -2.69200 8.84200   24.14300  1.000 19.12000 ?  178 ARG A HH12 1 
ATOM   2556 H  HH21 . ARG A 1 174 ? -2.24200 7.80100   21.05200  1.000 18.19000 ?  178 ARG A HH21 1 
ATOM   2557 H  HH22 . ARG A 1 174 ? -2.32900 7.33600   22.46400  1.000 18.19000 ?  178 ARG A HH22 1 
ATOM   2558 N  N    . ASP A 1 175 ? 1.25700  14.32800  18.88000  1.000 11.14607 ?  179 ASP A N    1 
ATOM   2559 C  CA   . ASP A 1 175 ? 2.72000  14.44900  18.83900  1.000 11.54086 ?  179 ASP A CA   1 
ATOM   2560 C  C    . ASP A 1 175 ? 3.27000  14.27800  17.42600  1.000 11.39610 ?  179 ASP A C    1 
ATOM   2561 O  O    . ASP A 1 175 ? 4.27500  13.58200  17.20900  1.000 11.76983 ?  179 ASP A O    1 
ATOM   2562 C  CB   . ASP A 1 175 ? 3.35400  13.46100  19.80800  1.000 11.86984 ?  179 ASP A CB   1 
ATOM   2563 C  CG   . ASP A 1 175 ? 2.72400  13.56000  21.18000  1.000 11.97512 ?  179 ASP A CG   1 
ATOM   2564 O  OD1  . ASP A 1 175 ? 2.88900  14.62700  21.81600  1.000 12.25147 ?  179 ASP A OD1  1 
ATOM   2565 O  OD2  . ASP A 1 175 ? 2.03600  12.59600  21.61400  1.000 12.83575 -1 179 ASP A OD2  1 
ATOM   2566 H  H    . ASP A 1 175 ? 0.85700  15.01400  19.21000  1.000 13.37000 ?  179 ASP A H    1 
ATOM   2567 H  HA   . ASP A 1 175 ? 2.96100  15.34800  19.11200  1.000 13.85000 ?  179 ASP A HA   1 
ATOM   2568 H  HB2  . ASP A 1 175 ? 3.22700  12.55800  19.47700  1.000 14.24000 ?  179 ASP A HB2  1 
ATOM   2569 H  HB3  . ASP A 1 175 ? 4.30100  13.65300  19.89100  1.000 14.24000 ?  179 ASP A HB3  1 
ATOM   2570 N  N    . THR A 1 176 ? 2.63400  14.95800  16.47100  1.000 11.37505 ?  180 THR A N    1 
ATOM   2571 C  CA   . THR A 1 176 ? 3.04200  14.91200  15.07600  1.000 11.48559 ?  180 THR A CA   1 
ATOM   2572 C  C    . THR A 1 176 ? 3.17000  16.31300  14.50100  1.000 11.45400 ?  180 THR A C    1 
ATOM   2573 O  O    . THR A 1 176 ? 2.61000  17.29100  15.00900  1.000 11.61981 ?  180 THR A O    1 
ATOM   2574 C  CB   . THR A 1 176 ? 2.04600  14.15200  14.17300  1.000 12.05408 ?  180 THR A CB   1 
ATOM   2575 O  OG1  . THR A 1 176 ? 0.78700  14.84200  14.14200  1.000 12.77258 ?  180 THR A OG1  1 
ATOM   2576 C  CG2  . THR A 1 176 ? 1.85600  12.71600  14.58700  1.000 12.55414 ?  180 THR A CG2  1 
ATOM   2577 H  H    . THR A 1 176 ? 1.95200  15.46100  16.61400  1.000 13.65000 ?  180 THR A H    1 
ATOM   2578 H  HA   . THR A 1 176 ? 3.90300  14.46600  15.06200  1.000 13.78000 ?  180 THR A HA   1 
ATOM   2579 H  HB   . THR A 1 176 ? 2.41600  14.12200  13.27700  1.000 14.46000 ?  180 THR A HB   1 
ATOM   2580 H  HG1  . THR A 1 176 ? 0.42700  14.81800  14.90000  1.000 15.32000 ?  180 THR A HG1  1 
ATOM   2581 H  HG21 . THR A 1 176 ? 1.16800  12.30200  14.04300  1.000 15.06000 ?  180 THR A HG21 1 
ATOM   2582 H  HG22 . THR A 1 176 ? 2.68600  12.22600  14.47300  1.000 15.06000 ?  180 THR A HG22 1 
ATOM   2583 H  HG23 . THR A 1 176 ? 1.59000  12.67200  15.51900  1.000 15.06000 ?  180 THR A HG23 1 
ATOM   2584 N  N    . SER A 1 177 ? 3.89100  16.39000  13.38700  1.000 11.45137 ?  181 SER A N    1 
ATOM   2585 C  CA   . SER A 1 177 ? 3.77600  17.53100  12.49100  1.000 11.59350 ?  181 SER A CA   1 
ATOM   2586 C  C    . SER A 1 177 ? 3.97100  17.01900  11.07500  1.000 11.39610 ?  181 SER A C    1 
ATOM   2587 O  O    . SER A 1 177 ? 4.02300  15.81300  10.84800  1.000 12.54361 ?  181 SER A O    1 
ATOM   2588 C  CB   . SER A 1 177 ? 4.75200  18.64900  12.83900  1.000 11.66192 ?  181 SER A CB   1 
ATOM   2589 O  OG   . SER A 1 177 ? 4.31800  19.82800  12.19400  1.000 12.26463 ?  181 SER A OG   1 
ATOM   2590 H  H    . SER A 1 177 ? 4.45300  15.79200  13.13000  1.000 13.74000 ?  181 SER A H    1 
ATOM   2591 H  HA   . SER A 1 177 ? 2.88300  17.89700  12.58700  1.000 13.91000 ?  181 SER A HA   1 
ATOM   2592 H  HB2  . SER A 1 177 ? 4.76200  18.78700  13.79900  1.000 13.99000 ?  181 SER A HB2  1 
ATOM   2593 H  HB3  . SER A 1 177 ? 5.64100  18.41500  12.52800  1.000 13.99000 ?  181 SER A HB3  1 
ATOM   2594 H  HG   . SER A 1 177 ? 4.88300  20.44000  12.30200  1.000 14.71000 ?  181 SER A HG   1 
ATOM   2595 N  N    . SER A 1 178 ? 4.10100  17.93900  10.12000  1.000 11.58297 ?  182 SER A N    1 
ATOM   2596 C  CA   . SER A 1 178 ? 4.39600  17.56900  8.73900   1.000 11.30925 ?  182 SER A CA   1 
ATOM   2597 C  C    . SER A 1 178 ? 5.81000  18.01000  8.38400   1.000 11.18555 ?  182 SER A C    1 
ATOM   2598 O  O    . SER A 1 178 ? 6.32200  18.98100  8.95300   1.000 11.50927 ?  182 SER A O    1 
ATOM   2599 C  CB   . SER A 1 178 ? 3.44100  18.22600  7.74700   1.000 11.82247 ?  182 SER A CB   1 
ATOM   2600 O  OG   . SER A 1 178 ? 3.63100  19.62800  7.74700   1.000 12.10145 ?  182 SER A OG   1 
ATOM   2601 H  H    . SER A 1 178 ? 4.02200  18.78600  10.24800  1.000 13.90000 ?  182 SER A H    1 
ATOM   2602 H  HA   . SER A 1 178 ? 4.30600  16.60700  8.64600   1.000 13.57000 ?  182 SER A HA   1 
ATOM   2603 H  HB2  . SER A 1 178 ? 3.61700  17.88000  6.85800   1.000 14.19000 ?  182 SER A HB2  1 
ATOM   2604 H  HB3  . SER A 1 178 ? 2.52700  18.02700  8.00500   1.000 14.19000 ?  182 SER A HB3  1 
ATOM   2605 H  HG   . SER A 1 178 ? 3.05600  19.99500  7.25800   1.000 14.52000 ?  182 SER A HG   1 
ATOM   2606 N  N    . PRO A 1 179 ? 6.45200  17.34700  7.41400   1.000 11.03817 ?  183 PRO A N    1 
ATOM   2607 C  CA   . PRO A 1 179 ? 7.77800  17.81500  6.97500   1.000 11.31451 ?  183 PRO A CA   1 
ATOM   2608 C  C    . PRO A 1 179 ? 7.74800  19.26300  6.53800   1.000 11.22766 ?  183 PRO A C    1 
ATOM   2609 O  O    . PRO A 1 179 ? 8.68200  20.02700  6.82300   1.000 12.29095 ?  183 PRO A O    1 
ATOM   2610 C  CB   . PRO A 1 179 ? 8.13100  16.83300  5.84300   1.000 12.04618 ?  183 PRO A CB   1 
ATOM   2611 C  CG   . PRO A 1 179 ? 7.40900  15.57100  6.21600   1.000 12.16988 ?  183 PRO A CG   1 
ATOM   2612 C  CD   . PRO A 1 179 ? 6.09100  16.04900  6.82100   1.000 11.67245 ?  183 PRO A CD   1 
ATOM   2613 H  HA   . PRO A 1 179 ? 8.44300  17.71000  7.67300   1.000 13.57000 ?  183 PRO A HA   1 
ATOM   2614 H  HB2  . PRO A 1 179 ? 7.81700  17.17700  4.99200   1.000 14.45000 ?  183 PRO A HB2  1 
ATOM   2615 H  HB3  . PRO A 1 179 ? 9.09000  16.69100  5.81100   1.000 14.45000 ?  183 PRO A HB3  1 
ATOM   2616 H  HG2  . PRO A 1 179 ? 7.25400  15.03000  5.42600   1.000 14.60000 ?  183 PRO A HG2  1 
ATOM   2617 H  HG3  . PRO A 1 179 ? 7.92900  15.07000  6.86400   1.000 14.60000 ?  183 PRO A HG3  1 
ATOM   2618 H  HD2  . PRO A 1 179 ? 5.41400  16.15800  6.13500   1.000 14.00000 ?  183 PRO A HD2  1 
ATOM   2619 H  HD3  . PRO A 1 179 ? 5.77800  15.43300  7.50100   1.000 14.00000 ?  183 PRO A HD3  1 
ATOM   2620 N  N    . ARG A 1 180 ? 6.68000  19.67100  5.84400   1.000 11.90406 ?  184 ARG A N    1 
ATOM   2621 C  CA   . ARG A 1 180 ? 6.59100  21.05100  5.38500   1.000 12.15935 ?  184 ARG A CA   1 
ATOM   2622 C  C    . ARG A 1 180 ? 6.54300  22.03500  6.55200   1.000 11.75404 ?  184 ARG A C    1 
ATOM   2623 O  O    . ARG A 1 180 ? 7.25500  23.04300  6.55500   1.000 12.52782 ?  184 ARG A O    1 
ATOM   2624 C  CB   . ARG A 1 180 ? 5.39300  21.22500  4.46400   1.000 12.79101 ?  184 ARG A CB   1 
ATOM   2625 C  CG   . ARG A 1 180 ? 5.19400  22.63700  4.00600   1.000 13.50688 ?  184 ARG A CG   1 
ATOM   2626 C  CD   . ARG A 1 180 ? 4.19300  22.65700  2.89200   1.000 14.77019 ?  184 ARG A CD   1 
ATOM   2627 N  NE   . ARG A 1 180 ? 4.07500  23.99300  2.34100   1.000 16.70727 ?  184 ARG A NE   1 
ATOM   2628 C  CZ   . ARG A 1 180 ? 3.45500  24.24700  1.20200   1.000 19.33127 ?  184 ARG A CZ   1 
ATOM   2629 N  NH1  . ARG A 1 180 ? 2.85200  23.28600  0.52300   1.000 20.28927 ?  184 ARG A NH1  1 
ATOM   2630 N  NH2  . ARG A 1 180 ? 3.46200  25.48500  0.72500   1.000 21.04463 ?  184 ARG A NH2  1 
ATOM   2631 H  H    . ARG A 1 180 ? 6.01000  19.17600  5.63300   1.000 14.28000 ?  184 ARG A H    1 
ATOM   2632 H  HA   . ARG A 1 180 ? 7.38900  21.25400  4.87100   1.000 14.59000 ?  184 ARG A HA   1 
ATOM   2633 H  HB2  . ARG A 1 180 ? 5.51900  20.67200  3.67700   1.000 15.34000 ?  184 ARG A HB2  1 
ATOM   2634 H  HB3  . ARG A 1 180 ? 4.59200  20.95100  4.93700   1.000 15.34000 ?  184 ARG A HB3  1 
ATOM   2635 H  HG2  . ARG A 1 180 ? 4.86000  23.17700  4.73900   1.000 16.21000 ?  184 ARG A HG2  1 
ATOM   2636 H  HG3  . ARG A 1 180 ? 6.03300  22.99900  3.68200   1.000 16.21000 ?  184 ARG A HG3  1 
ATOM   2637 H  HD2  . ARG A 1 180 ? 4.48000  22.05600  2.18600   1.000 17.72000 ?  184 ARG A HD2  1 
ATOM   2638 H  HD3  . ARG A 1 180 ? 3.32600  22.38400  3.22900   1.000 17.72000 ?  184 ARG A HD3  1 
ATOM   2639 H  HE   . ARG A 1 180 ? 4.42400  24.64800  2.77400   1.000 20.04000 ?  184 ARG A HE   1 
ATOM   2640 H  HH11 . ARG A 1 180 ? 2.86000  22.48000  0.82000   1.000 24.35000 ?  184 ARG A HH11 1 
ATOM   2641 H  HH12 . ARG A 1 180 ? 2.45300  23.46800  -0.21700  1.000 24.35000 ?  184 ARG A HH12 1 
ATOM   2642 H  HH21 . ARG A 1 180 ? 3.86800  26.10900  1.15600   1.000 25.25000 ?  184 ARG A HH21 1 
ATOM   2643 H  HH22 . ARG A 1 180 ? 3.06200  25.66300  -0.01500  1.000 25.25000 ?  184 ARG A HH22 1 
ATOM   2644 N  N    . ALA A 1 181 ? 5.64800  21.79500  7.52300   1.000 11.69088 ?  185 ALA A N    1 
ATOM   2645 C  CA   . ALA A 1 181 ? 5.52500  22.72400  8.64400   1.000 11.95933 ?  185 ALA A CA   1 
ATOM   2646 C  C    . ALA A 1 181 ? 6.79900  22.76200  9.47800   1.000 11.79615 ?  185 ALA A C    1 
ATOM   2647 O  O    . ALA A 1 181 ? 7.19800  23.82800  9.96100   1.000 12.44097 ?  185 ALA A O    1 
ATOM   2648 C  CB   . ALA A 1 181 ? 4.34100  22.34100  9.53300   1.000 12.05934 ?  185 ALA A CB   1 
ATOM   2649 H  H    . ALA A 1 181 ? 5.11600  21.11900  7.55200   1.000 14.03000 ?  185 ALA A H    1 
ATOM   2650 H  HA   . ALA A 1 181 ? 5.36300  23.60900  8.28200   1.000 14.35000 ?  185 ALA A HA   1 
ATOM   2651 H  HB1  . ALA A 1 181 ? 4.26200  22.98900  10.25000  1.000 14.47000 ?  185 ALA A HB1  1 
ATOM   2652 H  HB2  . ALA A 1 181 ? 3.53200  22.33900  8.99800   1.000 14.47000 ?  185 ALA A HB2  1 
ATOM   2653 H  HB3  . ALA A 1 181 ? 4.49600  21.45700  9.90200   1.000 14.47000 ?  185 ALA A HB3  1 
ATOM   2654 N  N    . VAL A 1 182 ? 7.45200  21.60800  9.64100   1.000 11.35136 ?  186 VAL A N    1 
ATOM   2655 C  CA   . VAL A 1 182 ? 8.73000  21.57000  10.35100  1.000 11.46190 ?  186 VAL A CA   1 
ATOM   2656 C  C    . VAL A 1 182 ? 9.75100  22.47200  9.65500   1.000 11.62771 ?  186 VAL A C    1 
ATOM   2657 O  O    . VAL A 1 182 ? 10.43100 23.27900  10.29500  1.000 12.31727 ?  186 VAL A O    1 
ATOM   2658 C  CB   . VAL A 1 182 ? 9.22200  20.11700  10.48700  1.000 12.02249 ?  186 VAL A CB   1 
ATOM   2659 C  CG1  . VAL A 1 182 ? 10.68800 20.07400  10.93800  1.000 12.14883 ?  186 VAL A CG1  1 
ATOM   2660 C  CG2  . VAL A 1 182 ? 8.33500  19.33900  11.45200  1.000 11.92775 ?  186 VAL A CG2  1 
ATOM   2661 H  H    . VAL A 1 182 ? 7.17900  20.84500  9.35400   1.000 13.62000 ?  186 VAL A H    1 
ATOM   2662 H  HA   . VAL A 1 182 ? 8.60400  21.91800  11.24800  1.000 13.75000 ?  186 VAL A HA   1 
ATOM   2663 H  HB   . VAL A 1 182 ? 9.16800  19.69000  9.61800   1.000 14.43000 ?  186 VAL A HB   1 
ATOM   2664 H  HG11 . VAL A 1 182 ? 10.92300 19.16000  11.16200  1.000 14.57000 ?  186 VAL A HG11 1 
ATOM   2665 H  HG12 . VAL A 1 182 ? 11.25000 20.39300  10.21500  1.000 14.57000 ?  186 VAL A HG12 1 
ATOM   2666 H  HG13 . VAL A 1 182 ? 10.79500 20.64300  11.71700  1.000 14.57000 ?  186 VAL A HG13 1 
ATOM   2667 H  HG21 . VAL A 1 182 ? 8.64400  18.42000  11.49400  1.000 14.31000 ?  186 VAL A HG21 1 
ATOM   2668 H  HG22 . VAL A 1 182 ? 8.38900  19.74700  12.33000  1.000 14.31000 ?  186 VAL A HG22 1 
ATOM   2669 H  HG23 . VAL A 1 182 ? 7.42000  19.36500  11.13100  1.000 14.31000 ?  186 VAL A HG23 1 
ATOM   2670 N  N    . THR A 1 183 ? 9.87600  22.33700  8.33200   1.000 11.94880 ?  187 THR A N    1 
ATOM   2671 C  CA   . THR A 1 183 ? 10.82100 23.15700  7.57700   1.000 12.74363 ?  187 THR A CA   1 
ATOM   2672 C  C    . THR A 1 183 ? 10.45900 24.63700  7.64500   1.000 12.97524 ?  187 THR A C    1 
ATOM   2673 O  O    . THR A 1 183 ? 11.32500 25.49600  7.84500   1.000 13.20158 ?  187 THR A O    1 
ATOM   2674 C  CB   . THR A 1 183 ? 10.89500 22.67100  6.12700   1.000 13.29896 ?  187 THR A CB   1 
ATOM   2675 O  OG1  . THR A 1 183 ? 11.42000 21.34800  6.11800   1.000 15.43080 ?  187 THR A OG1  1 
ATOM   2676 C  CG2  . THR A 1 183 ? 11.75800 23.57600  5.27400   1.000 14.78598 ?  187 THR A CG2  1 
ATOM   2677 H  H    . THR A 1 183 ? 9.42900  21.78100  7.85200   1.000 14.34000 ?  187 THR A H    1 
ATOM   2678 H  HA   . THR A 1 183 ? 11.70300 23.05700  7.96700   1.000 15.29000 ?  187 THR A HA   1 
ATOM   2679 H  HB   . THR A 1 183 ? 10.00700 22.68200  5.73600   1.000 15.96000 ?  187 THR A HB   1 
ATOM   2680 H  HG1  . THR A 1 183 ? 11.54300 21.09200  5.32700   1.000 18.51000 ?  187 THR A HG1  1 
ATOM   2681 H  HG21 . THR A 1 183 ? 11.88800 23.18100  4.39700   1.000 17.74000 ?  187 THR A HG21 1 
ATOM   2682 H  HG22 . THR A 1 183 ? 11.33100 24.44000  5.16900   1.000 17.74000 ?  187 THR A HG22 1 
ATOM   2683 H  HG23 . THR A 1 183 ? 12.62300 23.70100  5.69400   1.000 17.74000 ?  187 THR A HG23 1 
ATOM   2684 N  N    . GLU A 1 184 ? 9.18000  24.95900  7.47500   1.000 12.64099 ?  188 GLU A N    1 
ATOM   2685 C  CA   . GLU A 1 184 ? 8.75900  26.35100  7.51600   1.000 13.28580 ?  188 GLU A CA   1 
ATOM   2686 C  C    . GLU A 1 184 ? 9.04700  26.97400  8.87000   1.000 12.48571 ?  188 GLU A C    1 
ATOM   2687 O  O    . GLU A 1 184 ? 9.54400  28.10500  8.95100   1.000 13.48583 ?  188 GLU A O    1 
ATOM   2688 C  CB   . GLU A 1 184 ? 7.27300  26.43500  7.15800   1.000 13.92799 ?  188 GLU A CB   1 
ATOM   2689 C  CG   . GLU A 1 184 ? 7.05900  26.14500  5.66100   1.000 14.68334 ?  188 GLU A CG   1 
ATOM   2690 C  CD   . GLU A 1 184 ? 5.60900  25.97400  5.25500   1.000 16.28353 ?  188 GLU A CD   1 
ATOM   2691 O  OE1  . GLU A 1 184 ? 4.74500  25.71200  6.12600   1.000 16.74411 ?  188 GLU A OE1  1 
ATOM   2692 O  OE2  . GLU A 1 184 ? 5.32800  26.08500  4.03100   1.000 17.33366 -1 188 GLU A OE2  1 
ATOM   2693 H  H    . GLU A 1 184 ? 8.54500  24.39600  7.33700   1.000 15.17000 ?  188 GLU A H    1 
ATOM   2694 H  HA   . GLU A 1 184 ? 9.25400  26.86500  6.86000   1.000 15.94000 ?  188 GLU A HA   1 
ATOM   2695 H  HB2  . GLU A 1 184 ? 6.77800  25.78000  7.67300   1.000 16.71000 ?  188 GLU A HB2  1 
ATOM   2696 H  HB3  . GLU A 1 184 ? 6.94300  27.32700  7.35000   1.000 16.71000 ?  188 GLU A HB3  1 
ATOM   2697 H  HG2  . GLU A 1 184 ? 7.42100  26.88500  5.14800   1.000 17.62000 ?  188 GLU A HG2  1 
ATOM   2698 H  HG3  . GLU A 1 184 ? 7.52500  25.32500  5.43600   1.000 17.62000 ?  188 GLU A HG3  1 
ATOM   2699 N  N    . SER A 1 185 ? 8.74800  26.24600  9.94900   1.000 12.75942 ?  189 SER A N    1 
ATOM   2700 C  CA   . SER A 1 185 ? 9.03900  26.78000  11.27400  1.000 12.71995 ?  189 SER A CA   1 
ATOM   2701 C  C    . SER A 1 185 ? 10.53500 26.85900  11.54400  1.000 12.91207 ?  189 SER A C    1 
ATOM   2702 O  O    . SER A 1 185 ? 11.00700 27.84300  12.12200  1.000 13.30949 ?  189 SER A O    1 
ATOM   2703 C  CB   . SER A 1 185 ? 8.34700  25.92400  12.31800  1.000 12.92787 ?  189 SER A CB   1 
ATOM   2704 O  OG   . SER A 1 185 ? 6.96400  26.17300  12.26200  1.000 12.89628 ?  189 SER A OG   1 
ATOM   2705 H  H    . SER A 1 185 ? 8.38800  25.46600  9.93900   1.000 15.31000 ?  189 SER A H    1 
ATOM   2706 H  HA   . SER A 1 185 ? 8.69200  27.68400  11.33100  1.000 15.26000 ?  189 SER A HA   1 
ATOM   2707 H  HB2  . SER A 1 185 ? 8.51600  24.98700  12.13300  1.000 15.51000 ?  189 SER A HB2  1 
ATOM   2708 H  HB3  . SER A 1 185 ? 8.68300  26.15400  13.19900  1.000 15.51000 ?  189 SER A HB3  1 
ATOM   2709 H  HG   . SER A 1 185 ? 6.55500  25.63600  12.76200  1.000 15.47000 ?  189 SER A HG   1 
ATOM   2710 N  N    . LEU A 1 186 ? 11.29600 25.85400  11.09900  1.000 12.92523 ?  190 LEU A N    1 
ATOM   2711 C  CA   . LEU A 1 186 ? 12.74500 25.90500  11.27600  1.000 12.44886 ?  190 LEU A CA   1 
ATOM   2712 C  C    . LEU A 1 186 ? 13.32400 27.12200  10.57100  1.000 13.47530 ?  190 LEU A C    1 
ATOM   2713 O  O    . LEU A 1 186 ? 14.19900 27.81100  11.11500  1.000 14.27803 ?  190 LEU A O    1 
ATOM   2714 C  CB   . LEU A 1 186 ? 13.37600 24.61200  10.77100  1.000 12.53835 ?  190 LEU A CB   1 
ATOM   2715 C  CG   . LEU A 1 186 ? 14.87200 24.45000  11.00700  1.000 14.00957 ?  190 LEU A CG   1 
ATOM   2716 C  CD1  . LEU A 1 186 ? 15.18700 24.44900  12.49800  1.000 15.19919 ?  190 LEU A CD1  1 
ATOM   2717 C  CD2  . LEU A 1 186 ? 15.35100 23.16800  10.34600  1.000 14.73598 ?  190 LEU A CD2  1 
ATOM   2718 H  H    . LEU A 1 186 ? 11.00400 25.15000  10.70100  1.000 15.51000 ?  190 LEU A H    1 
ATOM   2719 H  HA   . LEU A 1 186 ? 12.95700 25.97900  12.21900  1.000 14.93000 ?  190 LEU A HA   1 
ATOM   2720 H  HB2  . LEU A 1 186 ? 12.93600 23.87000  11.21400  1.000 15.05000 ?  190 LEU A HB2  1 
ATOM   2721 H  HB3  . LEU A 1 186 ? 13.23100 24.56100  9.81400   1.000 15.05000 ?  190 LEU A HB3  1 
ATOM   2722 H  HG   . LEU A 1 186 ? 15.34900 25.19700  10.61400  1.000 16.81000 ?  190 LEU A HG   1 
ATOM   2723 H  HD11 . LEU A 1 186 ? 16.13800 24.30000  12.62000  1.000 18.24000 ?  190 LEU A HD11 1 
ATOM   2724 H  HD12 . LEU A 1 186 ? 14.93600 25.30800  12.87400  1.000 18.24000 ?  190 LEU A HD12 1 
ATOM   2725 H  HD13 . LEU A 1 186 ? 14.68300 23.74000  12.92700  1.000 18.24000 ?  190 LEU A HD13 1 
ATOM   2726 H  HD21 . LEU A 1 186 ? 16.30400 23.07100  10.50100  1.000 17.68000 ?  190 LEU A HD21 1 
ATOM   2727 H  HD22 . LEU A 1 186 ? 14.87500 22.41700  10.73200  1.000 17.68000 ?  190 LEU A HD22 1 
ATOM   2728 H  HD23 . LEU A 1 186 ? 15.17400 23.21900  9.39400   1.000 17.68000 ?  190 LEU A HD23 1 
ATOM   2729 N  N    A GLN A 1 187 ? 12.85600 27.40500  9.35000   0.300 13.89114 ?  191 GLN A N    1 
ATOM   2730 N  N    B GLN A 1 187 ? 12.85100 27.42000  9.36200   0.320 14.04379 ?  191 GLN A N    1 
ATOM   2731 N  N    C GLN A 1 187 ? 12.84400 27.41800  9.36000   0.360 13.89114 ?  191 GLN A N    1 
ATOM   2732 C  CA   A GLN A 1 187 ? 13.32300 28.58300  8.62600   0.300 14.54122 ?  191 GLN A CA   1 
ATOM   2733 C  CA   B GLN A 1 187 ? 13.35900 28.58900  8.65600   0.320 14.83862 ?  191 GLN A CA   1 
ATOM   2734 C  CA   C GLN A 1 187 ? 13.33400 28.58200  8.63000   0.360 14.61228 ?  191 GLN A CA   1 
ATOM   2735 C  C    A GLN A 1 187 ? 13.04100 29.85300  9.42000   0.300 14.57806 ?  191 GLN A C    1 
ATOM   2736 C  C    B GLN A 1 187 ? 13.04500 29.86700  9.42300   0.320 14.67281 ?  191 GLN A C    1 
ATOM   2737 C  C    C GLN A 1 187 ? 13.03300 29.86900  9.39100   0.360 14.57280 ?  191 GLN A C    1 
ATOM   2738 O  O    A GLN A 1 187 ? 13.92200 30.70400  9.58700   0.300 14.87810 ?  191 GLN A O    1 
ATOM   2739 O  O    B GLN A 1 187 ? 13.90300 30.74600  9.56500   0.320 14.89915 ?  191 GLN A O    1 
ATOM   2740 O  O    C GLN A 1 187 ? 13.88700 30.75800  9.49800   0.360 14.77282 ?  191 GLN A O    1 
ATOM   2741 C  CB   A GLN A 1 187 ? 12.64700 28.63900  7.25300   0.300 15.04128 ?  191 GLN A CB   1 
ATOM   2742 C  CB   B GLN A 1 187 ? 12.76700 28.64600  7.25300   0.320 15.72031 ?  191 GLN A CB   1 
ATOM   2743 C  CB   C GLN A 1 187 ? 12.71100 28.60900  7.23000   0.360 15.14392 ?  191 GLN A CB   1 
ATOM   2744 C  CG   A GLN A 1 187 ? 13.00200 29.87400  6.43400   0.300 16.08088 ?  191 GLN A CG   1 
ATOM   2745 C  CG   B GLN A 1 187 ? 13.15500 29.89800  6.49800   0.320 16.83097 ?  191 GLN A CG   1 
ATOM   2746 C  CG   C GLN A 1 187 ? 13.24500 29.71600  6.33200   0.360 16.26511 ?  191 GLN A CG   1 
ATOM   2747 C  CD   A GLN A 1 187 ? 12.21500 29.97800  5.13800   0.300 16.85465 ?  191 GLN A CD   1 
ATOM   2748 C  CD   B GLN A 1 187 ? 12.69200 29.83600  5.07300   0.320 17.69949 ?  191 GLN A CD   1 
ATOM   2749 C  CD   C GLN A 1 187 ? 12.59700 31.05800  6.60300   0.360 17.11258 ?  191 GLN A CD   1 
ATOM   2750 O  OE1  A GLN A 1 187 ? 11.10200 29.46200  5.02300   0.300 17.84951 ?  191 GLN A OE1  1 
ATOM   2751 O  OE1  B GLN A 1 187 ? 12.18100 28.81400  4.62500   0.320 18.02848 ?  191 GLN A OE1  1 
ATOM   2752 O  OE1  C GLN A 1 187 ? 11.45500 31.13300  7.07100   0.360 17.43104 ?  191 GLN A OE1  1 
ATOM   2753 N  NE2  A GLN A 1 187 ? 12.79400 30.64000  4.15400   0.300 17.05468 ?  191 GLN A NE2  1 
ATOM   2754 N  NE2  B GLN A 1 187 ? 12.87600 30.93000  4.34200   0.320 18.32062 ?  191 GLN A NE2  1 
ATOM   2755 N  NE2  C GLN A 1 187 ? 13.32200 32.12800  6.31600   0.360 18.22850 ?  191 GLN A NE2  1 
ATOM   2756 H  H    A GLN A 1 187 ? 12.27500 26.93400  8.92500   0.300 16.67000 ?  191 GLN A H    1 
ATOM   2757 H  H    B GLN A 1 187 ? 12.25000 26.97300  8.94000   0.320 16.85000 ?  191 GLN A H    1 
ATOM   2758 H  H    C GLN A 1 187 ? 12.24100 26.96600  8.94700   0.360 16.66000 ?  191 GLN A H    1 
ATOM   2759 H  HA   A GLN A 1 187 ? 14.28200 28.52000  8.49200   0.300 17.45000 ?  191 GLN A HA   1 
ATOM   2760 H  HA   B GLN A 1 187 ? 14.32200 28.51300  8.57400   0.320 17.80000 ?  191 GLN A HA   1 
ATOM   2761 H  HA   C GLN A 1 187 ? 14.29700 28.51800  8.52800   0.360 17.53000 ?  191 GLN A HA   1 
ATOM   2762 H  HB2  A GLN A 1 187 ? 12.91600 27.86000  6.74300   0.300 18.05000 ?  191 GLN A HB2  1 
ATOM   2763 H  HB2  B GLN A 1 187 ? 13.08200 27.88100  6.74700   0.320 18.86000 ?  191 GLN A HB2  1 
ATOM   2764 H  HB2  C GLN A 1 187 ? 12.89300 27.76200  6.79300   0.360 18.17000 ?  191 GLN A HB2  1 
ATOM   2765 H  HB3  A GLN A 1 187 ? 11.68500 28.63700  7.38000   0.300 18.05000 ?  191 GLN A HB3  1 
ATOM   2766 H  HB3  B GLN A 1 187 ? 11.79900 28.62400  7.31900   0.320 18.86000 ?  191 GLN A HB3  1 
ATOM   2767 H  HB3  C GLN A 1 187 ? 11.75400 28.73700  7.31900   0.360 18.17000 ?  191 GLN A HB3  1 
ATOM   2768 H  HG2  A GLN A 1 187 ? 12.81400 30.66600  6.96200   0.300 19.29000 ?  191 GLN A HG2  1 
ATOM   2769 H  HG2  B GLN A 1 187 ? 12.74600 30.66900  6.92100   0.320 20.19000 ?  191 GLN A HG2  1 
ATOM   2770 H  HG2  C GLN A 1 187 ? 14.19900 29.81000  6.47900   0.360 19.52000 ?  191 GLN A HG2  1 
ATOM   2771 H  HG3  A GLN A 1 187 ? 13.94500 29.84200  6.20900   0.300 19.29000 ?  191 GLN A HG3  1 
ATOM   2772 H  HG3  B GLN A 1 187 ? 14.12100 29.99000  6.50300   0.320 20.19000 ?  191 GLN A HG3  1 
ATOM   2773 H  HG3  C GLN A 1 187 ? 13.07300 29.48300  5.40600   0.360 19.52000 ?  191 GLN A HG3  1 
ATOM   2774 H  HE21 A GLN A 1 187 ? 13.57400 30.98300  4.26700   0.300 20.46000 ?  191 GLN A HE21 1 
ATOM   2775 H  HE21 B GLN A 1 187 ? 13.24100 31.62600  4.69300   0.320 21.98000 ?  191 GLN A HE21 1 
ATOM   2776 H  HE21 C GLN A 1 187 ? 14.11500 32.03700  5.99500   0.360 21.87000 ?  191 GLN A HE21 1 
ATOM   2777 H  HE22 A GLN A 1 187 ? 12.39100 30.72700  3.39900   0.300 20.46000 ?  191 GLN A HE22 1 
ATOM   2778 H  HE22 C GLN A 1 187 ? 13.00100 32.91500  6.45200   0.360 21.87000 ?  191 GLN A HE22 1 
ATOM   2779 N  N    . LYS A 1 188 ? 11.81500 29.98700  9.92800   1.000 14.70439 ?  192 LYS A N    1 
ATOM   2780 C  CA   . LYS A 1 188 ? 11.43600 31.20400  10.64100  1.000 15.13866 ?  192 LYS A CA   1 
ATOM   2781 C  C    . LYS A 1 188 ? 12.33200 31.43600  11.84500  1.000 14.79914 ?  192 LYS A C    1 
ATOM   2782 O  O    . LYS A 1 188 ? 12.69200 32.58100  12.14300  1.000 15.68346 ?  192 LYS A O    1 
ATOM   2783 C  CB   . LYS A 1 188 ? 9.98500  31.11100  11.10700  1.000 15.78084 ?  192 LYS A CB   1 
ATOM   2784 C  CG   . LYS A 1 188 ? 8.95800  31.19400  9.99600   1.000 15.60977 ?  192 LYS A CG   1 
ATOM   2785 C  CD   . LYS A 1 188 ? 7.57900  30.76700  10.48600  1.000 16.54146 ?  192 LYS A CD   1 
ATOM   2786 C  CE   . LYS A 1 188 ? 6.53800  30.83700  9.39800   1.000 16.77043 ?  192 LYS A CE   1 
ATOM   2787 N  NZ   . LYS A 1 188 ? 5.23700  30.31300  9.86800   1.000 17.25470 ?  192 LYS A NZ   1 
ATOM   2788 H  H    . LYS A 1 188 ? 11.20600 29.38200  9.88900   1.000 17.64000 ?  192 LYS A H    1 
ATOM   2789 H  HA   . LYS A 1 188 ? 11.52300 31.95300  10.03100  1.000 18.16000 ?  192 LYS A HA   1 
ATOM   2790 H  HB2  . LYS A 1 188 ? 9.86000  30.26200  11.55800  1.000 18.93000 ?  192 LYS A HB2  1 
ATOM   2791 H  HB3  . LYS A 1 188 ? 9.81100  31.84200  11.72100  1.000 18.93000 ?  192 LYS A HB3  1 
ATOM   2792 H  HG2  . LYS A 1 188 ? 8.90000  32.10900  9.67800   1.000 18.73000 ?  192 LYS A HG2  1 
ATOM   2793 H  HG3  . LYS A 1 188 ? 9.22000  30.60600  9.27000   1.000 18.73000 ?  192 LYS A HG3  1 
ATOM   2794 H  HD2  . LYS A 1 188 ? 7.62300  29.85100  10.80200  1.000 19.84000 ?  192 LYS A HD2  1 
ATOM   2795 H  HD3  . LYS A 1 188 ? 7.30200  31.35400  11.20700  1.000 19.84000 ?  192 LYS A HD3  1 
ATOM   2796 H  HE2  . LYS A 1 188 ? 6.41500  31.76100  9.12700   1.000 20.12000 ?  192 LYS A HE2  1 
ATOM   2797 H  HE3  . LYS A 1 188 ? 6.82700  30.30500  8.64000   1.000 20.12000 ?  192 LYS A HE3  1 
ATOM   2798 H  HZ1  . LYS A 1 188 ? 4.64500  30.32700  9.20400   1.000 20.70000 ?  192 LYS A HZ1  1 
ATOM   2799 H  HZ2  . LYS A 1 188 ? 5.33200  29.47400  10.15200  1.000 20.70000 ?  192 LYS A HZ2  1 
ATOM   2800 H  HZ3  . LYS A 1 188 ? 4.93200  30.81200  10.53900  1.000 20.70000 ?  192 LYS A HZ3  1 
ATOM   2801 N  N    . LEU A 1 189 ? 12.69900 30.35600  12.54100  1.000 14.23065 ?  193 LEU A N    1 
ATOM   2802 C  CA   . LEU A 1 189 ? 13.43900 30.42800  13.79000  1.000 14.89915 ?  193 LEU A CA   1 
ATOM   2803 C  C    . LEU A 1 189 ? 14.93900 30.58200  13.59000  1.000 15.62556 ?  193 LEU A C    1 
ATOM   2804 O  O    . LEU A 1 189 ? 15.58600 31.22700  14.41800  1.000 17.42314 ?  193 LEU A O    1 
ATOM   2805 C  CB   . LEU A 1 189 ? 13.13100 29.17500  14.62000  1.000 14.91758 ?  193 LEU A CB   1 
ATOM   2806 C  CG   . LEU A 1 189 ? 11.70000 29.08100  15.16800  1.000 14.46752 ?  193 LEU A CG   1 
ATOM   2807 C  CD1  . LEU A 1 189 ? 11.40000 27.67600  15.62000  1.000 14.15696 ?  193 LEU A CD1  1 
ATOM   2808 C  CD2  . LEU A 1 189 ? 11.47400 30.07100  16.29500  1.000 14.51490 ?  193 LEU A CD2  1 
ATOM   2809 H  H    . LEU A 1 189 ? 12.52400 29.54900  12.30000  1.000 17.07000 ?  193 LEU A H    1 
ATOM   2810 H  HA   . LEU A 1 189 ? 13.15000 31.21100  14.28400  1.000 17.88000 ?  193 LEU A HA   1 
ATOM   2811 H  HB2  . LEU A 1 189 ? 13.27900 28.39600  14.06100  1.000 17.89000 ?  193 LEU A HB2  1 
ATOM   2812 H  HB3  . LEU A 1 189 ? 13.73400 29.15800  15.37900  1.000 17.89000 ?  193 LEU A HB3  1 
ATOM   2813 H  HG   . LEU A 1 189 ? 11.08000 29.30900  14.45700  1.000 17.36000 ?  193 LEU A HG   1 
ATOM   2814 H  HD11 . LEU A 1 189 ? 10.51100 27.65100  16.00700  1.000 16.99000 ?  193 LEU A HD11 1 
ATOM   2815 H  HD12 . LEU A 1 189 ? 11.44500 27.08200  14.85500  1.000 16.99000 ?  193 LEU A HD12 1 
ATOM   2816 H  HD13 . LEU A 1 189 ? 12.05700 27.41100  16.28300  1.000 16.99000 ?  193 LEU A HD13 1 
ATOM   2817 H  HD21 . LEU A 1 189 ? 10.55000 30.01600  16.58300  1.000 17.41000 ?  193 LEU A HD21 1 
ATOM   2818 H  HD22 . LEU A 1 189 ? 12.06400 29.85000  17.03200  1.000 17.41000 ?  193 LEU A HD22 1 
ATOM   2819 H  HD23 . LEU A 1 189 ? 11.66800 30.96500  15.97300  1.000 17.41000 ?  193 LEU A HD23 1 
ATOM   2820 N  N    . THR A 1 190 ? 15.50600 30.01400  12.53000  1.000 15.30973 ?  194 THR A N    1 
ATOM   2821 C  CA   . THR A 1 190 ? 16.94800 30.05300  12.33500  1.000 15.13339 ?  194 THR A CA   1 
ATOM   2822 C  C    . THR A 1 190 ? 17.40000 31.12800  11.36400  1.000 16.41249 ?  194 THR A C    1 
ATOM   2823 O  O    . THR A 1 190 ? 18.55000 31.55600  11.44900  1.000 18.17586 ?  194 THR A O    1 
ATOM   2824 C  CB   . THR A 1 190 ? 17.47500 28.71600  11.79800  1.000 15.25709 ?  194 THR A CB   1 
ATOM   2825 O  OG1  . THR A 1 190 ? 16.85500 28.39100  10.54200  1.000 15.26236 ?  194 THR A OG1  1 
ATOM   2826 C  CG2  . THR A 1 190 ? 17.28100 27.60700  12.79100  1.000 15.37290 ?  194 THR A CG2  1 
ATOM   2827 H  H    . THR A 1 190 ? 15.07600 29.59900  11.91100  1.000 18.37000 ?  194 THR A H    1 
ATOM   2828 H  HA   . THR A 1 190 ? 17.34700 30.21800  13.20400  1.000 18.16000 ?  194 THR A HA   1 
ATOM   2829 H  HB   . THR A 1 190 ? 18.43000 28.79900  11.65000  1.000 18.31000 ?  194 THR A HB   1 
ATOM   2830 H  HG1  . THR A 1 190 ? 16.02800 28.28900  10.64700  1.000 18.31000 ?  194 THR A HG1  1 
ATOM   2831 H  HG21 . THR A 1 190 ? 17.63600 26.77700  12.43500  1.000 18.44000 ?  194 THR A HG21 1 
ATOM   2832 H  HG22 . THR A 1 190 ? 17.74100 27.81700  13.61800  1.000 18.44000 ?  194 THR A HG22 1 
ATOM   2833 H  HG23 . THR A 1 190 ? 16.33600 27.49000  12.97700  1.000 18.44000 ?  194 THR A HG23 1 
ATOM   2834 N  N    . LEU A 1 191 ? 16.53400 31.55100  10.43800  1.000 16.27300 ?  195 LEU A N    1 
ATOM   2835 C  CA   . LEU A 1 191 ? 16.91400 32.48700  9.38700   1.000 16.57830 ?  195 LEU A CA   1 
ATOM   2836 C  C    . LEU A 1 191 ? 15.98900 33.69900  9.34100   1.000 17.09679 ?  195 LEU A C    1 
ATOM   2837 O  O    . LEU A 1 191 ? 16.39500 34.77600  8.89700   1.000 19.26810 ?  195 LEU A O    1 
ATOM   2838 C  CB   . LEU A 1 191 ? 16.90500 31.79800  8.01800   1.000 16.66516 ?  195 LEU A CB   1 
ATOM   2839 C  CG   . LEU A 1 191 ? 17.83800 30.60900  7.85500   1.000 17.48631 ?  195 LEU A CG   1 
ATOM   2840 C  CD1  . LEU A 1 191 ? 17.58400 29.89600  6.52300   1.000 17.86004 ?  195 LEU A CD1  1 
ATOM   2841 C  CD2  . LEU A 1 191 ? 19.30800 31.00300  7.95600   1.000 18.54696 ?  195 LEU A CD2  1 
ATOM   2842 H  H    . LEU A 1 191 ? 15.71000 31.30400  10.40000  1.000 19.52000 ?  195 LEU A H    1 
ATOM   2843 H  HA   . LEU A 1 191 ? 17.81200 32.79700  9.58200   1.000 19.89000 ?  195 LEU A HA   1 
ATOM   2844 H  HB2  . LEU A 1 191 ? 16.00400 31.48000  7.84600   1.000 20.00000 ?  195 LEU A HB2  1 
ATOM   2845 H  HB3  . LEU A 1 191 ? 17.15800 32.45400  7.34900   1.000 20.00000 ?  195 LEU A HB3  1 
ATOM   2846 H  HG   . LEU A 1 191 ? 17.65100 29.99800  8.58500   1.000 20.98000 ?  195 LEU A HG   1 
ATOM   2847 H  HD11 . LEU A 1 191 ? 18.20600 29.15600  6.43700   1.000 21.43000 ?  195 LEU A HD11 1 
ATOM   2848 H  HD12 . LEU A 1 191 ? 16.67200 29.56500  6.51000   1.000 21.43000 ?  195 LEU A HD12 1 
ATOM   2849 H  HD13 . LEU A 1 191 ? 17.71700 30.52500  5.79700   1.000 21.43000 ?  195 LEU A HD13 1 
ATOM   2850 H  HD21 . LEU A 1 191 ? 19.85700 30.22400  7.77100   1.000 22.25000 ?  195 LEU A HD21 1 
ATOM   2851 H  HD22 . LEU A 1 191 ? 19.49400 31.70000  7.30800   1.000 22.25000 ?  195 LEU A HD22 1 
ATOM   2852 H  HD23 . LEU A 1 191 ? 19.48800 31.32800  8.85200   1.000 22.25000 ?  195 LEU A HD23 1 
ATOM   2853 N  N    . GLY A 1 192 ? 14.73800 33.51800  9.74300   1.000 17.46525 ?  196 GLY A N    1 
ATOM   2854 C  CA   . GLY A 1 192 ? 13.75000 34.57800  9.73400   1.000 18.03111 ?  196 GLY A CA   1 
ATOM   2855 C  C    . GLY A 1 192 ? 13.77400 35.39800  11.00400  1.000 19.33390 ?  196 GLY A C    1 
ATOM   2856 O  O    . GLY A 1 192 ? 14.78200 35.46400  11.71200  1.000 21.03147 ?  196 GLY A O    1 
ATOM   2857 H  H    . GLY A 1 192 ? 14.43200 32.76800  10.03300  1.000 20.95000 ?  196 GLY A H    1 
ATOM   2858 H  HA2  . GLY A 1 192 ? 13.92200 35.17000  8.98400   1.000 21.64000 ?  196 GLY A HA2  1 
ATOM   2859 H  HA3  . GLY A 1 192 ? 12.86600 34.19300  9.63500   1.000 21.64000 ?  196 GLY A HA3  1 
ATOM   2860 N  N    . SER A 1 193 ? 12.63200 36.00200  11.32200  1.000 19.85238 ?  197 SER A N    1 
ATOM   2861 C  CA   . SER A 1 193 ? 12.53800 36.95500  12.42000  1.000 21.31835 ?  197 SER A CA   1 
ATOM   2862 C  C    . SER A 1 193 ? 11.75300 36.44300  13.62100  1.000 20.59984 ?  197 SER A C    1 
ATOM   2863 O  O    . SER A 1 193 ? 11.40000 37.24300  14.49400  1.000 21.76840 ?  197 SER A O    1 
ATOM   2864 C  CB   . SER A 1 193 ? 11.92300 38.26000  11.92000  1.000 24.51873 ?  197 SER A CB   1 
ATOM   2865 O  OG   . SER A 1 193 ? 10.60800 38.02700  11.43800  1.000 26.93744 ?  197 SER A OG   1 
ATOM   2866 H  H    . SER A 1 193 ? 11.88800 35.87300  10.91000  1.000 23.82000 ?  197 SER A H    1 
ATOM   2867 H  HA   . SER A 1 193 ? 13.43900 37.13000  12.73200  1.000 25.58000 ?  197 SER A HA   1 
ATOM   2868 H  HB2  . SER A 1 193 ? 11.88600 38.89500  12.65200  1.000 29.42000 ?  197 SER A HB2  1 
ATOM   2869 H  HB3  . SER A 1 193 ? 12.46800 38.61400  11.20100  1.000 29.42000 ?  197 SER A HB3  1 
ATOM   2870 H  HG   . SER A 1 193 ? 10.15300 37.63300  12.02400  1.000 32.32000 ?  197 SER A HG   1 
ATOM   2871 N  N    . ALA A 1 194 ? 11.47900 35.14100  13.71000  1.000 19.23389 ?  198 ALA A N    1 
ATOM   2872 C  CA   . ALA A 1 194 ? 10.68300 34.65200  14.83400  1.000 19.19704 ?  198 ALA A CA   1 
ATOM   2873 C  C    . ALA A 1 194 ? 11.41200 34.81200  16.16200  1.000 19.78132 ?  198 ALA A C    1 
ATOM   2874 O  O    . ALA A 1 194 ? 10.76000 34.97700  17.20000  1.000 21.00515 ?  198 ALA A O    1 
ATOM   2875 C  CB   . ALA A 1 194 ? 10.26000 33.19900  14.61700  1.000 19.43654 ?  198 ALA A CB   1 
ATOM   2876 H  H    . ALA A 1 194 ? 11.73400 34.54000  13.15000  1.000 23.08000 ?  198 ALA A H    1 
ATOM   2877 H  HA   . ALA A 1 194 ? 9.87000  35.18000  14.87700  1.000 23.03000 ?  198 ALA A HA   1 
ATOM   2878 H  HB1  . ALA A 1 194 ? 9.74200  32.90400  15.38100  1.000 23.32000 ?  198 ALA A HB1  1 
ATOM   2879 H  HB2  . ALA A 1 194 ? 9.72300  33.14400  13.81100  1.000 23.32000 ?  198 ALA A HB2  1 
ATOM   2880 H  HB3  . ALA A 1 194 ? 11.05400 32.65000  14.52300  1.000 23.32000 ?  198 ALA A HB3  1 
ATOM   2881 N  N    . LEU A 1 195 ? 12.73900 34.75300  16.15400  1.000 19.39180 ?  199 LEU A N    1 
ATOM   2882 C  CA   . LEU A 1 195 ? 13.56300 35.04800  17.31600  1.000 19.80764 ?  199 LEU A CA   1 
ATOM   2883 C  C    . LEU A 1 195 ? 14.34900 36.32500  17.06800  1.000 21.28676 ?  199 LEU A C    1 
ATOM   2884 O  O    . LEU A 1 195 ? 14.69600 36.64200  15.93200  1.000 22.43953 ?  199 LEU A O    1 
ATOM   2885 C  CB   . LEU A 1 195 ? 14.55700 33.92200  17.59900  1.000 19.48392 ?  199 LEU A CB   1 
ATOM   2886 C  CG   . LEU A 1 195 ? 13.95100 32.57400  18.00000  1.000 19.04439 ?  199 LEU A CG   1 
ATOM   2887 C  CD1  . LEU A 1 195 ? 15.03500 31.51700  18.06600  1.000 19.16019 ?  199 LEU A CD1  1 
ATOM   2888 C  CD2  . LEU A 1 195 ? 13.22000 32.66300  19.30900  1.000 19.92081 ?  199 LEU A CD2  1 
ATOM   2889 H  H    . LEU A 1 195 ? 13.20000 34.53600  15.46100  1.000 23.27000 ?  199 LEU A H    1 
ATOM   2890 H  HA   . LEU A 1 195 ? 12.98800 35.15800  18.09000  1.000 23.77000 ?  199 LEU A HA   1 
ATOM   2891 H  HB2  . LEU A 1 195 ? 15.08200 33.77300  16.79700  1.000 23.38000 ?  199 LEU A HB2  1 
ATOM   2892 H  HB3  . LEU A 1 195 ? 15.13500 34.20400  18.32500  1.000 23.38000 ?  199 LEU A HB3  1 
ATOM   2893 H  HG   . LEU A 1 195 ? 13.30200 32.31400  17.32800  1.000 22.85000 ?  199 LEU A HG   1 
ATOM   2894 H  HD11 . LEU A 1 195 ? 14.64200 30.67900  18.35800  1.000 22.99000 ?  199 LEU A HD11 1 
ATOM   2895 H  HD12 . LEU A 1 195 ? 15.42500 31.41000  17.18500  1.000 22.99000 ?  199 LEU A HD12 1 
ATOM   2896 H  HD13 . LEU A 1 195 ? 15.71500 31.80100  18.69700  1.000 22.99000 ?  199 LEU A HD13 1 
ATOM   2897 H  HD21 . LEU A 1 195 ? 12.93300 31.77400  19.57200  1.000 23.90000 ?  199 LEU A HD21 1 
ATOM   2898 H  HD22 . LEU A 1 195 ? 13.81700 33.02900  19.98000  1.000 23.90000 ?  199 LEU A HD22 1 
ATOM   2899 H  HD23 . LEU A 1 195 ? 12.44900 33.24100  19.20100  1.000 23.90000 ?  199 LEU A HD23 1 
ATOM   2900 N  N    . ALA A 1 196 ? 14.63700 37.05600  18.14200  1.000 21.62891 ?  200 ALA A N    1 
ATOM   2901 C  CA   . ALA A 1 196 ? 15.56600 38.17200  18.04300  1.000 23.23700 ?  200 ALA A CA   1 
ATOM   2902 C  C    . ALA A 1 196 ? 16.95500 37.65500  17.67400  1.000 23.26858 ?  200 ALA A C    1 
ATOM   2903 O  O    . ALA A 1 196 ? 17.29900 36.50200  17.92000  1.000 21.81841 ?  200 ALA A O    1 
ATOM   2904 C  CB   . ALA A 1 196 ? 15.62300 38.93500  19.36800  1.000 24.22922 ?  200 ALA A CB   1 
ATOM   2905 H  H    . ALA A 1 196 ? 14.31200 36.92700  18.92800  1.000 25.95000 ?  200 ALA A H    1 
ATOM   2906 H  HA   . ALA A 1 196 ? 15.27200 38.79000  17.35500  1.000 27.88000 ?  200 ALA A HA   1 
ATOM   2907 H  HB1  . ALA A 1 196 ? 16.25100 39.66900  19.28400  1.000 29.07000 ?  200 ALA A HB1  1 
ATOM   2908 H  HB2  . ALA A 1 196 ? 14.73900 39.27700  19.57400  1.000 29.07000 ?  200 ALA A HB2  1 
ATOM   2909 H  HB3  . ALA A 1 196 ? 15.91400 38.32900  20.06800  1.000 29.07000 ?  200 ALA A HB3  1 
ATOM   2910 N  N    . ALA A 1 197 ? 17.77300 38.54200  17.11100  1.000 24.20290 ?  201 ALA A N    1 
ATOM   2911 C  CA   . ALA A 1 197 ? 19.02700 38.10300  16.50200  1.000 24.40293 ?  201 ALA A CA   1 
ATOM   2912 C  C    . ALA A 1 197 ? 19.94100 37.33900  17.45000  1.000 23.73969 ?  201 ALA A C    1 
ATOM   2913 O  O    . ALA A 1 197 ? 20.48600 36.30000  17.03700  1.000 23.05803 ?  201 ALA A O    1 
ATOM   2914 C  CB   . ALA A 1 197 ? 19.74200 39.29200  15.85900  1.000 25.39252 ?  201 ALA A CB   1 
ATOM   2915 H  H    . ALA A 1 197 ? 17.63000 39.38900  17.06800  1.000 29.04000 ?  201 ALA A H    1 
ATOM   2916 H  HA   . ALA A 1 197 ? 18.79600 37.48300  15.79200  1.000 29.28000 ?  201 ALA A HA   1 
ATOM   2917 H  HB1  . ALA A 1 197 ? 20.58800 38.99000  15.49100  1.000 30.47000 ?  201 ALA A HB1  1 
ATOM   2918 H  HB2  . ALA A 1 197 ? 19.18400 39.65300  15.15300  1.000 30.47000 ?  201 ALA A HB2  1 
ATOM   2919 H  HB3  . ALA A 1 197 ? 19.89900 39.96900  16.53600  1.000 30.47000 ?  201 ALA A HB3  1 
ATOM   2920 N  N    . PRO A 1 198 ? 20.16500 37.77100  18.69000  1.000 24.19501 ?  202 PRO A N    1 
ATOM   2921 C  CA   . PRO A 1 198 ? 21.06000 36.98800  19.56000  1.000 23.38701 ?  202 PRO A CA   1 
ATOM   2922 C  C    . PRO A 1 198 ? 20.51900 35.59700  19.83400  1.000 21.27887 ?  202 PRO A C    1 
ATOM   2923 O  O    . PRO A 1 198 ? 21.26700 34.61000  19.80200  1.000 21.41046 ?  202 PRO A O    1 
ATOM   2924 C  CB   . PRO A 1 198 ? 21.14300 37.83500  20.83900  1.000 24.55558 ?  202 PRO A CB   1 
ATOM   2925 C  CG   . PRO A 1 198 ? 20.74400 39.23500  20.40200  1.000 25.90311 ?  202 PRO A CG   1 
ATOM   2926 C  CD   . PRO A 1 198 ? 19.69200 39.00300  19.34800  1.000 25.12143 ?  202 PRO A CD   1 
ATOM   2927 H  HA   . PRO A 1 198 ? 21.94600 36.92800  19.16900  1.000 28.06000 ?  202 PRO A HA   1 
ATOM   2928 H  HB2  . PRO A 1 198 ? 20.52900 37.49000  21.50500  1.000 29.46000 ?  202 PRO A HB2  1 
ATOM   2929 H  HB3  . PRO A 1 198 ? 22.04900 37.82400  21.18500  1.000 29.46000 ?  202 PRO A HB3  1 
ATOM   2930 H  HG2  . PRO A 1 198 ? 20.38300 39.73000  21.15400  1.000 31.08000 ?  202 PRO A HG2  1 
ATOM   2931 H  HG3  . PRO A 1 198 ? 21.51100 39.70200  20.03500  1.000 31.08000 ?  202 PRO A HG3  1 
ATOM   2932 H  HD2  . PRO A 1 198 ? 18.82000 38.87100  19.75000  1.000 30.14000 ?  202 PRO A HD2  1 
ATOM   2933 H  HD3  . PRO A 1 198 ? 19.65900 39.74300  18.72100  1.000 30.14000 ?  202 PRO A HD3  1 
ATOM   2934 N  N    . GLN A 1 199 ? 19.20900 35.49600  20.08100  1.000 20.80513 ?  203 GLN A N    1 
ATOM   2935 C  CA   . GLN A 1 199 ? 18.59700 34.20300  20.37200  1.000 20.19979 ?  203 GLN A CA   1 
ATOM   2936 C  C    . GLN A 1 199 ? 18.58000 33.31800  19.13100  1.000 19.21283 ?  203 GLN A C    1 
ATOM   2937 O  O    . GLN A 1 199 ? 18.76300 32.09700  19.22600  1.000 18.65750 ?  203 GLN A O    1 
ATOM   2938 C  CB   . GLN A 1 199 ? 17.18700 34.42300  20.93000  1.000 21.22886 ?  203 GLN A CB   1 
ATOM   2939 C  CG   . GLN A 1 199 ? 17.12700 34.93800  22.37300  1.000 22.58165 ?  203 GLN A CG   1 
ATOM   2940 C  CD   . GLN A 1 199 ? 17.55000 36.39500  22.52100  1.000 23.56598 ?  203 GLN A CD   1 
ATOM   2941 O  OE1  . GLN A 1 199 ? 17.47900 37.18000  21.58300  1.000 22.92117 ?  203 GLN A OE1  1 
ATOM   2942 N  NE2  . GLN A 1 199 ? 17.97500 36.75800  23.71800  1.000 25.87942 ?  203 GLN A NE2  1 
ATOM   2943 H  H    . GLN A 1 199 ? 18.65900 36.15700  20.08600  1.000 24.96000 ?  203 GLN A H    1 
ATOM   2944 H  HA   . GLN A 1 199 ? 19.11100 33.73900  21.05000  1.000 24.24000 ?  203 GLN A HA   1 
ATOM   2945 H  HB2  . GLN A 1 199 ? 16.73500 35.07500  20.37100  1.000 25.47000 ?  203 GLN A HB2  1 
ATOM   2946 H  HB3  . GLN A 1 199 ? 16.71200 33.57800  20.90400  1.000 25.47000 ?  203 GLN A HB3  1 
ATOM   2947 H  HG2  . GLN A 1 199 ? 16.21600 34.86000  22.69500  1.000 27.09000 ?  203 GLN A HG2  1 
ATOM   2948 H  HG3  . GLN A 1 199 ? 17.72000 34.40100  22.92100  1.000 27.09000 ?  203 GLN A HG3  1 
ATOM   2949 H  HE21 . GLN A 1 199 ? 18.00000 36.18400  24.35800  1.000 31.05000 ?  203 GLN A HE21 1 
ATOM   2950 H  HE22 . GLN A 1 199 ? 18.22500 37.56900  23.85800  1.000 31.05000 ?  203 GLN A HE22 1 
ATOM   2951 N  N    A ARG A 1 200 ? 18.37100 33.91500  17.96000  0.580 18.63908 ?  204 ARG A N    1 
ATOM   2952 N  N    B ARG A 1 200 ? 18.37600 33.91900  17.95500  0.420 18.58118 ?  204 ARG A N    1 
ATOM   2953 C  CA   A ARG A 1 200 ? 18.45000 33.16200  16.71500  0.580 18.33641 ?  204 ARG A CA   1 
ATOM   2954 C  CA   B ARG A 1 200 ? 18.44600 33.15400  16.71400  0.420 18.15744 ?  204 ARG A CA   1 
ATOM   2955 C  C    A ARG A 1 200 ? 19.80900 32.49100  16.56900  0.580 17.52842 ?  204 ARG A C    1 
ATOM   2956 C  C    B ARG A 1 200 ? 19.80900 32.48800  16.56600  0.420 17.56790 ?  204 ARG A C    1 
ATOM   2957 O  O    A ARG A 1 200 ? 19.89300 31.29900  16.25400  0.580 17.53105 ?  204 ARG A O    1 
ATOM   2958 O  O    B ARG A 1 200 ? 19.89900 31.29900  16.24400  0.420 17.54421 ?  204 ARG A O    1 
ATOM   2959 C  CB   A ARG A 1 200 ? 18.18900 34.12800  15.55500  0.580 19.08650 ?  204 ARG A CB   1 
ATOM   2960 C  CB   B ARG A 1 200 ? 18.16100 34.07900  15.53000  0.420 18.48116 ?  204 ARG A CB   1 
ATOM   2961 C  CG   A ARG A 1 200 ? 18.21800 33.53200  14.16100  0.580 19.94976 ?  204 ARG A CG   1 
ATOM   2962 C  CG   B ARG A 1 200 ? 18.26300 33.40900  14.16100  0.420 18.93911 ?  204 ARG A CG   1 
ATOM   2963 C  CD   A ARG A 1 200 ? 18.10400 34.66600  13.14300  0.580 21.23412 ?  204 ARG A CD   1 
ATOM   2964 C  CD   B ARG A 1 200 ? 17.93300 34.38500  13.03000  0.420 19.79185 ?  204 ARG A CD   1 
ATOM   2965 N  NE   A ARG A 1 200 ? 17.07000 35.61800  13.54400  0.580 22.87643 ?  204 ARG A NE   1 
ATOM   2966 N  NE   B ARG A 1 200 ? 18.80100 35.55800  13.06200  0.420 21.30782 ?  204 ARG A NE   1 
ATOM   2967 C  CZ   A ARG A 1 200 ? 17.13500 36.93200  13.38000  0.580 24.80824 ?  204 ARG A CZ   1 
ATOM   2968 C  CZ   B ARG A 1 200 ? 18.62600 36.66000  12.33900  0.420 22.85274 ?  204 ARG A CZ   1 
ATOM   2969 N  NH1  A ARG A 1 200 ? 18.18700 37.50800  12.82300  0.580 26.41896 ?  204 ARG A NH1  1 
ATOM   2970 N  NH1  B ARG A 1 200 ? 17.59200 36.79700  11.52300  0.420 23.91603 ?  204 ARG A NH1  1 
ATOM   2971 N  NH2  A ARG A 1 200 ? 16.12400 37.68500  13.79800  0.580 24.28186 ?  204 ARG A NH2  1 
ATOM   2972 N  NH2  B ARG A 1 200 ? 19.50000 37.65900  12.45300  0.420 23.95287 ?  204 ARG A NH2  1 
ATOM   2973 H  H    A ARG A 1 200 ? 18.18300 34.74900  17.86100  0.580 22.36000 ?  204 ARG A H    1 
ATOM   2974 H  H    B ARG A 1 200 ? 18.19900 34.75400  17.85300  0.420 22.29000 ?  204 ARG A H    1 
ATOM   2975 H  HA   A ARG A 1 200 ? 17.77900 32.46100  16.70300  0.580 22.00000 ?  204 ARG A HA   1 
ATOM   2976 H  HA   B ARG A 1 200 ? 17.77100 32.45700  16.72500  0.420 21.79000 ?  204 ARG A HA   1 
ATOM   2977 H  HB2  A ARG A 1 200 ? 17.31000 34.51900  15.68000  0.580 22.90000 ?  204 ARG A HB2  1 
ATOM   2978 H  HB2  B ARG A 1 200 ? 17.25900 34.42600  15.62000  0.420 22.18000 ?  204 ARG A HB2  1 
ATOM   2979 H  HB3  A ARG A 1 200 ? 18.86700 34.82200  15.58200  0.580 22.90000 ?  204 ARG A HB3  1 
ATOM   2980 H  HB3  B ARG A 1 200 ? 18.80000 34.80800  15.54700  0.420 22.18000 ?  204 ARG A HB3  1 
ATOM   2981 H  HG2  A ARG A 1 200 ? 19.05300 33.06100  14.01800  0.580 23.94000 ?  204 ARG A HG2  1 
ATOM   2982 H  HG2  B ARG A 1 200 ? 19.16700 33.08400  14.02900  0.420 22.73000 ?  204 ARG A HG2  1 
ATOM   2983 H  HG3  A ARG A 1 200 ? 17.47000 32.92500  14.04400  0.580 23.94000 ?  204 ARG A HG3  1 
ATOM   2984 H  HG3  B ARG A 1 200 ? 17.63500 32.67000  14.11700  0.420 22.73000 ?  204 ARG A HG3  1 
ATOM   2985 H  HD2  A ARG A 1 200 ? 18.95000 35.13700  13.08600  0.580 25.48000 ?  204 ARG A HD2  1 
ATOM   2986 H  HD2  B ARG A 1 200 ? 18.05500 33.94000  12.17700  0.420 23.75000 ?  204 ARG A HD2  1 
ATOM   2987 H  HD3  A ARG A 1 200 ? 17.86800 34.30100  12.27600  0.580 25.48000 ?  204 ARG A HD3  1 
ATOM   2988 H  HD3  B ARG A 1 200 ? 17.01500 34.68300  13.12100  0.420 23.75000 ?  204 ARG A HD3  1 
ATOM   2989 H  HE   A ARG A 1 200 ? 16.36200 35.30100  13.91600  0.580 27.45000 ?  204 ARG A HE   1 
ATOM   2990 H  HE   B ARG A 1 200 ? 19.48000 35.53500  13.59100  0.420 25.57000 ?  204 ARG A HE   1 
ATOM   2991 H  HH11 A ARG A 1 200 ? 18.85000 37.02900  12.55700  0.580 31.70000 ?  204 ARG A HH11 1 
ATOM   2992 H  HH11 B ARG A 1 200 ? 17.01400 36.16400  11.45100  0.420 28.70000 ?  204 ARG A HH11 1 
ATOM   2993 H  HH12 A ARG A 1 200 ? 18.20900 38.36300  12.72600  0.580 31.70000 ?  204 ARG A HH12 1 
ATOM   2994 H  HH12 B ARG A 1 200 ? 17.49800 37.51900  11.06500  0.420 28.70000 ?  204 ARG A HH12 1 
ATOM   2995 H  HH21 A ARG A 1 200 ? 15.44000 37.32000  14.16900  0.580 29.14000 ?  204 ARG A HH21 1 
ATOM   2996 H  HH21 B ARG A 1 200 ? 20.16800 37.58600  12.99000  0.420 28.74000 ?  204 ARG A HH21 1 
ATOM   2997 H  HH22 A ARG A 1 200 ? 16.15400 38.53900  13.69800  0.580 29.14000 ?  204 ARG A HH22 1 
ATOM   2998 H  HH22 B ARG A 1 200 ? 19.39600 38.37600  11.99100  0.420 28.74000 ?  204 ARG A HH22 1 
ATOM   2999 N  N    . GLN A 1 201 ? 20.88900 33.24400  16.79100  1.000 17.76266 ?  205 GLN A N    1 
ATOM   3000 C  CA   . GLN A 1 201 ? 22.22200 32.66800  16.64500  1.000 18.41010 ?  205 GLN A CA   1 
ATOM   3001 C  C    . GLN A 1 201 ? 22.47400 31.60700  17.71000  1.000 17.79161 ?  205 GLN A C    1 
ATOM   3002 O  O    . GLN A 1 201 ? 23.13700 30.60600  17.44600  1.000 17.53105 ?  205 GLN A O    1 
ATOM   3003 C  CB   . GLN A 1 201 ? 23.29800 33.74500  16.67100  1.000 19.96818 ?  205 GLN A CB   1 
ATOM   3004 C  CG   . GLN A 1 201 ? 24.66800 33.19200  16.31400  1.000 20.08925 ?  205 GLN A CG   1 
ATOM   3005 C  CD   . GLN A 1 201 ? 24.75200 32.65100  14.88900  1.000 20.58668 ?  205 GLN A CD   1 
ATOM   3006 O  OE1  . GLN A 1 201 ? 24.39000 33.33300  13.93000  1.000 23.20541 ?  205 GLN A OE1  1 
ATOM   3007 N  NE2  . GLN A 1 201 ? 25.22900 31.42200  14.74400  1.000 20.78670 ?  205 GLN A NE2  1 
ATOM   3008 H  H    A GLN A 1 201 ? 20.87600 34.07300  17.02200  0.580 21.31000 ?  205 GLN A H    1 
ATOM   3009 H  H    B GLN A 1 201 ? 20.87400 34.07200  17.02400  0.420 21.31000 ?  205 GLN A H    1 
ATOM   3010 H  HA   . GLN A 1 201 ? 22.27800 32.24400  15.77400  1.000 22.09000 ?  205 GLN A HA   1 
ATOM   3011 H  HB2  . GLN A 1 201 ? 23.07200 34.43600  16.02800  1.000 23.96000 ?  205 GLN A HB2  1 
ATOM   3012 H  HB3  . GLN A 1 201 ? 23.34700 34.12500  17.56200  1.000 23.96000 ?  205 GLN A HB3  1 
ATOM   3013 H  HG2  . GLN A 1 201 ? 25.32500 33.90100  16.40100  1.000 24.10000 ?  205 GLN A HG2  1 
ATOM   3014 H  HG3  . GLN A 1 201 ? 24.88100 32.46600  16.92000  1.000 24.10000 ?  205 GLN A HG3  1 
ATOM   3015 H  HE21 . GLN A 1 201 ? 25.47300 30.97100  15.43500  1.000 24.94000 ?  205 GLN A HE21 1 
ATOM   3016 H  HE22 . GLN A 1 201 ? 25.29500 31.07600  13.96000  1.000 24.94000 ?  205 GLN A HE22 1 
ATOM   3017 N  N    . GLN A 1 202 ? 21.95200 31.79900  18.92200  1.000 17.58106 ?  206 GLN A N    1 
ATOM   3018 C  CA   . GLN A 1 202 ? 22.09400 30.75500  19.93600  1.000 17.47578 ?  206 GLN A CA   1 
ATOM   3019 C  C    . GLN A 1 202 ? 21.37900 29.47600  19.51400  1.000 16.66779 ?  206 GLN A C    1 
ATOM   3020 O  O    . GLN A 1 202 ? 21.89700 28.37300  19.71100  1.000 16.24668 ?  206 GLN A O    1 
ATOM   3021 C  CB   . GLN A 1 202 ? 21.58300 31.24200  21.29400  1.000 18.36273 ?  206 GLN A CB   1 
ATOM   3022 C  CG   . GLN A 1 202 ? 21.67300 30.18000  22.38700  1.000 19.28915 ?  206 GLN A CG   1 
ATOM   3023 C  CD   . GLN A 1 202 ? 23.10200 29.82000  22.73700  1.000 20.52088 ?  206 GLN A CD   1 
ATOM   3024 O  OE1  . GLN A 1 202 ? 23.70600 30.43300  23.61100  1.000 23.53703 ?  206 GLN A OE1  1 
ATOM   3025 N  NE2  . GLN A 1 202 ? 23.66000 28.83100  22.05100  1.000 20.14452 ?  206 GLN A NE2  1 
ATOM   3026 H  H    . GLN A 1 202 ? 21.52500 32.50100  19.17500  1.000 21.09000 ?  206 GLN A H    1 
ATOM   3027 H  HA   . GLN A 1 202 ? 23.03700 30.55400  20.03900  1.000 20.97000 ?  206 GLN A HA   1 
ATOM   3028 H  HB2  . GLN A 1 202 ? 22.11400 32.00400  21.57400  1.000 22.03000 ?  206 GLN A HB2  1 
ATOM   3029 H  HB3  . GLN A 1 202 ? 20.65200 31.50100  21.20400  1.000 22.03000 ?  206 GLN A HB3  1 
ATOM   3030 H  HG2  . GLN A 1 202 ? 21.24300 30.51400  23.18900  1.000 23.14000 ?  206 GLN A HG2  1 
ATOM   3031 H  HG3  . GLN A 1 202 ? 21.22700 29.37400  22.08300  1.000 23.14000 ?  206 GLN A HG3  1 
ATOM   3032 H  HE21 . GLN A 1 202 ? 23.21200 28.42600  21.44000  1.000 24.17000 ?  206 GLN A HE21 1 
ATOM   3033 H  HE22 . GLN A 1 202 ? 24.47000 28.59600  22.21800  1.000 24.17000 ?  206 GLN A HE22 1 
ATOM   3034 N  N    . PHE A 1 203 ? 20.17900 29.60200  18.95000  1.000 16.39933 ?  207 PHE A N    1 
ATOM   3035 C  CA   . PHE A 1 203 ? 19.46600 28.42100  18.47000  1.000 15.67820 ?  207 PHE A CA   1 
ATOM   3036 C  C    . PHE A 1 203 ? 20.27300 27.72300  17.38400  1.000 15.59661 ?  207 PHE A C    1 
ATOM   3037 O  O    . PHE A 1 203 ? 20.46300 26.50400  17.40500  1.000 15.39921 ?  207 PHE A O    1 
ATOM   3038 C  CB   . PHE A 1 203 ? 18.07000 28.81900  17.96900  1.000 15.88348 ?  207 PHE A CB   1 
ATOM   3039 C  CG   . PHE A 1 203 ? 17.20300 27.65400  17.53700  1.000 15.19130 ?  207 PHE A CG   1 
ATOM   3040 C  CD1  . PHE A 1 203 ? 17.17200 26.47700  18.25700  1.000 15.93349 ?  207 PHE A CD1  1 
ATOM   3041 C  CD2  . PHE A 1 203 ? 16.39600 27.77200  16.42200  1.000 15.10181 ?  207 PHE A CD2  1 
ATOM   3042 C  CE1  . PHE A 1 203 ? 16.36700 25.41000  17.86800  1.000 15.83611 ?  207 PHE A CE1  1 
ATOM   3043 C  CE2  . PHE A 1 203 ? 15.57700 26.71600  16.03900  1.000 14.99127 ?  207 PHE A CE2  1 
ATOM   3044 C  CZ   . PHE A 1 203 ? 15.55000 25.54300  16.76600  1.000 15.14655 ?  207 PHE A CZ   1 
ATOM   3045 H  H    . PHE A 1 203 ? 19.76200 30.34600  18.83600  1.000 19.68000 ?  207 PHE A H    1 
ATOM   3046 H  HA   . PHE A 1 203 ? 19.34100 27.79500  19.20100  1.000 18.81000 ?  207 PHE A HA   1 
ATOM   3047 H  HB2  . PHE A 1 203 ? 17.60500 29.28100  18.68400  1.000 19.06000 ?  207 PHE A HB2  1 
ATOM   3048 H  HB3  . PHE A 1 203 ? 18.17200 29.40700  17.20500  1.000 19.06000 ?  207 PHE A HB3  1 
ATOM   3049 H  HD1  . PHE A 1 203 ? 17.70000 26.39600  19.01800  1.000 19.11000 ?  207 PHE A HD1  1 
ATOM   3050 H  HD2  . PHE A 1 203 ? 16.40100 28.55900  15.92600  1.000 18.12000 ?  207 PHE A HD2  1 
ATOM   3051 H  HE1  . PHE A 1 203 ? 16.38100 24.61400  18.34800  1.000 19.00000 ?  207 PHE A HE1  1 
ATOM   3052 H  HE2  . PHE A 1 203 ? 15.04100 26.80200  15.28500  1.000 17.99000 ?  207 PHE A HE2  1 
ATOM   3053 H  HZ   . PHE A 1 203 ? 14.98500 24.84800  16.51400  1.000 18.17000 ?  207 PHE A HZ   1 
ATOM   3054 N  N    . VAL A 1 204 ? 20.76500 28.49500  16.41400  1.000 16.18878 ?  208 VAL A N    1 
ATOM   3055 C  CA   . VAL A 1 204 ? 21.63300 27.94900  15.37000  1.000 16.25195 ?  208 VAL A CA   1 
ATOM   3056 C  C    . VAL A 1 204 ? 22.83200 27.23800  15.99000  1.000 16.16773 ?  208 VAL A C    1 
ATOM   3057 O  O    . VAL A 1 204 ? 23.21200 26.14100  15.56800  1.000 16.40197 ?  208 VAL A O    1 
ATOM   3058 C  CB   . VAL A 1 204 ? 22.06500 29.07500  14.41600  1.000 16.45987 ?  208 VAL A CB   1 
ATOM   3059 C  CG1  . VAL A 1 204 ? 23.25100 28.63000  13.58200  1.000 16.92308 ?  208 VAL A CG1  1 
ATOM   3060 C  CG2  . VAL A 1 204 ? 20.90500 29.49000  13.52900  1.000 17.22049 ?  208 VAL A CG2  1 
ATOM   3061 H  H    . VAL A 1 204 ? 20.61300 29.33800  16.33600  1.000 19.42000 ?  208 VAL A H    1 
ATOM   3062 H  HA   . VAL A 1 204 ? 21.13800 27.28900  14.86000  1.000 19.50000 ?  208 VAL A HA   1 
ATOM   3063 H  HB   . VAL A 1 204 ? 22.33600 29.84800  14.93600  1.000 19.75000 ?  208 VAL A HB   1 
ATOM   3064 H  HG11 . VAL A 1 204 ? 23.34300 29.22400  12.82100  1.000 20.31000 ?  208 VAL A HG11 1 
ATOM   3065 H  HG12 . VAL A 1 204 ? 24.05200 28.66500  14.12800  1.000 20.31000 ?  208 VAL A HG12 1 
ATOM   3066 H  HG13 . VAL A 1 204 ? 23.09900 27.72200  13.27700  1.000 20.31000 ?  208 VAL A HG13 1 
ATOM   3067 H  HG21 . VAL A 1 204 ? 21.19500 30.21000  12.94700  1.000 20.66000 ?  208 VAL A HG21 1 
ATOM   3068 H  HG22 . VAL A 1 204 ? 20.62500 28.72800  12.99900  1.000 20.66000 ?  208 VAL A HG22 1 
ATOM   3069 H  HG23 . VAL A 1 204 ? 20.17200 29.79200  14.08800  1.000 20.66000 ?  208 VAL A HG23 1 
ATOM   3070 N  N    . ASP A 1 205 ? 23.49500 27.87800  16.95900  1.000 16.29143 ?  209 ASP A N    1 
ATOM   3071 C  CA   . ASP A 1 205 ? 24.69700 27.27300  17.52900  1.000 16.72832 ?  209 ASP A CA   1 
ATOM   3072 C  C    . ASP A 1 205 ? 24.38200 25.97000  18.25000  1.000 16.69937 ?  209 ASP A C    1 
ATOM   3073 O  O    . ASP A 1 205 ? 25.16300 25.01600  18.18600  1.000 16.52567 ?  209 ASP A O    1 
ATOM   3074 C  CB   . ASP A 1 205 ? 25.38100 28.24900  18.47600  1.000 18.83910 ?  209 ASP A CB   1 
ATOM   3075 C  CG   . ASP A 1 205 ? 26.05100 29.40300  17.74200  1.000 21.13674 ?  209 ASP A CG   1 
ATOM   3076 O  OD1  . ASP A 1 205 ? 26.16400 29.33800  16.50500  1.000 22.48164 ?  209 ASP A OD1  1 
ATOM   3077 O  OD2  . ASP A 1 205 ? 26.44600 30.36700  18.42500  1.000 22.87906 -1 209 ASP A OD2  1 
ATOM   3078 H  H    . ASP A 1 205 ? 23.27600 28.64000  17.29300  1.000 19.54000 ?  209 ASP A H    1 
ATOM   3079 H  HA   . ASP A 1 205 ? 25.31000 27.07300  16.80400  1.000 20.07000 ?  209 ASP A HA   1 
ATOM   3080 H  HB2  . ASP A 1 205 ? 24.72000 28.62000  19.08000  1.000 22.61000 ?  209 ASP A HB2  1 
ATOM   3081 H  HB3  . ASP A 1 205 ? 26.06300 27.77700  18.97900  1.000 22.61000 ?  209 ASP A HB3  1 
ATOM   3082 N  N    . TRP A 1 206 ? 23.24500 25.90400  18.95000  1.000 16.19142 ?  210 TRP A N    1 
ATOM   3083 C  CA   . TRP A 1 206 ? 22.86200 24.64100  19.57300  1.000 15.78084 ?  210 TRP A CA   1 
ATOM   3084 C  C    . TRP A 1 206 ? 22.64800 23.55700  18.52000  1.000 15.45712 ?  210 TRP A C    1 
ATOM   3085 O  O    . TRP A 1 206 ? 23.12700 22.43400  18.66900  1.000 15.70715 ?  210 TRP A O    1 
ATOM   3086 C  CB   . TRP A 1 206 ? 21.62200 24.81300  20.44300  1.000 15.64398 ?  210 TRP A CB   1 
ATOM   3087 C  CG   . TRP A 1 206 ? 21.89900 25.45900  21.77100  1.000 16.42565 ?  210 TRP A CG   1 
ATOM   3088 C  CD1  . TRP A 1 206 ? 23.09300 25.52500  22.43600  1.000 17.50210 ?  210 TRP A CD1  1 
ATOM   3089 C  CD2  . TRP A 1 206 ? 20.94600 26.14100  22.59600  1.000 16.66516 ?  210 TRP A CD2  1 
ATOM   3090 N  NE1  . TRP A 1 206 ? 22.92200 26.17900  23.62900  1.000 18.04427 ?  210 TRP A NE1  1 
ATOM   3091 C  CE2  . TRP A 1 206 ? 21.61700 26.57600  23.75000  1.000 17.71002 ?  210 TRP A CE2  1 
ATOM   3092 C  CE3  . TRP A 1 206 ? 19.57700 26.40900  22.47300  1.000 16.71779 ?  210 TRP A CE3  1 
ATOM   3093 C  CZ2  . TRP A 1 206 ? 20.97200 27.28200  24.77000  1.000 17.97584 ?  210 TRP A CZ2  1 
ATOM   3094 C  CZ3  . TRP A 1 206 ? 18.93000 27.09000  23.49200  1.000 17.54684 ?  210 TRP A CZ3  1 
ATOM   3095 C  CH2  . TRP A 1 206 ? 19.63500 27.53200  24.61900  1.000 18.10480 ?  210 TRP A CH2  1 
ATOM   3096 H  H    . TRP A 1 206 ? 22.69800 26.55500  19.07300  1.000 19.43000 ?  210 TRP A H    1 
ATOM   3097 H  HA   . TRP A 1 206 ? 23.58000 24.35800  20.16000  1.000 18.93000 ?  210 TRP A HA   1 
ATOM   3098 H  HB2  . TRP A 1 206 ? 20.98400 25.37100  19.97000  1.000 18.77000 ?  210 TRP A HB2  1 
ATOM   3099 H  HB3  . TRP A 1 206 ? 21.23700 23.93900  20.61300  1.000 18.77000 ?  210 TRP A HB3  1 
ATOM   3100 H  HD1  . TRP A 1 206 ? 23.89800 25.17900  22.12600  1.000 21.00000 ?  210 TRP A HD1  1 
ATOM   3101 H  HE1  . TRP A 1 206 ? 23.53900 26.31800  24.21200  1.000 21.65000 ?  210 TRP A HE1  1 
ATOM   3102 H  HE3  . TRP A 1 206 ? 19.10900 26.13300  21.71800  1.000 20.06000 ?  210 TRP A HE3  1 
ATOM   3103 H  HZ2  . TRP A 1 206 ? 21.43400 27.57200  25.52400  1.000 21.57000 ?  210 TRP A HZ2  1 
ATOM   3104 H  HZ3  . TRP A 1 206 ? 18.01700 27.25700  23.42600  1.000 21.05000 ?  210 TRP A HZ3  1 
ATOM   3105 H  HH2  . TRP A 1 206 ? 19.18400 28.00500  25.27900  1.000 21.72000 ?  210 TRP A HH2  1 
ATOM   3106 N  N    . LEU A 1 207 ? 21.94300 23.87700  17.43000  1.000 14.98864 ?  211 LEU A N    1 
ATOM   3107 C  CA   . LEU A 1 207 ? 21.74600 22.90100  16.35900  1.000 14.35962 ?  211 LEU A CA   1 
ATOM   3108 C  C    . LEU A 1 207 ? 23.06800 22.47900  15.72800  1.000 14.09116 ?  211 LEU A C    1 
ATOM   3109 O  O    . LEU A 1 207 ? 23.25500 21.30300  15.39200  1.000 14.58596 ?  211 LEU A O    1 
ATOM   3110 C  CB   . LEU A 1 207 ? 20.81300 23.48700  15.29500  1.000 14.59122 ?  211 LEU A CB   1 
ATOM   3111 C  CG   . LEU A 1 207 ? 19.37200 23.74300  15.72900  1.000 13.90167 ?  211 LEU A CG   1 
ATOM   3112 C  CD1  . LEU A 1 207 ? 18.68000 24.63600  14.72200  1.000 15.14918 ?  211 LEU A CD1  1 
ATOM   3113 C  CD2  . LEU A 1 207 ? 18.61000 22.44200  15.92000  1.000 14.06748 ?  211 LEU A CD2  1 
ATOM   3114 H  H    . LEU A 1 207 ? 21.57400 24.64100  17.29000  1.000 17.98000 ?  211 LEU A H    1 
ATOM   3115 H  HA   . LEU A 1 207 ? 21.33200 22.10800  16.73400  1.000 17.23000 ?  211 LEU A HA   1 
ATOM   3116 H  HB2  . LEU A 1 207 ? 21.18100 24.33800  15.00700  1.000 17.51000 ?  211 LEU A HB2  1 
ATOM   3117 H  HB3  . LEU A 1 207 ? 20.78200 22.86900  14.54800  1.000 17.51000 ?  211 LEU A HB3  1 
ATOM   3118 H  HG   . LEU A 1 207 ? 19.37800 24.19500  16.58700  1.000 16.68000 ?  211 LEU A HG   1 
ATOM   3119 H  HD11 . LEU A 1 207 ? 17.75900 24.76600  14.99600  1.000 18.18000 ?  211 LEU A HD11 1 
ATOM   3120 H  HD12 . LEU A 1 207 ? 19.13900 25.49000  14.68900  1.000 18.18000 ?  211 LEU A HD12 1 
ATOM   3121 H  HD13 . LEU A 1 207 ? 18.70900 24.21100  13.85100  1.000 18.18000 ?  211 LEU A HD13 1 
ATOM   3122 H  HD21 . LEU A 1 207 ? 17.69700 22.64500  16.17700  1.000 16.88000 ?  211 LEU A HD21 1 
ATOM   3123 H  HD22 . LEU A 1 207 ? 18.61700 21.94600  15.08600  1.000 16.88000 ?  211 LEU A HD22 1 
ATOM   3124 H  HD23 . LEU A 1 207 ? 19.04200 21.92200  16.61700  1.000 16.88000 ?  211 LEU A HD23 1 
ATOM   3125 N  N    . LYS A 1 208 ? 23.98100 23.43100  15.52000  1.000 14.88336 ?  212 LYS A N    1 
ATOM   3126 C  CA   . LYS A 1 208 ? 25.28300 23.09600  14.93800  1.000 15.19919 ?  212 LYS A CA   1 
ATOM   3127 C  C    . LYS A 1 208 ? 26.05900 22.12300  15.81300  1.000 16.04666 ?  212 LYS A C    1 
ATOM   3128 O  O    . LYS A 1 208 ? 26.80300 21.27400  15.29800  1.000 17.17048 ?  212 LYS A O    1 
ATOM   3129 C  CB   . LYS A 1 208 ? 26.12000 24.35400  14.72700  1.000 16.11509 ?  212 LYS A CB   1 
ATOM   3130 C  CG   . LYS A 1 208 ? 25.68800 25.21400  13.55300  1.000 18.12323 ?  212 LYS A CG   1 
ATOM   3131 C  CD   . LYS A 1 208 ? 26.64700 26.39700  13.43000  1.000 20.04451 ?  212 LYS A CD   1 
ATOM   3132 C  CE   . LYS A 1 208 ? 26.47400 27.17300  12.16000  1.000 21.77366 ?  212 LYS A CE   1 
ATOM   3133 N  NZ   . LYS A 1 208 ? 27.63800 28.11200  12.00800  1.000 22.18424 ?  212 LYS A NZ   1 
ATOM   3134 H  H    . LYS A 1 208 ? 23.87500 24.26400  15.70300  1.000 17.86000 ?  212 LYS A H    1 
ATOM   3135 H  HA   . LYS A 1 208 ? 25.12400 22.68500  14.07400  1.000 18.24000 ?  212 LYS A HA   1 
ATOM   3136 H  HB2  . LYS A 1 208 ? 26.06100 24.90100  15.52700  1.000 19.33000 ?  212 LYS A HB2  1 
ATOM   3137 H  HB3  . LYS A 1 208 ? 27.04000 24.08900  14.57300  1.000 19.33000 ?  212 LYS A HB3  1 
ATOM   3138 H  HG2  . LYS A 1 208 ? 25.71900 24.69500  12.73400  1.000 21.74000 ?  212 LYS A HG2  1 
ATOM   3139 H  HG3  . LYS A 1 208 ? 24.79000 25.54800  13.70000  1.000 21.74000 ?  212 LYS A HG3  1 
ATOM   3140 H  HD2  . LYS A 1 208 ? 26.49400 27.00300  14.17200  1.000 24.05000 ?  212 LYS A HD2  1 
ATOM   3141 H  HD3  . LYS A 1 208 ? 27.55800 26.06600  13.45500  1.000 24.05000 ?  212 LYS A HD3  1 
ATOM   3142 H  HE2  . LYS A 1 208 ? 26.45300 26.56800  11.40200  1.000 26.13000 ?  212 LYS A HE2  1 
ATOM   3143 H  HE3  . LYS A 1 208 ? 25.65300 27.68900  12.19600  1.000 26.13000 ?  212 LYS A HE3  1 
ATOM   3144 H  HZ1  . LYS A 1 208 ? 28.39800 27.65100  11.97600  1.000 26.62000 ?  212 LYS A HZ1  1 
ATOM   3145 H  HZ2  . LYS A 1 208 ? 27.55300 28.58200  11.25700  1.000 26.62000 ?  212 LYS A HZ2  1 
ATOM   3146 H  HZ3  . LYS A 1 208 ? 27.66800 28.67300  12.69800  1.000 26.62000 ?  212 LYS A HZ3  1 
ATOM   3147 N  N    . GLY A 1 209 ? 25.90800 22.23500  17.13300  1.000 15.80979 ?  213 GLY A N    1 
ATOM   3148 C  CA   . GLY A 1 209 ? 26.59900 21.37100  18.06700  1.000 16.31511 ?  213 GLY A CA   1 
ATOM   3149 C  C    . GLY A 1 209 ? 25.89600 20.05900  18.34700  1.000 15.75452 ?  213 GLY A C    1 
ATOM   3150 O  O    . GLY A 1 209 ? 26.31400 19.32800  19.24500  1.000 16.65463 ?  213 GLY A O    1 
ATOM   3151 H  H    . GLY A 1 209 ? 25.40000 22.81700  17.51100  1.000 18.97000 ?  213 GLY A H    1 
ATOM   3152 H  HA2  . GLY A 1 209 ? 27.47800 21.16800  17.71200  1.000 19.57000 ?  213 GLY A HA2  1 
ATOM   3153 H  HA3  . GLY A 1 209 ? 26.70000 21.84000  18.91000  1.000 19.57000 ?  213 GLY A HA3  1 
ATOM   3154 N  N    . ASN A 1 210 ? 24.83700 19.72200  17.61800  1.000 15.06496 ?  214 ASN A N    1 
ATOM   3155 C  CA   . ASN A 1 210 ? 24.18600 18.44100  17.83700  1.000 14.70703 ?  214 ASN A CA   1 
ATOM   3156 C  C    . ASN A 1 210 ? 25.17500 17.30000  17.63000  1.000 14.77809 ?  214 ASN A C    1 
ATOM   3157 O  O    . ASN A 1 210 ? 25.94700 17.30400  16.67200  1.000 15.23604 ?  214 ASN A O    1 
ATOM   3158 C  CB   . ASN A 1 210 ? 23.02600 18.23100  16.86200  1.000 14.87810 ?  214 ASN A CB   1 
ATOM   3159 C  CG   . ASN A 1 210 ? 22.30700 16.93100  17.13100  1.000 13.93588 ?  214 ASN A CG   1 
ATOM   3160 O  OD1  . ASN A 1 210 ? 22.21900 16.51100  18.28000  1.000 14.30435 ?  214 ASN A OD1  1 
ATOM   3161 N  ND2  . ASN A 1 210 ? 21.87100 16.25000  16.07900  1.000 14.32540 ?  214 ASN A ND2  1 
ATOM   3162 H  H    . ASN A 1 210 ? 24.48400 20.20900  17.00300  1.000 18.07000 ?  214 ASN A H    1 
ATOM   3163 H  HA   . ASN A 1 210 ? 23.84400 18.43400  18.74400  1.000 17.65000 ?  214 ASN A HA   1 
ATOM   3164 H  HB2  . ASN A 1 210 ? 22.39100 18.95800  16.95900  1.000 17.85000 ?  214 ASN A HB2  1 
ATOM   3165 H  HB3  . ASN A 1 210 ? 23.36900 18.20900  15.95500  1.000 17.85000 ?  214 ASN A HB3  1 
ATOM   3166 H  HD21 . ASN A 1 210 ? 21.45700 15.50500  16.19100  1.000 17.19000 ?  214 ASN A HD21 1 
ATOM   3167 H  HD22 . ASN A 1 210 ? 22.00300 16.55400  15.28600  1.000 17.19000 ?  214 ASN A HD22 1 
ATOM   3168 N  N    . THR A 1 211 ? 25.09700 16.28500  18.49200  1.000 14.98338 ?  215 THR A N    1 
ATOM   3169 C  CA   . THR A 1 211 ? 25.95100 15.11500  18.40900  1.000 15.69925 ?  215 THR A CA   1 
ATOM   3170 C  C    . THR A 1 211 ? 25.27200 13.87400  17.86800  1.000 15.37553 ?  215 THR A C    1 
ATOM   3171 O  O    . THR A 1 211 ? 25.96600 12.87900  17.62800  1.000 16.02034 ?  215 THR A O    1 
ATOM   3172 C  CB   . THR A 1 211 ? 26.56500 14.76000  19.77900  1.000 16.30195 ?  215 THR A CB   1 
ATOM   3173 O  OG1  . THR A 1 211 ? 25.56000 14.18700  20.61800  1.000 16.67568 ?  215 THR A OG1  1 
ATOM   3174 C  CG2  . THR A 1 211 ? 27.19200 15.97500  20.44100  1.000 17.60211 ?  215 THR A CG2  1 
ATOM   3175 H  H    . THR A 1 211 ? 24.54200 16.25700  19.14800  1.000 17.98000 ?  215 THR A H    1 
ATOM   3176 H  HA   . THR A 1 211 ? 26.67300 15.34900  17.80600  1.000 18.83000 ?  215 THR A HA   1 
ATOM   3177 H  HB   . THR A 1 211 ? 27.27700 14.11300  19.65500  1.000 19.56000 ?  215 THR A HB   1 
ATOM   3178 H  HG1  . THR A 1 211 ? 24.96900 14.75900  20.79000  1.000 20.01000 ?  215 THR A HG1  1 
ATOM   3179 H  HG21 . THR A 1 211 ? 27.65600 15.70900  21.25100  1.000 21.12000 ?  215 THR A HG21 1 
ATOM   3180 H  HG22 . THR A 1 211 ? 27.82700 16.39100  19.83700  1.000 21.12000 ?  215 THR A HG22 1 
ATOM   3181 H  HG23 . THR A 1 211 ? 26.50500 16.62000  20.67000  1.000 21.12000 ?  215 THR A HG23 1 
ATOM   3182 N  N    . THR A 1 212 ? 23.94900 13.88900  17.66300  1.000 14.27803 ?  216 THR A N    1 
ATOM   3183 C  CA   . THR A 1 212 ? 23.22300 12.66100  17.38900  1.000 14.18065 ?  216 THR A CA   1 
ATOM   3184 C  C    . THR A 1 212 ? 22.91300 12.45300  15.91200  1.000 14.26750 ?  216 THR A C    1 
ATOM   3185 O  O    . THR A 1 212 ? 22.28800 11.44500  15.56600  1.000 15.10971 ?  216 THR A O    1 
ATOM   3186 C  CB   . THR A 1 212 ? 21.88700 12.64000  18.13900  1.000 14.77282 ?  216 THR A CB   1 
ATOM   3187 O  OG1  . THR A 1 212 ? 21.04100 13.65300  17.59600  1.000 14.88336 ?  216 THR A OG1  1 
ATOM   3188 C  CG2  . THR A 1 212 ? 22.05900 12.87100  19.63400  1.000 16.77306 ?  216 THR A CG2  1 
ATOM   3189 H  H    . THR A 1 212 ? 23.46100 14.59700  17.68000  1.000 17.13000 ?  216 THR A H    1 
ATOM   3190 H  HA   . THR A 1 212 ? 23.78000 11.93100  17.70200  1.000 17.02000 ?  216 THR A HA   1 
ATOM   3191 H  HB   . THR A 1 212 ? 21.48300 11.76500  18.03600  1.000 17.72000 ?  216 THR A HB   1 
ATOM   3192 H  HG1  . THR A 1 212 ? 20.26900 13.58700  17.92000  1.000 17.86000 ?  216 THR A HG1  1 
ATOM   3193 H  HG21 . THR A 1 212 ? 21.20800 12.76400  20.08600  1.000 20.12000 ?  216 THR A HG21 1 
ATOM   3194 H  HG22 . THR A 1 212 ? 22.69100 12.23100  19.99800  1.000 20.12000 ?  216 THR A HG22 1 
ATOM   3195 H  HG23 . THR A 1 212 ? 22.39100 13.76800  19.79500  1.000 20.12000 ?  216 THR A HG23 1 
ATOM   3196 N  N    . GLY A 1 213 ? 23.29400 13.37500  15.03900  1.000 14.12538 ?  217 GLY A N    1 
ATOM   3197 C  CA   . GLY A 1 213 ? 22.83600 13.34400  13.66700  1.000 13.92272 ?  217 GLY A CA   1 
ATOM   3198 C  C    . GLY A 1 213 ? 23.86000 13.03000  12.59900  1.000 14.29382 ?  217 GLY A C    1 
ATOM   3199 O  O    . GLY A 1 213 ? 23.61300 13.30400  11.42700  1.000 14.44647 ?  217 GLY A O    1 
ATOM   3200 H  H    . GLY A 1 213 ? 23.81900 14.03100  15.22100  1.000 16.95000 ?  217 GLY A H    1 
ATOM   3201 H  HA2  . GLY A 1 213 ? 22.13800 12.67400  13.59700  1.000 16.70000 ?  217 GLY A HA2  1 
ATOM   3202 H  HA3  . GLY A 1 213 ? 22.46200 14.21400  13.45500  1.000 16.70000 ?  217 GLY A HA3  1 
ATOM   3203 N  N    . ASN A 1 214 ? 25.00900 12.47800  12.96200  1.000 14.76756 ?  218 ASN A N    1 
ATOM   3204 C  CA   . ASN A 1 214 ? 26.08400 12.34200  11.99200  1.000 15.50186 ?  218 ASN A CA   1 
ATOM   3205 C  C    . ASN A 1 214 ? 25.75000 11.39000  10.85300  1.000 15.68083 ?  218 ASN A C    1 
ATOM   3206 O  O    . ASN A 1 214 ? 26.37400 11.48600  9.79200   1.000 16.67832 ?  218 ASN A O    1 
ATOM   3207 C  CB   . ASN A 1 214 ? 27.37000 11.89800  12.68200  1.000 16.86255 ?  218 ASN A CB   1 
ATOM   3208 C  CG   . ASN A 1 214 ? 27.92800 12.95900  13.60900  1.000 19.64183 ?  218 ASN A CG   1 
ATOM   3209 O  OD1  . ASN A 1 214 ? 27.56500 14.13100  13.51500  1.000 20.08925 ?  218 ASN A OD1  1 
ATOM   3210 N  ND2  . ASN A 1 214 ? 28.81600 12.55200  14.49300  1.000 23.70021 ?  218 ASN A ND2  1 
ATOM   3211 H  H    . ASN A 1 214 ? 25.18900 12.18000  13.74900  1.000 17.72000 ?  218 ASN A H    1 
ATOM   3212 H  HA   . ASN A 1 214 ? 26.24000 13.21500  11.59900  1.000 18.60000 ?  218 ASN A HA   1 
ATOM   3213 H  HB2  . ASN A 1 214 ? 27.19000 11.10300  13.20800  1.000 20.23000 ?  218 ASN A HB2  1 
ATOM   3214 H  HB3  . ASN A 1 214 ? 28.04100 11.70400  12.00800  1.000 20.23000 ?  218 ASN A HB3  1 
ATOM   3215 H  HD21 . ASN A 1 214 ? 29.16400 13.11500  15.04300  1.000 28.43000 ?  218 ASN A HD21 1 
ATOM   3216 H  HD22 . ASN A 1 214 ? 29.04800 11.72500  14.52000  1.000 28.43000 ?  218 ASN A HD22 1 
ATOM   3217 N  N    . HIS A 1 215 ? 24.79900 10.48300  11.03800  1.000 14.67544 ?  219 HIS A N    1 
ATOM   3218 C  CA   . HIS A 1 215 ? 24.44000 9.50800   10.02000  1.000 15.33079 ?  219 HIS A CA   1 
ATOM   3219 C  C    . HIS A 1 215 ? 23.17100 9.85000   9.26700   1.000 13.98326 ?  219 HIS A C    1 
ATOM   3220 O  O    . HIS A 1 215 ? 22.68800 9.00800   8.49900   1.000 15.09655 ?  219 HIS A O    1 
ATOM   3221 C  CB   . HIS A 1 215 ? 24.36300 8.11400   10.64000  1.000 17.27839 ?  219 HIS A CB   1 
ATOM   3222 C  CG   . HIS A 1 215 ? 25.61800 7.73100   11.34400  1.000 20.25506 ?  219 HIS A CG   1 
ATOM   3223 N  ND1  . HIS A 1 215 ? 26.79700 7.51100   10.67300  1.000 22.23951 ?  219 HIS A ND1  1 
ATOM   3224 C  CD2  . HIS A 1 215 ? 25.89900 7.60800   12.66200  1.000 22.98697 ?  219 HIS A CD2  1 
ATOM   3225 C  CE1  . HIS A 1 215 ? 27.75000 7.24100   11.54700  1.000 23.28174 ?  219 HIS A CE1  1 
ATOM   3226 N  NE2  . HIS A 1 215 ? 27.23200 7.29100   12.76100  1.000 23.92129 ?  219 HIS A NE2  1 
ATOM   3227 H  H    . HIS A 1 215 ? 24.33800 10.41200  11.76100  1.000 17.61000 ?  219 HIS A H    1 
ATOM   3228 H  HA   . HIS A 1 215 ? 25.14400 9.49100   9.35300   1.000 18.39000 ?  219 HIS A HA   1 
ATOM   3229 H  HB2  . HIS A 1 215 ? 23.63800 8.09300   11.28400  1.000 20.73000 ?  219 HIS A HB2  1 
ATOM   3230 H  HB3  . HIS A 1 215 ? 24.20200 7.46400   9.93800   1.000 20.73000 ?  219 HIS A HB3  1 
ATOM   3231 H  HD2  . HIS A 1 215 ? 25.30300 7.71700   13.36700  1.000 27.58000 ?  219 HIS A HD2  1 
ATOM   3232 H  HE1  . HIS A 1 215 ? 28.63700 7.04700   11.34200  1.000 27.94000 ?  219 HIS A HE1  1 
ATOM   3233 H  HE2  . HIS A 1 215 ? 27.65900 7.14800   13.49300  1.000 28.70000 ?  219 HIS A HE2  1 
ATOM   3234 N  N    . ARG A 1 216 ? 22.63200 11.04500  9.46800   1.000 13.21211 ?  220 ARG A N    1 
ATOM   3235 C  CA   . ARG A 1 216 ? 21.36100 11.44500  8.87700   1.000 13.18842 ?  220 ARG A CA   1 
ATOM   3236 C  C    . ARG A 1 216 ? 21.62700 12.57000  7.85700   1.000 12.81206 ?  220 ARG A C    1 
ATOM   3237 O  O    . ARG A 1 216 ? 22.44200 12.35700  6.95400   1.000 13.36476 ?  220 ARG A O    1 
ATOM   3238 C  CB   . ARG A 1 216 ? 20.32600 11.70800  9.97200   1.000 12.75942 ?  220 ARG A CB   1 
ATOM   3239 C  CG   . ARG A 1 216 ? 20.00100 10.44100  10.74400  1.000 13.18842 ?  220 ARG A CG   1 
ATOM   3240 C  CD   . ARG A 1 216 ? 18.95300 10.61900  11.81700  1.000 13.31212 ?  220 ARG A CD   1 
ATOM   3241 N  NE   . ARG A 1 216 ? 18.85000 9.37900   12.56500  1.000 13.26738 ?  220 ARG A NE   1 
ATOM   3242 C  CZ   . ARG A 1 216 ? 17.90800 9.10600   13.45800  1.000 13.30159 ?  220 ARG A CZ   1 
ATOM   3243 N  NH1  . ARG A 1 216 ? 16.86900 9.90700   13.63300  1.000 13.01735 ?  220 ARG A NH1  1 
ATOM   3244 N  NH2  . ARG A 1 216 ? 17.99400 7.98600   14.15800  1.000 14.89126 ?  220 ARG A NH2  1 
ATOM   3245 H  H    . ARG A 1 216 ? 22.99200 11.65600  9.95400   1.000 15.85000 ?  220 ARG A H    1 
ATOM   3246 H  HA   . ARG A 1 216 ? 21.01700 10.69800  8.36300   1.000 15.82000 ?  220 ARG A HA   1 
ATOM   3247 H  HB2  . ARG A 1 216 ? 20.67700 12.36400  10.59400  1.000 15.31000 ?  220 ARG A HB2  1 
ATOM   3248 H  HB3  . ARG A 1 216 ? 19.50800 12.03800  9.56800   1.000 15.31000 ?  220 ARG A HB3  1 
ATOM   3249 H  HG2  . ARG A 1 216 ? 19.67300 9.77300   10.12100  1.000 15.83000 ?  220 ARG A HG2  1 
ATOM   3250 H  HG3  . ARG A 1 216 ? 20.81100 10.12300  11.17400  1.000 15.83000 ?  220 ARG A HG3  1 
ATOM   3251 H  HD2  . ARG A 1 216 ? 19.21200 11.33300  12.42000  1.000 15.97000 ?  220 ARG A HD2  1 
ATOM   3252 H  HD3  . ARG A 1 216 ? 18.09400 10.81900  11.41400  1.000 15.97000 ?  220 ARG A HD3  1 
ATOM   3253 H  HE   . ARG A 1 216 ? 19.44500 8.77500   12.41700  1.000 15.92000 ?  220 ARG A HE   1 
ATOM   3254 H  HH11 . ARG A 1 216 ? 16.79400 10.62300  13.16100  1.000 15.62000 ?  220 ARG A HH11 1 
ATOM   3255 H  HH12 . ARG A 1 216 ? 16.26900 9.71300   14.21700  1.000 15.62000 ?  220 ARG A HH12 1 
ATOM   3256 H  HH21 . ARG A 1 216 ? 18.65300 7.44800   14.03000  1.000 17.87000 ?  220 ARG A HH21 1 
ATOM   3257 H  HH22 . ARG A 1 216 ? 17.39100 7.79600   14.74100  1.000 17.87000 ?  220 ARG A HH22 1 
ATOM   3258 N  N    . ILE A 1 217 ? 20.97800 13.72200  7.96000   1.000 12.62257 ?  221 ILE A N    1 
ATOM   3259 C  CA   . ILE A 1 217 ? 21.16200 14.74800  6.93600   1.000 12.55940 ?  221 ILE A CA   1 
ATOM   3260 C  C    . ILE A 1 217 ? 22.63500 15.11700  6.78300   1.000 13.24896 ?  221 ILE A C    1 
ATOM   3261 O  O    . ILE A 1 217 ? 23.11900 15.29300  5.65800   1.000 13.51215 ?  221 ILE A O    1 
ATOM   3262 C  CB   . ILE A 1 217 ? 20.29000 15.98100  7.23000   1.000 12.97787 ?  221 ILE A CB   1 
ATOM   3263 C  CG1  . ILE A 1 217 ? 18.79600 15.64100  7.07000   1.000 13.69638 ?  221 ILE A CG1  1 
ATOM   3264 C  CG2  . ILE A 1 217 ? 20.68800 17.14600  6.31700   1.000 13.48320 ?  221 ILE A CG2  1 
ATOM   3265 C  CD1  . ILE A 1 217 ? 17.87700 16.67600  7.63600   1.000 13.66743 ?  221 ILE A CD1  1 
ATOM   3266 H  H    . ILE A 1 217 ? 20.43800 13.93300  8.59600   1.000 15.14000 ?  221 ILE A H    1 
ATOM   3267 H  HA   . ILE A 1 217 ? 20.86700 14.37600  6.09100   1.000 15.07000 ?  221 ILE A HA   1 
ATOM   3268 H  HB   . ILE A 1 217 ? 20.43900 16.24900  8.15000   1.000 15.57000 ?  221 ILE A HB   1 
ATOM   3269 H  HG12 . ILE A 1 217 ? 18.59600 15.55400  6.12500   1.000 16.43000 ?  221 ILE A HG12 1 
ATOM   3270 H  HG13 . ILE A 1 217 ? 18.61600 14.80400  7.52600   1.000 16.43000 ?  221 ILE A HG13 1 
ATOM   3271 H  HG21 . ILE A 1 217 ? 20.01200 17.83900  6.37500   1.000 16.18000 ?  221 ILE A HG21 1 
ATOM   3272 H  HG22 . ILE A 1 217 ? 21.54600 17.49500  6.60600   1.000 16.18000 ?  221 ILE A HG22 1 
ATOM   3273 H  HG23 . ILE A 1 217 ? 20.75300 16.82400  5.40400   1.000 16.18000 ?  221 ILE A HG23 1 
ATOM   3274 H  HD11 . ILE A 1 217 ? 16.96700 16.34400  7.60000   1.000 16.40000 ?  221 ILE A HD11 1 
ATOM   3275 H  HD12 . ILE A 1 217 ? 18.12800 16.85200  8.55700   1.000 16.40000 ?  221 ILE A HD12 1 
ATOM   3276 H  HD13 . ILE A 1 217 ? 17.95400 17.48800  7.11200   1.000 16.40000 ?  221 ILE A HD13 1 
ATOM   3277 N  N    . ARG A 1 218 ? 23.37200 15.21100  7.89900   1.000 13.56478 ?  222 ARG A N    1 
ATOM   3278 C  CA   . ARG A 1 218 ? 24.78500 15.56500  7.84000   1.000 14.08327 ?  222 ARG A CA   1 
ATOM   3279 C  C    . ARG A 1 218 ? 25.58300 14.64700  6.93100   1.000 14.05168 ?  222 ARG A C    1 
ATOM   3280 O  O    . ARG A 1 218 ? 26.58100 15.08600  6.34900   1.000 14.60701 ?  222 ARG A O    1 
ATOM   3281 C  CB   . ARG A 1 218 ? 25.37800 15.53500  9.24600   1.000 14.90179 ?  222 ARG A CB   1 
ATOM   3282 C  CG   . ARG A 1 218 ? 25.05000 16.74400  10.08300  1.000 14.89915 ?  222 ARG A CG   1 
ATOM   3283 C  CD   . ARG A 1 218 ? 25.45600 16.51000  11.51600  1.000 15.60450 ?  222 ARG A CD   1 
ATOM   3284 N  NE   . ARG A 1 218 ? 24.98900 17.56500  12.39900  1.000 15.48870 ?  222 ARG A NE   1 
ATOM   3285 C  CZ   . ARG A 1 218 ? 25.69300 18.62500  12.76100  1.000 16.58620 ?  222 ARG A CZ   1 
ATOM   3286 N  NH1  . ARG A 1 218 ? 26.92000 18.83100  12.30600  1.000 17.79424 ?  222 ARG A NH1  1 
ATOM   3287 N  NH2  . ARG A 1 218 ? 25.14900 19.49800  13.60800  1.000 17.44420 ?  222 ARG A NH2  1 
ATOM   3288 H  H    . ARG A 1 218 ? 23.07500 15.07500  8.69500   1.000 16.28000 ?  222 ARG A H    1 
ATOM   3289 H  HA   . ARG A 1 218 ? 24.85600 16.46300  7.48000   1.000 16.90000 ?  222 ARG A HA   1 
ATOM   3290 H  HB2  . ARG A 1 218 ? 25.03600 14.75500  9.70900   1.000 17.88000 ?  222 ARG A HB2  1 
ATOM   3291 H  HB3  . ARG A 1 218 ? 26.34400 15.48100  9.17300   1.000 17.88000 ?  222 ARG A HB3  1 
ATOM   3292 H  HG2  . ARG A 1 218 ? 25.53100 17.51500  9.74600   1.000 17.88000 ?  222 ARG A HG2  1 
ATOM   3293 H  HG3  . ARG A 1 218 ? 24.09400 16.91100  10.05500  1.000 17.88000 ?  222 ARG A HG3  1 
ATOM   3294 H  HD2  . ARG A 1 218 ? 25.07700 15.67100  11.82100  1.000 18.72000 ?  222 ARG A HD2  1 
ATOM   3295 H  HD3  . ARG A 1 218 ? 26.42400 16.47700  11.57000  1.000 18.72000 ?  222 ARG A HD3  1 
ATOM   3296 H  HE   . ARG A 1 218 ? 24.19100 17.49500  12.71200  1.000 18.58000 ?  222 ARG A HE   1 
ATOM   3297 H  HH11 . ARG A 1 218 ? 27.27800 18.26900  11.76300  1.000 21.35000 ?  222 ARG A HH11 1 
ATOM   3298 H  HH12 . ARG A 1 218 ? 27.36000 19.52800  12.55500  1.000 21.35000 ?  222 ARG A HH12 1 
ATOM   3299 H  HH21 . ARG A 1 218 ? 24.35400 19.36700  13.90800  1.000 20.93000 ?  222 ARG A HH21 1 
ATOM   3300 H  HH22 . ARG A 1 218 ? 25.59200 20.19300  13.85300  1.000 20.93000 ?  222 ARG A HH22 1 
ATOM   3301 N  N    . ALA A 1 219 ? 25.20300 13.37000  6.83400   1.000 13.72270 ?  223 ALA A N    1 
ATOM   3302 C  CA   . ALA A 1 219 ? 25.93900 12.43600  5.98800   1.000 15.18340 ?  223 ALA A CA   1 
ATOM   3303 C  C    . ALA A 1 219 ? 25.79500 12.76500  4.51200   1.000 16.49935 ?  223 ALA A C    1 
ATOM   3304 O  O    . ALA A 1 219 ? 26.61000 12.30300  3.70300   1.000 18.44695 ?  223 ALA A O    1 
ATOM   3305 C  CB   . ALA A 1 219 ? 25.49200 10.99600  6.25000   1.000 15.84927 ?  223 ALA A CB   1 
ATOM   3306 H  H    . ALA A 1 219 ? 24.53000 13.02600  7.24400   1.000 16.46000 ?  223 ALA A H    1 
ATOM   3307 H  HA   . ALA A 1 219 ? 26.87900 12.49200  6.21900   1.000 18.21000 ?  223 ALA A HA   1 
ATOM   3308 H  HB1  . ALA A 1 219 ? 25.99500 10.40000  5.67500   1.000 19.02000 ?  223 ALA A HB1  1 
ATOM   3309 H  HB2  . ALA A 1 219 ? 25.66000 10.77800  7.18100   1.000 19.02000 ?  223 ALA A HB2  1 
ATOM   3310 H  HB3  . ALA A 1 219 ? 24.54400 10.92000  6.05900   1.000 19.02000 ?  223 ALA A HB3  1 
ATOM   3311 N  N    . ALA A 1 220 ? 24.81100 13.58700  4.14300   1.000 15.70978 ?  224 ALA A N    1 
ATOM   3312 C  CA   . ALA A 1 220 ? 24.61200 14.02200  2.76800   1.000 16.54935 ?  224 ALA A CA   1 
ATOM   3313 C  C    . ALA A 1 220 ? 25.20700 15.39500  2.49400   1.000 16.83097 ?  224 ALA A C    1 
ATOM   3314 O  O    . ALA A 1 220 ? 25.13200 15.87500  1.35900   1.000 19.41812 ?  224 ALA A O    1 
ATOM   3315 C  CB   . ALA A 1 220 ? 23.11300 14.04500  2.44000   1.000 17.55737 ?  224 ALA A CB   1 
ATOM   3316 H  H    . ALA A 1 220 ? 24.23200 13.91300  4.68900   1.000 18.85000 ?  224 ALA A H    1 
ATOM   3317 H  HA   . ALA A 1 220 ? 25.04200 13.38500  2.17500   1.000 19.85000 ?  224 ALA A HA   1 
ATOM   3318 H  HB1  . ALA A 1 220 ? 22.99500 14.32000  1.51700   1.000 21.07000 ?  224 ALA A HB1  1 
ATOM   3319 H  HB2  . ALA A 1 220 ? 22.74800 13.15500  2.56800   1.000 21.07000 ?  224 ALA A HB2  1 
ATOM   3320 H  HB3  . ALA A 1 220 ? 22.66900 14.67300  3.03100   1.000 21.07000 ?  224 ALA A HB3  1 
ATOM   3321 N  N    . VAL A 1 221 ? 25.76100 16.05000  3.50600   1.000 16.63357 ?  225 VAL A N    1 
ATOM   3322 C  CA   . VAL A 1 221 ? 26.22500 17.43400  3.43500   1.000 17.70212 ?  225 VAL A CA   1 
ATOM   3323 C  C    . VAL A 1 221 ? 27.75300 17.44200  3.41500   1.000 18.32588 ?  225 VAL A C    1 
ATOM   3324 O  O    . VAL A 1 221 ? 28.37100 16.91600  4.34300   1.000 18.98649 ?  225 VAL A O    1 
ATOM   3325 C  CB   . VAL A 1 221 ? 25.69300 18.24200  4.62900   1.000 17.64685 ?  225 VAL A CB   1 
ATOM   3326 C  CG1  . VAL A 1 221 ? 26.28600 19.64100  4.63700   1.000 18.85489 ?  225 VAL A CG1  1 
ATOM   3327 C  CG2  . VAL A 1 221 ? 24.17200 18.31000  4.59400   1.000 18.29693 ?  225 VAL A CG2  1 
ATOM   3328 H  H    . VAL A 1 221 ? 25.88500 15.69800  4.28100   1.000 19.96000 ?  225 VAL A H    1 
ATOM   3329 H  HA   . VAL A 1 221 ? 25.91800 17.83500  2.60600   1.000 21.24000 ?  225 VAL A HA   1 
ATOM   3330 H  HB   . VAL A 1 221 ? 25.95800 17.79600  5.44900   1.000 21.17000 ?  225 VAL A HB   1 
ATOM   3331 H  HG11 . VAL A 1 221 ? 25.79300 20.19000  5.26700   1.000 22.62000 ?  225 VAL A HG11 1 
ATOM   3332 H  HG12 . VAL A 1 221 ? 27.21800 19.58800  4.90400   1.000 22.62000 ?  225 VAL A HG12 1 
ATOM   3333 H  HG13 . VAL A 1 221 ? 26.21900 20.01900  3.74600   1.000 22.62000 ?  225 VAL A HG13 1 
ATOM   3334 H  HG21 . VAL A 1 221 ? 23.86100 18.82300  5.35600   1.000 21.96000 ?  225 VAL A HG21 1 
ATOM   3335 H  HG22 . VAL A 1 221 ? 23.89300 18.73900  3.77000   1.000 21.96000 ?  225 VAL A HG22 1 
ATOM   3336 H  HG23 . VAL A 1 221 ? 23.81400 17.40900  4.63500   1.000 21.96000 ?  225 VAL A HG23 1 
ATOM   3337 N  N    . PRO A 1 222 ? 28.39400 18.04200  2.40800   1.000 17.79687 ?  226 PRO A N    1 
ATOM   3338 C  CA   . PRO A 1 222 ? 29.86000 18.11400  2.39200   1.000 18.21797 ?  226 PRO A CA   1 
ATOM   3339 C  C    . PRO A 1 222 ? 30.43000 18.68800  3.67800   1.000 18.11796 ?  226 PRO A C    1 
ATOM   3340 O  O    . PRO A 1 222 ? 29.86100 19.60000  4.28200   1.000 17.80213 ?  226 PRO A O    1 
ATOM   3341 C  CB   . PRO A 1 222 ? 30.14500 19.04600  1.20900   1.000 18.76804 ?  226 PRO A CB   1 
ATOM   3342 C  CG   . PRO A 1 222 ? 28.99700 18.83200  0.31300   1.000 18.65487 ?  226 PRO A CG   1 
ATOM   3343 C  CD   . PRO A 1 222 ? 27.79800 18.64000  1.19900   1.000 18.82594 ?  226 PRO A CD   1 
ATOM   3344 H  HA   . PRO A 1 222 ? 30.23400 17.23200  2.24200   1.000 21.86000 ?  226 PRO A HA   1 
ATOM   3345 H  HB2  . PRO A 1 222 ? 30.19100 19.96600  1.51100   1.000 22.52000 ?  226 PRO A HB2  1 
ATOM   3346 H  HB3  . PRO A 1 222 ? 30.97800 18.79600  0.77900   1.000 22.52000 ?  226 PRO A HB3  1 
ATOM   3347 H  HG2  . PRO A 1 222 ? 28.88000 19.60900  -0.25500  1.000 22.38000 ?  226 PRO A HG2  1 
ATOM   3348 H  HG3  . PRO A 1 222 ? 29.15100 18.04400  -0.23000  1.000 22.38000 ?  226 PRO A HG3  1 
ATOM   3349 H  HD2  . PRO A 1 222 ? 27.37400 19.48800  1.40200   1.000 22.59000 ?  226 PRO A HD2  1 
ATOM   3350 H  HD3  . PRO A 1 222 ? 27.15700 18.03700  0.79100   1.000 22.59000 ?  226 PRO A HD3  1 
ATOM   3351 N  N    . ALA A 1 223 ? 31.60500 18.17300  4.05600   1.000 18.71540 ?  227 ALA A N    1 
ATOM   3352 C  CA   . ALA A 1 223 ? 32.22700 18.55700  5.31400   1.000 20.16031 ?  227 ALA A CA   1 
ATOM   3353 C  C    . ALA A 1 223 ? 32.58200 20.03000  5.38100   1.000 19.48392 ?  227 ALA A C    1 
ATOM   3354 O  O    . ALA A 1 223 ? 32.70400 20.56300  6.48700   1.000 20.94462 ?  227 ALA A O    1 
ATOM   3355 C  CB   . ALA A 1 223 ? 33.47600 17.70100  5.54600   1.000 22.53691 ?  227 ALA A CB   1 
ATOM   3356 H  H    . ALA A 1 223 ? 32.05700 17.60100  3.59900   1.000 22.46000 ?  227 ALA A H    1 
ATOM   3357 H  HA   . ALA A 1 223 ? 31.59700 18.38900  6.03200   1.000 24.19000 ?  227 ALA A HA   1 
ATOM   3358 H  HB1  . ALA A 1 223 ? 33.91900 18.00100  6.35500   1.000 27.04000 ?  227 ALA A HB1  1 
ATOM   3359 H  HB2  . ALA A 1 223 ? 33.21000 16.77300  5.64000   1.000 27.04000 ?  227 ALA A HB2  1 
ATOM   3360 H  HB3  . ALA A 1 223 ? 34.07200 17.79900  4.78700   1.000 27.04000 ?  227 ALA A HB3  1 
ATOM   3361 N  N    . ASP A 1 224 ? 32.76700 20.70300  4.24700   1.000 17.29944 ?  228 ASP A N    1 
ATOM   3362 C  CA   . ASP A 1 224 ? 33.14000 22.11600  4.27900   1.000 16.45197 ?  228 ASP A CA   1 
ATOM   3363 C  C    . ASP A 1 224 ? 31.93700 23.05900  4.28900   1.000 17.14416 ?  228 ASP A C    1 
ATOM   3364 O  O    . ASP A 1 224 ? 32.12200 24.26900  4.09200   1.000 17.97847 ?  228 ASP A O    1 
ATOM   3365 C  CB   . ASP A 1 224 ? 34.08200 22.47600  3.11900   1.000 15.44396 ?  228 ASP A CB   1 
ATOM   3366 C  CG   . ASP A 1 224 ? 33.38000 22.43100  1.78400   1.000 15.70188 ?  228 ASP A CG   1 
ATOM   3367 O  OD1  . ASP A 1 224 ? 32.63200 21.46500  1.57400   1.000 15.49133 ?  228 ASP A OD1  1 
ATOM   3368 O  OD2  . ASP A 1 224 ? 33.60000 23.32700  0.93500   1.000 16.70200 -1 228 ASP A OD2  1 
ATOM   3369 H  H    . ASP A 1 224 ? 32.68400 20.36800  3.46000   1.000 20.76000 ?  228 ASP A H    1 
ATOM   3370 H  HA   . ASP A 1 224 ? 33.63500 22.26300  5.10000   1.000 19.74000 ?  228 ASP A HA   1 
ATOM   3371 H  HB2  . ASP A 1 224 ? 34.42300 23.37500  3.25100   1.000 18.53000 ?  228 ASP A HB2  1 
ATOM   3372 H  HB3  . ASP A 1 224 ? 34.81600 21.84300  3.09600   1.000 18.53000 ?  228 ASP A HB3  1 
ATOM   3373 N  N    . TRP A 1 225 ? 30.71900 22.54400  4.49700   1.000 16.03613 ?  229 TRP A N    1 
ATOM   3374 C  CA   . TRP A 1 225 ? 29.54200 23.38900  4.66200   1.000 16.33091 ?  229 TRP A CA   1 
ATOM   3375 C  C    . TRP A 1 225 ? 29.11300 23.36200  6.12500   1.000 17.14153 ?  229 TRP A C    1 
ATOM   3376 O  O    . TRP A 1 225 ? 29.21000 22.33300  6.80300   1.000 20.37876 ?  229 TRP A O    1 
ATOM   3377 C  CB   . TRP A 1 225 ? 28.34400 22.90500  3.84200   1.000 15.64135 ?  229 TRP A CB   1 
ATOM   3378 C  CG   . TRP A 1 225 ? 28.53400 22.85800  2.37400   1.000 15.99665 ?  229 TRP A CG   1 
ATOM   3379 C  CD1  . TRP A 1 225 ? 29.64000 23.20700  1.67700   1.000 16.11772 ?  229 TRP A CD1  1 
ATOM   3380 C  CD2  . TRP A 1 225 ? 27.58900 22.37900  1.41400   1.000 16.66779 ?  229 TRP A CD2  1 
ATOM   3381 N  NE1  . TRP A 1 225 ? 29.44400 22.99000  0.33000   1.000 17.00467 ?  229 TRP A NE1  1 
ATOM   3382 C  CE2  . TRP A 1 225 ? 28.18500 22.48600  0.14300   1.000 17.24944 ?  229 TRP A CE2  1 
ATOM   3383 C  CE3  . TRP A 1 225 ? 26.27300 21.90500  1.50900   1.000 18.16797 ?  229 TRP A CE3  1 
ATOM   3384 C  CZ2  . TRP A 1 225 ? 27.52300 22.09100  -1.02300  1.000 18.44695 ?  229 TRP A CZ2  1 
ATOM   3385 C  CZ3  . TRP A 1 225 ? 25.61100 21.52100  0.35400   1.000 19.46286 ?  229 TRP A CZ3  1 
ATOM   3386 C  CH2  . TRP A 1 225 ? 26.23600 21.62100  -0.89900  1.000 19.57603 ?  229 TRP A CH2  1 
ATOM   3387 H  H    . TRP A 1 225 ? 30.55400 21.70200  4.54500   1.000 19.24000 ?  229 TRP A H    1 
ATOM   3388 H  HA   . TRP A 1 225 ? 29.77400 24.28500  4.37200   1.000 19.59000 ?  229 TRP A HA   1 
ATOM   3389 H  HB2  . TRP A 1 225 ? 28.12300 22.00500  4.13100   1.000 18.77000 ?  229 TRP A HB2  1 
ATOM   3390 H  HB3  . TRP A 1 225 ? 27.59800 23.50100  4.01500   1.000 18.77000 ?  229 TRP A HB3  1 
ATOM   3391 H  HD1  . TRP A 1 225 ? 30.42000 23.54600  2.05200   1.000 19.34000 ?  229 TRP A HD1  1 
ATOM   3392 H  HE1  . TRP A 1 225 ? 30.01900 23.14600  -0.29100  1.000 20.40000 ?  229 TRP A HE1  1 
ATOM   3393 H  HE3  . TRP A 1 225 ? 25.85100 21.85000  2.33500   1.000 21.80000 ?  229 TRP A HE3  1 
ATOM   3394 H  HZ2  . TRP A 1 225 ? 27.93800 22.14500  -1.85400  1.000 22.13000 ?  229 TRP A HZ2  1 
ATOM   3395 H  HZ3  . TRP A 1 225 ? 24.74200 21.19300  0.41000   1.000 23.35000 ?  229 TRP A HZ3  1 
ATOM   3396 H  HH2  . TRP A 1 225 ? 25.77100 21.36300  -1.66100  1.000 23.49000 ?  229 TRP A HH2  1 
ATOM   3397 N  N    . ALA A 1 226 ? 28.55200 24.46800  6.59600   1.000 15.71241 ?  230 ALA A N    1 
ATOM   3398 C  CA   . ALA A 1 226 ? 28.02600 24.50200  7.95900   1.000 15.59924 ?  230 ALA A CA   1 
ATOM   3399 C  C    . ALA A 1 226 ? 26.63000 23.88900  7.98300   1.000 15.29920 ?  230 ALA A C    1 
ATOM   3400 O  O    . ALA A 1 226 ? 25.87500 23.98000  7.01000   1.000 15.15182 ?  230 ALA A O    1 
ATOM   3401 C  CB   . ALA A 1 226 ? 27.96600 25.93200  8.49300   1.000 16.91255 ?  230 ALA A CB   1 
ATOM   3402 H  H    . ALA A 1 226 ? 28.46400 25.20100  6.15600   1.000 18.85000 ?  230 ALA A H    1 
ATOM   3403 H  HA   . ALA A 1 226 ? 28.61100 23.99500  8.54500   1.000 18.72000 ?  230 ALA A HA   1 
ATOM   3404 H  HB1  . ALA A 1 226 ? 27.61500 25.91700  9.39800   1.000 20.29000 ?  230 ALA A HB1  1 
ATOM   3405 H  HB2  . ALA A 1 226 ? 28.86000 26.30800  8.49100   1.000 20.29000 ?  230 ALA A HB2  1 
ATOM   3406 H  HB3  . ALA A 1 226 ? 27.38500 26.45800  7.92200   1.000 20.29000 ?  230 ALA A HB3  1 
ATOM   3407 N  N    . VAL A 1 227 ? 26.28700 23.28200  9.11700   1.000 14.87547 ?  231 VAL A N    1 
ATOM   3408 C  CA   . VAL A 1 227 ? 25.01300 22.58900  9.25600   1.000 14.77809 ?  231 VAL A CA   1 
ATOM   3409 C  C    . VAL A 1 227 ? 24.65500 22.47600  10.72100  1.000 14.68597 ?  231 VAL A C    1 
ATOM   3410 O  O    . VAL A 1 227 ? 25.51200 22.22200  11.56500  1.000 15.15182 ?  231 VAL A O    1 
ATOM   3411 C  CB   . VAL A 1 227 ? 25.06400 21.21200  8.55700   1.000 16.09140 ?  231 VAL A CB   1 
ATOM   3412 C  CG1  . VAL A 1 227 ? 26.31600 20.44500  8.97400   1.000 18.10480 ?  231 VAL A CG1  1 
ATOM   3413 C  CG2  . VAL A 1 227 ? 23.78600 20.41300  8.81900   1.000 16.59146 ?  231 VAL A CG2  1 
ATOM   3414 H  H    . VAL A 1 227 ? 26.77800 23.25800  9.82200   1.000 17.85000 ?  231 VAL A H    1 
ATOM   3415 H  HA   . VAL A 1 227 ? 24.31900 23.12600  8.84100   1.000 17.73000 ?  231 VAL A HA   1 
ATOM   3416 H  HB   . VAL A 1 227 ? 25.11600 21.34800  7.59800   1.000 19.30000 ?  231 VAL A HB   1 
ATOM   3417 H  HG11 . VAL A 1 227 ? 26.27600 19.55000  8.60200   1.000 21.72000 ?  231 VAL A HG11 1 
ATOM   3418 H  HG12 . VAL A 1 227 ? 27.09800 20.91000  8.63700   1.000 21.72000 ?  231 VAL A HG12 1 
ATOM   3419 H  HG13 . VAL A 1 227 ? 26.35000 20.39900  9.94200   1.000 21.72000 ?  231 VAL A HG13 1 
ATOM   3420 H  HG21 . VAL A 1 227 ? 23.75600 19.65600  8.21400   1.000 19.91000 ?  231 VAL A HG21 1 
ATOM   3421 H  HG22 . VAL A 1 227 ? 23.79100 20.10200  9.73800   1.000 19.91000 ?  231 VAL A HG22 1 
ATOM   3422 H  HG23 . VAL A 1 227 ? 23.01800 20.98700  8.66900   1.000 19.91000 ?  231 VAL A HG23 1 
ATOM   3423 N  N    . GLY A 1 228 ? 23.36700 22.61900  11.00300  1.000 14.10432 ?  232 GLY A N    1 
ATOM   3424 C  CA   . GLY A 1 228 ? 22.82600 22.26600  12.30100  1.000 14.41489 ?  232 GLY A CA   1 
ATOM   3425 C  C    . GLY A 1 228 ? 21.58800 21.42100  12.09900  1.000 13.66216 ?  232 GLY A C    1 
ATOM   3426 O  O    . GLY A 1 228 ? 20.89000 21.56700  11.10400  1.000 14.27803 ?  232 GLY A O    1 
ATOM   3427 H  H    A GLY A 1 228 ? 22.78100 22.92200  10.45100  0.590 16.92000 ?  232 GLY A H    1 
ATOM   3428 H  H    B GLY A 1 228 ? 22.78100 22.92200  10.45100  0.410 16.92000 ?  232 GLY A H    1 
ATOM   3429 H  HA2  . GLY A 1 228 ? 23.48000 21.76100  12.81000  1.000 17.30000 ?  232 GLY A HA2  1 
ATOM   3430 H  HA3  . GLY A 1 228 ? 22.59100 23.06700  12.79500  1.000 17.30000 ?  232 GLY A HA3  1 
ATOM   3431 N  N    . ASP A 1 229 ? 21.32900 20.51500  13.05000  1.000 13.12526 ?  233 ASP A N    1 
ATOM   3432 C  CA   . ASP A 1 229 ? 20.20300 19.60300  12.88900  1.000 12.28042 ?  233 ASP A CA   1 
ATOM   3433 C  C    . ASP A 1 229 ? 19.65500 19.18300  14.24500  1.000 12.95155 ?  233 ASP A C    1 
ATOM   3434 O  O    . ASP A 1 229 ? 20.29400 19.35400  15.28500  1.000 13.29107 ?  233 ASP A O    1 
ATOM   3435 C  CB   . ASP A 1 229 ? 20.59500 18.35600  12.07100  1.000 12.70415 ?  233 ASP A CB   1 
ATOM   3436 C  CG   . ASP A 1 229 ? 21.23600 17.27700  12.92700  1.000 12.97787 ?  233 ASP A CG   1 
ATOM   3437 O  OD1  . ASP A 1 229 ? 22.33900 17.51700  13.45100  1.000 13.18579 ?  233 ASP A OD1  1 
ATOM   3438 O  OD2  . ASP A 1 229 ? 20.62800 16.19100  13.14200  1.000 13.09894 -1 233 ASP A OD2  1 
ATOM   3439 H  H    . ASP A 1 229 ? 21.78100 20.41600  13.77500  1.000 15.75000 ?  233 ASP A H    1 
ATOM   3440 H  HA   . ASP A 1 229 ? 19.50200 20.08600  12.42400  1.000 14.73000 ?  233 ASP A HA   1 
ATOM   3441 H  HB2  . ASP A 1 229 ? 19.79900 17.98300  11.66100  1.000 15.24000 ?  233 ASP A HB2  1 
ATOM   3442 H  HB3  . ASP A 1 229 ? 21.23100 18.61400  11.38600  1.000 15.24000 ?  233 ASP A HB3  1 
ATOM   3443 N  N    . LYS A 1 230 ? 18.44900 18.60900  14.21100  1.000 12.31200 ?  234 LYS A N    1 
ATOM   3444 C  CA   . LYS A 1 230 ? 17.88300 17.89700  15.35400  1.000 11.86458 ?  234 LYS A CA   1 
ATOM   3445 C  C    . LYS A 1 230 ? 17.22500 16.61400  14.85900  1.000 11.59350 ?  234 LYS A C    1 
ATOM   3446 O  O    . LYS A 1 230 ? 16.36500 16.65000  13.96400  1.000 12.08829 ?  234 LYS A O    1 
ATOM   3447 C  CB   . LYS A 1 230 ? 16.83400 18.72700  16.10500  1.000 12.65941 ?  234 LYS A CB   1 
ATOM   3448 C  CG   . LYS A 1 230 ? 16.19300 17.95300  17.26400  1.000 13.27264 ?  234 LYS A CG   1 
ATOM   3449 C  CD   . LYS A 1 230 ? 17.13800 17.88800  18.49200  1.000 14.40962 ?  234 LYS A CD   1 
ATOM   3450 C  CE   . LYS A 1 230 ? 16.71900 16.84400  19.51800  1.000 14.27013 ?  234 LYS A CE   1 
ATOM   3451 N  NZ   . LYS A 1 230 ? 17.10100 15.46800  19.10200  1.000 14.36488 ?  234 LYS A NZ   1 
ATOM   3452 H  H    . LYS A 1 230 ? 17.93300 18.62000  13.52400  1.000 14.77000 ?  234 LYS A H    1 
ATOM   3453 H  HA   . LYS A 1 230 ? 18.60400 17.68600  15.96800  1.000 14.23000 ?  234 LYS A HA   1 
ATOM   3454 H  HB2  . LYS A 1 230 ? 17.25900 19.51900  16.47000  1.000 15.19000 ?  234 LYS A HB2  1 
ATOM   3455 H  HB3  . LYS A 1 230 ? 16.13100 18.98300  15.48700  1.000 15.19000 ?  234 LYS A HB3  1 
ATOM   3456 H  HG2  . LYS A 1 230 ? 15.37300 18.39600  17.53300  1.000 15.92000 ?  234 LYS A HG2  1 
ATOM   3457 H  HG3  . LYS A 1 230 ? 16.00100 17.04600  16.97800  1.000 15.92000 ?  234 LYS A HG3  1 
ATOM   3458 H  HD2  . LYS A 1 230 ? 18.03200 17.66500  18.18900  1.000 17.29000 ?  234 LYS A HD2  1 
ATOM   3459 H  HD3  . LYS A 1 230 ? 17.14200 18.75200  18.93100  1.000 17.29000 ?  234 LYS A HD3  1 
ATOM   3460 H  HE2  . LYS A 1 230 ? 17.15300 17.03600  20.36400  1.000 17.12000 ?  234 LYS A HE2  1 
ATOM   3461 H  HE3  . LYS A 1 230 ? 15.75500 16.87100  19.62600  1.000 17.12000 ?  234 LYS A HE3  1 
ATOM   3462 H  HZ1  . LYS A 1 230 ? 16.91700 14.89100  19.75400  1.000 17.23000 ?  234 LYS A HZ1  1 
ATOM   3463 H  HZ2  . LYS A 1 230 ? 16.64800 15.23400  18.37200  1.000 17.23000 ?  234 LYS A HZ2  1 
ATOM   3464 H  HZ3  . LYS A 1 230 ? 17.97200 15.43500  18.92400  1.000 17.23000 ?  234 LYS A HZ3  1 
ATOM   3465 N  N    . THR A 1 231 ? 17.59700 15.49200  15.48000  1.000 11.79352 ?  235 THR A N    1 
ATOM   3466 C  CA   . THR A 1 231 ? 17.06400 14.18600  15.14100  1.000 11.93038 ?  235 THR A CA   1 
ATOM   3467 C  C    . THR A 1 231 ? 15.83700 13.81800  15.97600  1.000 11.66982 ?  235 THR A C    1 
ATOM   3468 O  O    . THR A 1 231 ? 15.56700 14.38800  17.03900  1.000 12.24621 ?  235 THR A O    1 
ATOM   3469 C  CB   . THR A 1 231 ? 18.11900 13.11500  15.40700  1.000 12.87786 ?  235 THR A CB   1 
ATOM   3470 O  OG1  . THR A 1 231 ? 18.51900 13.15600  16.78500  1.000 13.45688 ?  235 THR A OG1  1 
ATOM   3471 C  CG2  . THR A 1 231 ? 19.34100 13.33200  14.55800  1.000 13.00682 ?  235 THR A CG2  1 
ATOM   3472 H  H    . THR A 1 231 ? 18.17400 15.46800  16.11800  1.000 14.15000 ?  235 THR A H    1 
ATOM   3473 H  HA   . THR A 1 231 ? 16.80700 14.21000  14.20600  1.000 14.31000 ?  235 THR A HA   1 
ATOM   3474 H  HB   . THR A 1 231 ? 17.73800 12.25000  15.19200  1.000 15.45000 ?  235 THR A HB   1 
ATOM   3475 H  HG1  . THR A 1 231 ? 17.85900 12.99700  17.28000  1.000 16.15000 ?  235 THR A HG1  1 
ATOM   3476 H  HG21 . THR A 1 231 ? 19.98600 12.62500  14.71900  1.000 15.60000 ?  235 THR A HG21 1 
ATOM   3477 H  HG22 . THR A 1 231 ? 19.09800 13.32800  13.61900  1.000 15.60000 ?  235 THR A HG22 1 
ATOM   3478 H  HG23 . THR A 1 231 ? 19.74900 14.18500  14.77400  1.000 15.60000 ?  235 THR A HG23 1 
ATOM   3479 N  N    . GLY A 1 232 ? 15.13000 12.80600  15.49600  1.000 11.53823 ?  236 GLY A N    1 
ATOM   3480 C  CA   . GLY A 1 232 ? 14.11500 12.12900  16.27700  1.000 11.46453 ?  236 GLY A CA   1 
ATOM   3481 C  C    . GLY A 1 232 ? 14.10000 10.64800  15.98300  1.000 11.07764 ?  236 GLY A C    1 
ATOM   3482 O  O    . GLY A 1 232 ? 14.25900 10.25300  14.81700  1.000 12.25936 ?  236 GLY A O    1 
ATOM   3483 H  H    . GLY A 1 232 ? 15.22200 12.48700  14.70300  1.000 13.84000 ?  236 GLY A H    1 
ATOM   3484 H  HA2  . GLY A 1 232 ? 14.29200 12.25700  17.22200  1.000 13.75000 ?  236 GLY A HA2  1 
ATOM   3485 H  HA3  . GLY A 1 232 ? 13.24300 12.49700  16.06700  1.000 13.75000 ?  236 GLY A HA3  1 
ATOM   3486 N  N    . THR A 1 233 ? 13.91900 9.82400   17.01100  1.000 11.46453 ?  237 THR A N    1 
ATOM   3487 C  CA   . THR A 1 233 ? 13.87100 8.37400   16.86300  1.000 12.56993 ?  237 THR A CA   1 
ATOM   3488 C  C    . THR A 1 233 ? 12.85300 7.83800   17.86200  1.000 12.87786 ?  237 THR A C    1 
ATOM   3489 O  O    . THR A 1 233 ? 13.06800 7.93100   19.07000  1.000 14.24381 ?  237 THR A O    1 
ATOM   3490 C  CB   . THR A 1 233 ? 15.23500 7.74300   17.13100  1.000 14.09643 ?  237 THR A CB   1 
ATOM   3491 O  OG1  . THR A 1 233 ? 16.22200 8.38900   16.31900  1.000 14.63070 ?  237 THR A OG1  1 
ATOM   3492 C  CG2  . THR A 1 233 ? 15.21000 6.27400   16.80700  1.000 15.39921 ?  237 THR A CG2  1 
ATOM   3493 H  H    . THR A 1 233 ? 13.82000 10.08800  17.82300  1.000 13.76000 ?  237 THR A H    1 
ATOM   3494 H  HA   . THR A 1 233 ? 13.58900 8.15500   15.96100  1.000 15.08000 ?  237 THR A HA   1 
ATOM   3495 H  HB   . THR A 1 233 ? 15.46300 7.84600   18.06800  1.000 16.91000 ?  237 THR A HB   1 
ATOM   3496 H  HG1  . THR A 1 233 ? 16.99000 8.14000   16.54900  1.000 17.56000 ?  237 THR A HG1  1 
ATOM   3497 H  HG21 . THR A 1 233 ? 16.10200 5.90200   16.88700  1.000 18.48000 ?  237 THR A HG21 1 
ATOM   3498 H  HG22 . THR A 1 233 ? 14.61800 5.81000   17.42000  1.000 18.48000 ?  237 THR A HG22 1 
ATOM   3499 H  HG23 . THR A 1 233 ? 14.89200 6.14000   15.90100  1.000 18.48000 ?  237 THR A HG23 1 
ATOM   3500 N  N    . CYS A 1 234 ? 11.72900 7.29600   17.39000  1.000 12.54887 ?  238 CYS A N    1 
ATOM   3501 C  CA   . CYS A 1 234 ? 10.68000 6.85300   18.29800  1.000 13.42266 ?  238 CYS A CA   1 
ATOM   3502 C  C    . CYS A 1 234 ? 10.90200 5.45300   18.82600  1.000 14.68071 ?  238 CYS A C    1 
ATOM   3503 O  O    . CYS A 1 234 ? 10.37300 5.13200   19.89700  1.000 16.25195 ?  238 CYS A O    1 
ATOM   3504 C  CB   . CYS A 1 234 ? 9.29900  6.92100   17.63100  1.000 13.43056 ?  238 CYS A CB   1 
ATOM   3505 S  SG   . CYS A 1 234 ? 8.49700  8.54700   17.64100  1.000 13.45424 ?  238 CYS A SG   1 
ATOM   3506 H  H    . CYS A 1 234 ? 11.55500 7.17700   16.55600  1.000 15.05000 ?  238 CYS A H    1 
ATOM   3507 H  HA   . CYS A 1 234 ? 10.66500 7.46400   19.05200  1.000 16.10000 ?  238 CYS A HA   1 
ATOM   3508 H  HB2  . CYS A 1 234 ? 9.39600  6.65400   16.70300  1.000 16.12000 ?  238 CYS A HB2  1 
ATOM   3509 H  HB3  . CYS A 1 234 ? 8.70800  6.30600   18.09300  1.000 16.12000 ?  238 CYS A HB3  1 
ATOM   3510 N  N    . GLY A 1 235 ? 11.64900 4.60600   18.10200  1.000 14.90968 ?  239 GLY A N    1 
ATOM   3511 C  CA   . GLY A 1 235 ? 11.92300 3.24700   18.56000  1.000 15.57292 ?  239 GLY A CA   1 
ATOM   3512 C  C    . GLY A 1 235 ? 10.91700 2.20100   18.12700  1.000 15.59397 ?  239 GLY A C    1 
ATOM   3513 O  O    . GLY A 1 235 ? 11.10200 1.01600   18.43400  1.000 16.93624 ?  239 GLY A O    1 
ATOM   3514 H  H    . GLY A 1 235 ? 12.00500 4.80000   17.34400  1.000 17.89000 ?  239 GLY A H    1 
ATOM   3515 H  HA2  . GLY A 1 235 ? 12.79100 2.97700   18.22200  1.000 18.69000 ?  239 GLY A HA2  1 
ATOM   3516 H  HA3  . GLY A 1 235 ? 11.94800 3.24800   19.53000  1.000 18.69000 ?  239 GLY A HA3  1 
ATOM   3517 N  N    . VAL A 1 236 ? 9.85100  2.59700   17.43700  1.000 14.66755 ?  240 VAL A N    1 
ATOM   3518 C  CA   . VAL A 1 236 ? 8.82300  1.68000   16.96400  1.000 14.33856 ?  240 VAL A CA   1 
ATOM   3519 C  C    . VAL A 1 236 ? 8.35100  2.19400   15.60800  1.000 12.51729 ?  240 VAL A C    1 
ATOM   3520 O  O    . VAL A 1 236 ? 8.58000  3.35100   15.24500  1.000 13.19895 ?  240 VAL A O    1 
ATOM   3521 C  CB   . VAL A 1 236 ? 7.60900  1.60400   17.92500  1.000 15.30973 ?  240 VAL A CB   1 
ATOM   3522 C  CG1  . VAL A 1 236 ? 7.95800  0.81600   19.18600  1.000 16.80728 ?  240 VAL A CG1  1 
ATOM   3523 C  CG2  . VAL A 1 236 ? 7.13700  3.00600   18.28000  1.000 16.22563 ?  240 VAL A CG2  1 
ATOM   3524 H  H    . VAL A 1 236 ? 9.69800  3.41700   17.22500  1.000 17.60000 ?  240 VAL A H    1 
ATOM   3525 H  HA   . VAL A 1 236 ? 9.19600  0.79000   16.87400  1.000 17.20000 ?  240 VAL A HA   1 
ATOM   3526 H  HB   . VAL A 1 236 ? 6.88500  1.13700   17.48000  1.000 18.37000 ?  240 VAL A HB   1 
ATOM   3527 H  HG11 . VAL A 1 236 ? 7.16600  0.74200   19.74100  1.000 20.17000 ?  240 VAL A HG11 1 
ATOM   3528 H  HG12 . VAL A 1 236 ? 8.26700  -0.06700  18.93100  1.000 20.17000 ?  240 VAL A HG12 1 
ATOM   3529 H  HG13 . VAL A 1 236 ? 8.65700  1.28500   19.66800  1.000 20.17000 ?  240 VAL A HG13 1 
ATOM   3530 H  HG21 . VAL A 1 236 ? 6.35700  2.94100   18.85300  1.000 19.47000 ?  240 VAL A HG21 1 
ATOM   3531 H  HG22 . VAL A 1 236 ? 7.85000  3.47200   18.74400  1.000 19.47000 ?  240 VAL A HG22 1 
ATOM   3532 H  HG23 . VAL A 1 236 ? 6.90900  3.47800   17.46400  1.000 19.47000 ?  240 VAL A HG23 1 
ATOM   3533 N  N    . TYR A 1 237 ? 7.68100  1.31200   14.85800  1.000 13.09631 ?  241 TYR A N    1 
ATOM   3534 C  CA   . TYR A 1 237 ? 6.98200  1.68900   13.62300  1.000 12.69626 ?  241 TYR A CA   1 
ATOM   3535 C  C    . TYR A 1 237 ? 7.92100  2.35000   12.61200  1.000 12.87523 ?  241 TYR A C    1 
ATOM   3536 O  O    . TYR A 1 237 ? 7.53600  3.26900   11.89800  1.000 12.76469 ?  241 TYR A O    1 
ATOM   3537 C  CB   . TYR A 1 237 ? 5.72900  2.56200   13.88000  1.000 12.97524 ?  241 TYR A CB   1 
ATOM   3538 C  CG   . TYR A 1 237 ? 4.61500  1.79200   14.53900  1.000 12.45149 ?  241 TYR A CG   1 
ATOM   3539 C  CD1  . TYR A 1 237 ? 3.83600  0.89700   13.80800  1.000 12.81206 ?  241 TYR A CD1  1 
ATOM   3540 C  CD2  . TYR A 1 237 ? 4.33900  1.94100   15.89400  1.000 12.61730 ?  241 TYR A CD2  1 
ATOM   3541 C  CE1  . TYR A 1 237 ? 2.83700  0.15900   14.41000  1.000 12.61730 ?  241 TYR A CE1  1 
ATOM   3542 C  CE2  . TYR A 1 237 ? 3.34800  1.19400   16.50900  1.000 13.19632 ?  241 TYR A CE2  1 
ATOM   3543 C  CZ   . TYR A 1 237 ? 2.59600  0.31300   15.75600  1.000 13.06472 ?  241 TYR A CZ   1 
ATOM   3544 O  OH   . TYR A 1 237 ? 1.59600  -0.43700  16.33300  1.000 14.83599 ?  241 TYR A OH   1 
ATOM   3545 H  H    . TYR A 1 237 ? 7.61500  0.47600   15.04600  1.000 15.71000 ?  241 TYR A H    1 
ATOM   3546 H  HA   . TYR A 1 237 ? 6.66500  0.86500   13.22300  1.000 15.23000 ?  241 TYR A HA   1 
ATOM   3547 H  HB2  . TYR A 1 237 ? 5.97100  3.30000   14.46100  1.000 15.57000 ?  241 TYR A HB2  1 
ATOM   3548 H  HB3  . TYR A 1 237 ? 5.40000  2.90200   13.03300  1.000 15.57000 ?  241 TYR A HB3  1 
ATOM   3549 H  HD1  . TYR A 1 237 ? 3.99200  0.79400   12.89700  1.000 15.37000 ?  241 TYR A HD1  1 
ATOM   3550 H  HD2  . TYR A 1 237 ? 4.82800  2.55200   16.39600  1.000 15.14000 ?  241 TYR A HD2  1 
ATOM   3551 H  HE1  . TYR A 1 237 ? 2.33000  -0.43900  13.91000  1.000 15.14000 ?  241 TYR A HE1  1 
ATOM   3552 H  HE2  . TYR A 1 237 ? 3.19000  1.28500   17.42100  1.000 15.83000 ?  241 TYR A HE2  1 
ATOM   3553 H  HH   . TYR A 1 237 ? 1.27700  -0.97200  15.77000  1.000 17.80000 ?  241 TYR A HH   1 
ATOM   3554 N  N    . GLY A 1 238 ? 9.17300  1.89400   12.55900  1.000 13.65953 ?  242 GLY A N    1 
ATOM   3555 C  CA   . GLY A 1 238 ? 10.14100 2.45600   11.63500  1.000 13.45161 ?  242 GLY A CA   1 
ATOM   3556 C  C    . GLY A 1 238 ? 10.19900 3.96800   11.62500  1.000 12.88576 ?  242 GLY A C    1 
ATOM   3557 O  O    . GLY A 1 238 ? 10.46500 4.56500   10.57800  1.000 13.80429 ?  242 GLY A O    1 
ATOM   3558 H  H    . GLY A 1 238 ? 9.48100  1.25900   13.05100  1.000 16.39000 ?  242 GLY A H    1 
ATOM   3559 H  HA2  . GLY A 1 238 ? 11.02300 2.12800   11.87000  1.000 16.14000 ?  242 GLY A HA2  1 
ATOM   3560 H  HA3  . GLY A 1 238 ? 9.92300  2.16200   10.73700  1.000 16.14000 ?  242 GLY A HA3  1 
ATOM   3561 N  N    . THR A 1 239 ? 9.97900  4.61000   12.77300  1.000 12.32253 ?  243 THR A N    1 
ATOM   3562 C  CA   . THR A 1 239 ? 9.70100  6.04200   12.82700  1.000 12.12777 ?  243 THR A CA   1 
ATOM   3563 C  C    . THR A 1 239 ? 10.92700 6.78800   13.33800  1.000 12.11461 ?  243 THR A C    1 
ATOM   3564 O  O    . THR A 1 239 ? 11.31800 6.63700   14.50500  1.000 12.97261 ?  243 THR A O    1 
ATOM   3565 C  CB   . THR A 1 239 ? 8.46400  6.31500   13.69100  1.000 12.23568 ?  243 THR A CB   1 
ATOM   3566 O  OG1  . THR A 1 239 ? 7.31200  5.73600   13.06000  1.000 12.39359 ?  243 THR A OG1  1 
ATOM   3567 C  CG2  . THR A 1 239 ? 8.20800  7.79500   13.85300  1.000 12.83049 ?  243 THR A CG2  1 
ATOM   3568 H  H    . THR A 1 239 ? 9.98600  4.22900   13.54400  1.000 14.78000 ?  243 THR A H    1 
ATOM   3569 H  HA   . THR A 1 239 ? 9.53200  6.36500   11.92800  1.000 14.55000 ?  243 THR A HA   1 
ATOM   3570 H  HB   . THR A 1 239 ? 8.61300  5.93200   14.57000  1.000 14.68000 ?  243 THR A HB   1 
ATOM   3571 H  HG1  . THR A 1 239 ? 7.43700  4.91500   12.93100  1.000 14.87000 ?  243 THR A HG1  1 
ATOM   3572 H  HG21 . THR A 1 239 ? 7.41400  7.93700   14.39300  1.000 15.40000 ?  243 THR A HG21 1 
ATOM   3573 H  HG22 . THR A 1 239 ? 8.96400  8.21600   14.28900  1.000 15.40000 ?  243 THR A HG22 1 
ATOM   3574 H  HG23 . THR A 1 239 ? 8.07600  8.20500   12.98500  1.000 15.40000 ?  243 THR A HG23 1 
ATOM   3575 N  N    . ALA A 1 240 ? 11.52400 7.59900   12.46200  1.000 11.80405 ?  244 ALA A N    1 
ATOM   3576 C  CA   . ALA A 1 240 ? 12.69100 8.40000   12.80200  1.000 11.82247 ?  244 ALA A CA   1 
ATOM   3577 C  C    . ALA A 1 240 ? 12.76400 9.54900   11.81200  1.000 11.69351 ?  244 ALA A C    1 
ATOM   3578 O  O    . ALA A 1 240 ? 12.11200 9.52600   10.76400  1.000 12.36727 ?  244 ALA A O    1 
ATOM   3579 C  CB   . ALA A 1 240 ? 13.97400 7.56500   12.74700  1.000 12.84365 ?  244 ALA A CB   1 
ATOM   3580 H  H    . ALA A 1 240 ? 11.26500 7.70100   11.64800  1.000 14.16000 ?  244 ALA A H    1 
ATOM   3581 H  HA   . ALA A 1 240 ? 12.60000 8.75900   13.69900  1.000 14.18000 ?  244 ALA A HA   1 
ATOM   3582 H  HB1  . ALA A 1 240 ? 14.72700 8.12600   12.99000  1.000 15.41000 ?  244 ALA A HB1  1 
ATOM   3583 H  HB2  . ALA A 1 240 ? 13.89700 6.82600   13.37100  1.000 15.41000 ?  244 ALA A HB2  1 
ATOM   3584 H  HB3  . ALA A 1 240 ? 14.09100 7.22500   11.84600  1.000 15.41000 ?  244 ALA A HB3  1 
ATOM   3585 N  N    . ASN A 1 241 ? 13.57300 10.55100  12.13900  1.000 11.41453 ?  245 ASN A N    1 
ATOM   3586 C  CA   . ASN A 1 241 ? 13.53300 11.78800  11.37000  1.000 11.63824 ?  245 ASN A CA   1 
ATOM   3587 C  C    . ASN A 1 241 ? 14.75200 12.65000  11.68300  1.000 11.19871 ?  245 ASN A C    1 
ATOM   3588 O  O    . ASN A 1 241 ? 15.56900 12.34600  12.56300  1.000 11.25924 ?  245 ASN A O    1 
ATOM   3589 C  CB   . ASN A 1 241 ? 12.23200 12.54900  11.65100  1.000 11.35926 ?  245 ASN A CB   1 
ATOM   3590 C  CG   . ASN A 1 241 ? 12.03200 12.78800  13.14400  1.000 11.61455 ?  245 ASN A CG   1 
ATOM   3591 O  OD1  . ASN A 1 241 ? 12.82800 13.49200  13.77800  1.000 11.98038 ?  245 ASN A OD1  1 
ATOM   3592 N  ND2  . ASN A 1 241 ? 11.00100 12.15400  13.73000  1.000 11.66719 ?  245 ASN A ND2  1 
ATOM   3593 H  H    . ASN A 1 241 ? 14.14000 10.53900  12.78500  1.000 13.70000 ?  245 ASN A H    1 
ATOM   3594 H  HA   . ASN A 1 241 ? 13.59000 11.57000  10.42700  1.000 13.96000 ?  245 ASN A HA   1 
ATOM   3595 H  HB2  . ASN A 1 241 ? 12.26200 13.41000  11.20600  1.000 13.63000 ?  245 ASN A HB2  1 
ATOM   3596 H  HB3  . ASN A 1 241 ? 11.48100 12.03200  11.32200  1.000 13.63000 ?  245 ASN A HB3  1 
ATOM   3597 H  HD21 . ASN A 1 241 ? 10.85300 12.26100  14.57000  1.000 14.00000 ?  245 ASN A HD21 1 
ATOM   3598 H  HD22 . ASN A 1 241 ? 10.49100 11.64200  13.26400  1.000 14.00000 ?  245 ASN A HD22 1 
ATOM   3599 N  N    . ASP A 1 242 ? 14.88500 13.72400  10.91900  1.000 11.26188 ?  246 ASP A N    1 
ATOM   3600 C  CA   . ASP A 1 242 ? 15.92500 14.72600  11.10800  1.000 11.51191 ?  246 ASP A CA   1 
ATOM   3601 C  C    . ASP A 1 242 ? 15.46200 15.97400  10.37900  1.000 10.89604 ?  246 ASP A C    1 
ATOM   3602 O  O    . ASP A 1 242 ? 14.83800 15.87700  9.32000   1.000 12.23831 ?  246 ASP A O    1 
ATOM   3603 C  CB   . ASP A 1 242 ? 17.24800 14.21100  10.52300  1.000 11.27504 ?  246 ASP A CB   1 
ATOM   3604 C  CG   . ASP A 1 242 ? 18.48700 14.97000  10.98200  1.000 11.87511 ?  246 ASP A CG   1 
ATOM   3605 O  OD1  . ASP A 1 242 ? 18.46900 15.59600  12.06100  1.000 12.71468 ?  246 ASP A OD1  1 
ATOM   3606 O  OD2  . ASP A 1 242 ? 19.51200 14.89100  10.25900  1.000 12.37517 -1 246 ASP A OD2  1 
ATOM   3607 H  H    . ASP A 1 242 ? 14.36600 13.90400  10.25700  1.000 13.51000 ?  246 ASP A H    1 
ATOM   3608 H  HA   . ASP A 1 242 ? 16.06400 14.94100  12.04400  1.000 13.81000 ?  246 ASP A HA   1 
ATOM   3609 H  HB2  . ASP A 1 242 ? 17.36100 13.28400  10.78500  1.000 13.53000 ?  246 ASP A HB2  1 
ATOM   3610 H  HB3  . ASP A 1 242 ? 17.20600 14.28000  9.55700   1.000 13.53000 ?  246 ASP A HB3  1 
ATOM   3611 N  N    . TYR A 1 243 ? 15.78700 17.13600  10.93200  1.000 11.39084 ?  247 TYR A N    1 
ATOM   3612 C  CA   . TYR A 1 243 ? 15.64000 18.39000  10.21000  1.000 11.72246 ?  247 TYR A CA   1 
ATOM   3613 C  C    . TYR A 1 243 ? 16.91300 19.20500  10.36900  1.000 11.66456 ?  247 TYR A C    1 
ATOM   3614 O  O    . TYR A 1 243 ? 17.65100 19.04200  11.34700  1.000 12.31463 ?  247 TYR A O    1 
ATOM   3615 C  CB   . TYR A 1 243 ? 14.41300 19.20100  10.62500  1.000 12.10671 ?  247 TYR A CB   1 
ATOM   3616 C  CG   . TYR A 1 243 ? 14.24500 19.57000  12.09000  1.000 11.44085 ?  247 TYR A CG   1 
ATOM   3617 C  CD1  . TYR A 1 243 ? 15.05300 20.52700  12.68000  1.000 12.86733 ?  247 TYR A CD1  1 
ATOM   3618 C  CD2  . TYR A 1 243 ? 13.23600 19.00600  12.84000  1.000 11.99091 ?  247 TYR A CD2  1 
ATOM   3619 C  CE1  . TYR A 1 243 ? 14.88300 20.88400  13.99400  1.000 13.30423 ?  247 TYR A CE1  1 
ATOM   3620 C  CE2  . TYR A 1 243 ? 13.03400 19.38400  14.16300  1.000 12.36990 ?  247 TYR A CE2  1 
ATOM   3621 C  CZ   . TYR A 1 243 ? 13.85200 20.32500  14.72700  1.000 13.00156 ?  247 TYR A CZ   1 
ATOM   3622 O  OH   . TYR A 1 243 ? 13.69200 20.69700  16.03700  1.000 13.61216 ?  247 TYR A OH   1 
ATOM   3623 H  H    . TYR A 1 243 ? 16.09800 17.22300  11.72900  1.000 13.67000 ?  247 TYR A H    1 
ATOM   3624 H  HA   . TYR A 1 243 ? 15.51300 18.19600  9.26900   1.000 14.06000 ?  247 TYR A HA   1 
ATOM   3625 H  HB2  . TYR A 1 243 ? 14.43400 20.03600  10.13200  1.000 14.52000 ?  247 TYR A HB2  1 
ATOM   3626 H  HB3  . TYR A 1 243 ? 13.62700 18.68900  10.37800  1.000 14.52000 ?  247 TYR A HB3  1 
ATOM   3627 H  HD1  . TYR A 1 243 ? 15.72100 20.93400  12.17700  1.000 15.44000 ?  247 TYR A HD1  1 
ATOM   3628 H  HD2  . TYR A 1 243 ? 12.68300 18.36400  12.45700  1.000 14.39000 ?  247 TYR A HD2  1 
ATOM   3629 H  HE1  . TYR A 1 243 ? 15.45800 21.49900  14.38900  1.000 15.96000 ?  247 TYR A HE1  1 
ATOM   3630 H  HE2  . TYR A 1 243 ? 12.34900 19.00000  14.66100  1.000 14.84000 ?  247 TYR A HE2  1 
ATOM   3631 H  HH   . TYR A 1 243 ? 13.15400 20.17800  16.42000  1.000 16.33000 ?  247 TYR A HH   1 
ATOM   3632 N  N    . ALA A 1 244 ? 17.19100 20.05800  9.39200   1.000 12.28042 ?  248 ALA A N    1 
ATOM   3633 C  CA   . ALA A 1 244 ? 18.46500 20.74800  9.36400   1.000 12.89628 ?  248 ALA A CA   1 
ATOM   3634 C  C    . ALA A 1 244 ? 18.38000 22.05800  8.61200   1.000 12.64362 ?  248 ALA A C    1 
ATOM   3635 O  O    . ALA A 1 244 ? 17.55900 22.24300  7.70500   1.000 13.22001 ?  248 ALA A O    1 
ATOM   3636 C  CB   . ALA A 1 244 ? 19.55600 19.88600  8.71600   1.000 13.13052 ?  248 ALA A CB   1 
ATOM   3637 H  H    . ALA A 1 244 ? 16.66100 20.25000  8.74200   1.000 14.73000 ?  248 ALA A H    1 
ATOM   3638 H  HA   . ALA A 1 244 ? 18.68800 20.95200  10.28600  1.000 15.47000 ?  248 ALA A HA   1 
ATOM   3639 H  HB1  . ALA A 1 244 ? 20.39300 20.37700  8.72300   1.000 15.75000 ?  248 ALA A HB1  1 
ATOM   3640 H  HB2  . ALA A 1 244 ? 19.65100 19.06400  9.22200   1.000 15.75000 ?  248 ALA A HB2  1 
ATOM   3641 H  HB3  . ALA A 1 244 ? 19.29800 19.68500  7.80300   1.000 15.75000 ?  248 ALA A HB3  1 
ATOM   3642 N  N    A VAL A 1 245 ? 19.25200 22.97200  9.01300   0.630 12.75153 ?  249 VAL A N    1 
ATOM   3643 N  N    B VAL A 1 245 ? 19.31000 22.94200  8.96200   0.370 13.10420 ?  249 VAL A N    1 
ATOM   3644 C  CA   A VAL A 1 245 ? 19.62900 24.11100  8.19500   0.630 13.49372 ?  249 VAL A CA   1 
ATOM   3645 C  CA   B VAL A 1 245 ? 19.61300 24.14500  8.20200   0.370 14.05695 ?  249 VAL A CA   1 
ATOM   3646 C  C    A VAL A 1 245 ? 21.04400 23.85500  7.71600   0.630 13.46214 ?  249 VAL A C    1 
ATOM   3647 C  C    B VAL A 1 245 ? 21.06700 24.02800  7.75200   0.370 14.45173 ?  249 VAL A C    1 
ATOM   3648 O  O    A VAL A 1 245 ? 21.90100 23.39200  8.48400   0.630 12.70679 ?  249 VAL A O    1 
ATOM   3649 O  O    B VAL A 1 245 ? 21.96700 23.80200  8.57500   0.370 14.75177 ?  249 VAL A O    1 
ATOM   3650 C  CB   A VAL A 1 245 ? 19.52900 25.45500  8.93500   0.630 15.23867 ?  249 VAL A CB   1 
ATOM   3651 C  CB   B VAL A 1 245 ? 19.34000 25.41800  9.01900   0.370 14.96232 ?  249 VAL A CB   1 
ATOM   3652 C  CG1  A VAL A 1 245 ? 19.76400 26.60100  7.97100   0.630 16.11246 ?  249 VAL A CG1  1 
ATOM   3653 C  CG1  B VAL A 1 245 ? 19.96500 25.33400  10.41300  0.370 14.59122 ?  249 VAL A CG1  1 
ATOM   3654 C  CG2  A VAL A 1 245 ? 18.17100 25.58500  9.57300   0.630 15.36763 ?  249 VAL A CG2  1 
ATOM   3655 C  CG2  B VAL A 1 245 ? 19.80100 26.65700  8.26600   0.370 15.69136 ?  249 VAL A CG2  1 
ATOM   3656 H  H    A VAL A 1 245 ? 19.64800 22.95200  9.77700   0.630 15.30000 ?  249 VAL A H    1 
ATOM   3657 H  H    B VAL A 1 245 ? 19.79800 22.86000  9.66500   0.370 15.72000 ?  249 VAL A H    1 
ATOM   3658 H  HA   A VAL A 1 245 ? 19.02400 24.17500  7.43900   0.630 16.19000 ?  249 VAL A HA   1 
ATOM   3659 H  HA   B VAL A 1 245 ? 19.06100 24.20000  7.40700   0.370 16.87000 ?  249 VAL A HA   1 
ATOM   3660 H  HB   A VAL A 1 245 ? 20.20800 25.49300  9.62700   0.630 18.28000 ?  249 VAL A HB   1 
ATOM   3661 H  HB   B VAL A 1 245 ? 18.38200 25.49800  9.14600   0.370 17.95000 ?  249 VAL A HB   1 
ATOM   3662 H  HG11 A VAL A 1 245 ? 19.57300 27.43800  8.42300   0.630 19.33000 ?  249 VAL A HG11 1 
ATOM   3663 H  HG11 B VAL A 1 245 ? 19.82100 26.17500  10.87500  0.370 17.51000 ?  249 VAL A HG11 1 
ATOM   3664 H  HG12 A VAL A 1 245 ? 20.68900 26.58500  7.68000   0.630 19.33000 ?  249 VAL A HG12 1 
ATOM   3665 H  HG12 B VAL A 1 245 ? 19.54600 24.61100  10.90400  0.370 17.51000 ?  249 VAL A HG12 1 
ATOM   3666 H  HG13 A VAL A 1 245 ? 19.17500 26.49600  7.20700   0.630 19.33000 ?  249 VAL A HG13 1 
ATOM   3667 H  HG13 B VAL A 1 245 ? 20.91600 25.16600  10.32300  0.370 17.51000 ?  249 VAL A HG13 1 
ATOM   3668 H  HG21 A VAL A 1 245 ? 18.12500 26.42900  10.05000  0.630 18.44000 ?  249 VAL A HG21 1 
ATOM   3669 H  HG21 B VAL A 1 245 ? 19.52300 27.44600  8.75700   0.370 18.82000 ?  249 VAL A HG21 1 
ATOM   3670 H  HG22 A VAL A 1 245 ? 17.49200 25.55900  8.88100   0.630 18.44000 ?  249 VAL A HG22 1 
ATOM   3671 H  HG22 B VAL A 1 245 ? 20.76800 26.63800  8.18900   0.370 18.82000 ?  249 VAL A HG22 1 
ATOM   3672 H  HG23 A VAL A 1 245 ? 18.04100 24.84900  10.19100  0.630 18.44000 ?  249 VAL A HG23 1 
ATOM   3673 H  HG23 B VAL A 1 245 ? 19.39800 26.65800  7.38400   0.370 18.82000 ?  249 VAL A HG23 1 
ATOM   3674 N  N    . VAL A 1 246 ? 21.28200 24.13800  6.44100   1.000 14.69387 ?  250 VAL A N    1 
ATOM   3675 C  CA   . VAL A 1 246 ? 22.55500 23.86900  5.78100   1.000 14.65439 ?  250 VAL A CA   1 
ATOM   3676 C  C    . VAL A 1 246 ? 22.99800 25.14300  5.08400   1.000 14.91495 ?  250 VAL A C    1 
ATOM   3677 O  O    . VAL A 1 246 ? 22.20000 25.77900  4.38700   1.000 16.09930 ?  250 VAL A O    1 
ATOM   3678 C  CB   . VAL A 1 246 ? 22.37700 22.74600  4.73900   1.000 15.40974 ?  250 VAL A CB   1 
ATOM   3679 C  CG1  . VAL A 1 246 ? 23.66600 22.50500  3.96200   1.000 16.68095 ?  250 VAL A CG1  1 
ATOM   3680 C  CG2  . VAL A 1 246 ? 21.88600 21.46600  5.39900   1.000 16.67568 ?  250 VAL A CG2  1 
ATOM   3681 H  H    A VAL A 1 246 ? 20.70200 24.50000  5.91900   0.630 17.63000 ?  250 VAL A H    1 
ATOM   3682 H  H    B VAL A 1 246 ? 20.67200 24.38100  5.88500   0.370 17.63000 ?  250 VAL A H    1 
ATOM   3683 H  HA   . VAL A 1 246 ? 23.22700 23.61700  6.43400   1.000 17.58000 ?  250 VAL A HA   1 
ATOM   3684 H  HB   . VAL A 1 246 ? 21.70200 23.02600  4.10100   1.000 18.49000 ?  250 VAL A HB   1 
ATOM   3685 H  HG11 . VAL A 1 246 ? 23.58600 21.67600  3.46500   1.000 20.02000 ?  250 VAL A HG11 1 
ATOM   3686 H  HG12 . VAL A 1 246 ? 23.80900 23.24500  3.35100   1.000 20.02000 ?  250 VAL A HG12 1 
ATOM   3687 H  HG13 . VAL A 1 246 ? 24.40500 22.44600  4.58800   1.000 20.02000 ?  250 VAL A HG13 1 
ATOM   3688 H  HG21 . VAL A 1 246 ? 21.77900 20.78100  4.72000   1.000 20.01000 ?  250 VAL A HG21 1 
ATOM   3689 H  HG22 . VAL A 1 246 ? 22.53900 21.18000  6.05700   1.000 20.01000 ?  250 VAL A HG22 1 
ATOM   3690 H  HG23 . VAL A 1 246 ? 21.03500 21.63900  5.83000   1.000 20.01000 ?  250 VAL A HG23 1 
ATOM   3691 N  N    . TRP A 1 247 ? 24.26200 25.51500  5.26500   1.000 15.37553 ?  251 TRP A N    1 
ATOM   3692 C  CA   . TRP A 1 247 ? 24.82200 26.68500  4.60100   1.000 16.57567 ?  251 TRP A CA   1 
ATOM   3693 C  C    . TRP A 1 247 ? 25.86400 26.23200  3.58300   1.000 16.90992 ?  251 TRP A C    1 
ATOM   3694 O  O    . TRP A 1 247 ? 27.05700 26.12800  3.91200   1.000 18.27324 ?  251 TRP A O    1 
ATOM   3695 C  CB   . TRP A 1 247 ? 25.45500 27.62000  5.62800   1.000 17.84424 ?  251 TRP A CB   1 
ATOM   3696 C  CG   . TRP A 1 247 ? 24.48800 28.36500  6.49800   1.000 18.29693 ?  251 TRP A CG   1 
ATOM   3697 C  CD1  . TRP A 1 247 ? 24.01500 29.62600  6.30100   1.000 19.03386 ?  251 TRP A CD1  1 
ATOM   3698 C  CD2  . TRP A 1 247 ? 23.89400 27.90300  7.72400   1.000 17.91004 ?  251 TRP A CD2  1 
ATOM   3699 N  NE1  . TRP A 1 247 ? 23.16200 29.97800  7.31900   1.000 19.04439 ?  251 TRP A NE1  1 
ATOM   3700 C  CE2  . TRP A 1 247 ? 23.06900 28.94100  8.20900   1.000 18.19429 ?  251 TRP A CE2  1 
ATOM   3701 C  CE3  . TRP A 1 247 ? 23.97800 26.71500  8.45400   1.000 17.82845 ?  251 TRP A CE3  1 
ATOM   3702 C  CZ2  . TRP A 1 247 ? 22.33200 28.82500  9.39100   1.000 18.78646 ?  251 TRP A CZ2  1 
ATOM   3703 C  CZ3  . TRP A 1 247 ? 23.25800 26.61300  9.63800   1.000 18.51538 ?  251 TRP A CZ3  1 
ATOM   3704 C  CH2  . TRP A 1 247 ? 22.44900 27.65600  10.08300  1.000 18.09954 ?  251 TRP A CH2  1 
ATOM   3705 H  H    . TRP A 1 247 ? 24.81800 25.10000  5.77300   1.000 18.45000 ?  251 TRP A H    1 
ATOM   3706 H  HA   . TRP A 1 247 ? 24.11700 27.15700  4.13100   1.000 19.89000 ?  251 TRP A HA   1 
ATOM   3707 H  HB2  . TRP A 1 247 ? 26.02300 27.09400  6.21100   1.000 21.41000 ?  251 TRP A HB2  1 
ATOM   3708 H  HB3  . TRP A 1 247 ? 25.98600 28.28000  5.15500   1.000 21.41000 ?  251 TRP A HB3  1 
ATOM   3709 H  HD1  . TRP A 1 247 ? 24.23700 30.17100  5.58000   1.000 22.84000 ?  251 TRP A HD1  1 
ATOM   3710 H  HE1  . TRP A 1 247 ? 22.75100 30.73000  7.38700   1.000 22.85000 ?  251 TRP A HE1  1 
ATOM   3711 H  HE3  . TRP A 1 247 ? 24.50300 26.00900  8.15400   1.000 21.39000 ?  251 TRP A HE3  1 
ATOM   3712 H  HZ2  . TRP A 1 247 ? 21.78600 29.51500  9.69300   1.000 22.54000 ?  251 TRP A HZ2  1 
ATOM   3713 H  HZ3  . TRP A 1 247 ? 23.31900 25.83400  10.14300  1.000 22.22000 ?  251 TRP A HZ3  1 
ATOM   3714 H  HH2  . TRP A 1 247 ? 21.97300 27.55100  10.87500  1.000 21.72000 ?  251 TRP A HH2  1 
ATOM   3715 N  N    . PRO A 1 248 ? 25.47900 25.94000  2.33800   1.000 17.14416 ?  252 PRO A N    1 
ATOM   3716 C  CA   . PRO A 1 248 ? 26.49500 25.67900  1.30700   1.000 17.88636 ?  252 PRO A CA   1 
ATOM   3717 C  C    . PRO A 1 248 ? 27.29600 26.95200  1.11500   1.000 19.26547 ?  252 PRO A C    1 
ATOM   3718 O  O    . PRO A 1 248 ? 26.77800 28.05400  1.24200   1.000 23.21068 ?  252 PRO A O    1 
ATOM   3719 C  CB   . PRO A 1 248 ? 25.67000 25.35700  0.05000   1.000 18.81278 ?  252 PRO A CB   1 
ATOM   3720 C  CG   . PRO A 1 248 ? 24.24400 25.25500  0.50300   1.000 19.06808 ?  252 PRO A CG   1 
ATOM   3721 C  CD   . PRO A 1 248 ? 24.13200 26.07200  1.76000   1.000 17.81793 ?  252 PRO A CD   1 
ATOM   3722 H  HA   . PRO A 1 248 ? 27.05600 24.91600  1.51700   1.000 21.46000 ?  252 PRO A HA   1 
ATOM   3723 H  HB2  . PRO A 1 248 ? 25.77400 26.07100  -0.59900  1.000 22.57000 ?  252 PRO A HB2  1 
ATOM   3724 H  HB3  . PRO A 1 248 ? 25.97000 24.51700  -0.33000  1.000 22.57000 ?  252 PRO A HB3  1 
ATOM   3725 H  HG2  . PRO A 1 248 ? 23.66000 25.60700  -0.18600  1.000 22.88000 ?  252 PRO A HG2  1 
ATOM   3726 H  HG3  . PRO A 1 248 ? 24.02600 24.32600  0.68000   1.000 22.88000 ?  252 PRO A HG3  1 
ATOM   3727 H  HD2  . PRO A 1 248 ? 23.92800 26.99900  1.55700   1.000 21.38000 ?  252 PRO A HD2  1 
ATOM   3728 H  HD3  . PRO A 1 248 ? 23.45800 25.70700  2.35500   1.000 21.38000 ?  252 PRO A HD3  1 
ATOM   3729 N  N    . THR A 1 249 ? 28.56900 26.81400  0.78600   1.000 16.58357 ?  253 THR A N    1 
ATOM   3730 C  CA   . THR A 1 249 ? 29.36900 28.00200  0.54400   1.000 16.38354 ?  253 THR A CA   1 
ATOM   3731 C  C    . THR A 1 249 ? 28.93100 28.64600  -0.75900  1.000 16.98362 ?  253 THR A C    1 
ATOM   3732 O  O    . THR A 1 249 ? 28.57000 27.96600  -1.72000  1.000 17.66001 ?  253 THR A O    1 
ATOM   3733 C  CB   . THR A 1 249 ? 30.86700 27.69500  0.56400   1.000 15.76768 ?  253 THR A CB   1 
ATOM   3734 O  OG1  . THR A 1 249 ? 31.20800 26.89200  -0.55600  1.000 15.14655 ?  253 THR A OG1  1 
ATOM   3735 C  CG2  . THR A 1 249 ? 31.24700 26.94000  1.84200   1.000 16.80991 ?  253 THR A CG2  1 
ATOM   3736 H  H    . THR A 1 249 ? 28.98200 26.06500  0.69800   1.000 19.90000 ?  253 THR A H    1 
ATOM   3737 H  HA   . THR A 1 249 ? 29.23400 28.64400  1.25900   1.000 19.66000 ?  253 THR A HA   1 
ATOM   3738 H  HB   . THR A 1 249 ? 31.36200 28.52900  0.53500   1.000 18.92000 ?  253 THR A HB   1 
ATOM   3739 H  HG1  . THR A 1 249 ? 30.81800 26.15000  -0.50800  1.000 18.17000 ?  253 THR A HG1  1 
ATOM   3740 H  HG21 . THR A 1 249 ? 32.13900 27.19400  2.12500   1.000 20.17000 ?  253 THR A HG21 1 
ATOM   3741 H  HG22 . THR A 1 249 ? 30.61900 27.15200  2.55100   1.000 20.17000 ?  253 THR A HG22 1 
ATOM   3742 H  HG23 . THR A 1 249 ? 31.22800 25.98400  1.68000   1.000 20.17000 ?  253 THR A HG23 1 
ATOM   3743 N  N    . GLY A 1 250 ? 28.90500 29.96500  -0.77200  1.000 18.80489 ?  254 GLY A N    1 
ATOM   3744 C  CA   . GLY A 1 250 ? 28.66500 30.67100  -2.00200  1.000 19.81553 ?  254 GLY A CA   1 
ATOM   3745 C  C    . GLY A 1 250 ? 27.22100 30.76400  -2.46400  1.000 20.33139 ?  254 GLY A C    1 
ATOM   3746 O  O    . GLY A 1 250 ? 26.98400 31.31300  -3.54500  1.000 22.33689 ?  254 GLY A O    1 
ATOM   3747 H  H    . GLY A 1 250 ? 29.02400 30.46600  -0.08300  1.000 22.56000 ?  254 GLY A H    1 
ATOM   3748 H  HA2  . GLY A 1 250 ? 28.99400 31.57800  -1.90100  1.000 23.78000 ?  254 GLY A HA2  1 
ATOM   3749 H  HA3  . GLY A 1 250 ? 29.16500 30.23100  -2.70700  1.000 23.78000 ?  254 GLY A HA3  1 
ATOM   3750 N  N    . ARG A 1 251 ? 26.25100 30.25000  -1.70600  1.000 19.34179 ?  255 ARG A N    1 
ATOM   3751 C  CA   . ARG A 1 251 ? 24.84200 30.37300  -2.07700  1.000 19.41549 ?  255 ARG A CA   1 
ATOM   3752 C  C    . ARG A 1 251 ? 24.01200 30.44200  -0.80000  1.000 18.93122 ?  255 ARG A C    1 
ATOM   3753 O  O    . ARG A 1 251 ? 24.53100 30.31500  0.30300   1.000 19.05755 ?  255 ARG A O    1 
ATOM   3754 C  CB   . ARG A 1 251 ? 24.39600 29.24600  -3.00400  1.000 20.08662 ?  255 ARG A CB   1 
ATOM   3755 C  CG   . ARG A 1 251 ? 24.54700 27.86000  -2.41100  1.000 21.16043 ?  255 ARG A CG   1 
ATOM   3756 C  CD   . ARG A 1 251 ? 24.16600 26.76900  -3.39400  1.000 23.00276 ?  255 ARG A CD   1 
ATOM   3757 N  NE   . ARG A 1 251 ? 22.78000 26.88000  -3.82000  1.000 23.55019 ?  255 ARG A NE   1 
ATOM   3758 C  CZ   . ARG A 1 251 ? 22.27800 26.35300  -4.92900  1.000 25.00563 ?  255 ARG A CZ   1 
ATOM   3759 N  NH1  . ARG A 1 251 ? 23.02600 25.67500  -5.77600  1.000 25.94522 ?  255 ARG A NH1  1 
ATOM   3760 N  NH2  . ARG A 1 251 ? 20.98900 26.53100  -5.20600  1.000 26.11892 ?  255 ARG A NH2  1 
ATOM   3761 H  H    . ARG A 1 251 ? 26.38500 29.82500  -0.97000  1.000 23.21000 ?  255 ARG A H    1 
ATOM   3762 H  HA   . ARG A 1 251 ? 24.71700 31.20300  -2.56100  1.000 23.30000 ?  255 ARG A HA   1 
ATOM   3763 H  HB2  . ARG A 1 251 ? 23.45900 29.37400  -3.21900  1.000 24.10000 ?  255 ARG A HB2  1 
ATOM   3764 H  HB3  . ARG A 1 251 ? 24.93000 29.28000  -3.81300  1.000 24.10000 ?  255 ARG A HB3  1 
ATOM   3765 H  HG2  . ARG A 1 251 ? 25.47200 27.72400  -2.15200  1.000 25.39000 ?  255 ARG A HG2  1 
ATOM   3766 H  HG3  . ARG A 1 251 ? 23.97100 27.78100  -1.63500  1.000 25.39000 ?  255 ARG A HG3  1 
ATOM   3767 H  HD2  . ARG A 1 251 ? 24.73100 26.83600  -4.18000  1.000 27.60000 ?  255 ARG A HD2  1 
ATOM   3768 H  HD3  . ARG A 1 251 ? 24.28600 25.90400  -2.97300  1.000 27.60000 ?  255 ARG A HD3  1 
ATOM   3769 H  HE   . ARG A 1 251 ? 22.24400 27.32200  -3.31300  1.000 28.26000 ?  255 ARG A HE   1 
ATOM   3770 H  HH11 . ARG A 1 251 ? 23.86400 25.56400  -5.61600  1.000 31.13000 ?  255 ARG A HH11 1 
ATOM   3771 H  HH12 . ARG A 1 251 ? 22.67600 25.34300  -6.48800  1.000 31.13000 ?  255 ARG A HH12 1 
ATOM   3772 H  HH21 . ARG A 1 251 ? 20.49200 26.98300  -4.66900  1.000 31.34000 ?  255 ARG A HH21 1 
ATOM   3773 H  HH22 . ARG A 1 251 ? 20.65200 26.19300  -5.92200  1.000 31.34000 ?  255 ARG A HH22 1 
ATOM   3774 N  N    . ALA A 1 252 ? 22.70900 30.65600  -0.95300  1.000 18.40484 ?  256 ALA A N    1 
ATOM   3775 C  CA   . ALA A 1 252 ? 21.82700 30.84300  0.18300   1.000 17.90478 ?  256 ALA A CA   1 
ATOM   3776 C  C    . ALA A 1 252 ? 21.59600 29.53500  0.92700   1.000 16.55462 ?  256 ALA A C    1 
ATOM   3777 O  O    . ALA A 1 252 ? 21.71400 28.45200  0.36300   1.000 16.47040 ?  256 ALA A O    1 
ATOM   3778 C  CB   . ALA A 1 252 ? 20.50100 31.41400  -0.30300  1.000 19.11282 ?  256 ALA A CB   1 
ATOM   3779 H  H    . ALA A 1 252 ? 22.31000 30.69700  -1.71400  1.000 22.08000 ?  256 ALA A H    1 
ATOM   3780 H  HA   . ALA A 1 252 ? 22.23000 31.46100  0.81300   1.000 21.48000 ?  256 ALA A HA   1 
ATOM   3781 H  HB1  . ALA A 1 252 ? 19.90800 31.52600  0.45600   1.000 22.93000 ?  256 ALA A HB1  1 
ATOM   3782 H  HB2  . ALA A 1 252 ? 20.66300 32.27200  -0.72600  1.000 22.93000 ?  256 ALA A HB2  1 
ATOM   3783 H  HB3  . ALA A 1 252 ? 20.10800 30.79900  -0.94200  1.000 22.93000 ?  256 ALA A HB3  1 
ATOM   3784 N  N    . PRO A 1 253 ? 21.27100 29.61500  2.20800   1.000 16.78886 ?  257 PRO A N    1 
ATOM   3785 C  CA   . PRO A 1 253 ? 21.04400 28.38100  2.96400   1.000 16.27300 ?  257 PRO A CA   1 
ATOM   3786 C  C    . PRO A 1 253 ? 19.83600 27.58900  2.48700   1.000 15.20972 ?  257 PRO A C    1 
ATOM   3787 O  O    . PRO A 1 253 ? 18.91600 28.10700  1.85000   1.000 15.95981 ?  257 PRO A O    1 
ATOM   3788 C  CB   . PRO A 1 253 ? 20.90100 28.84800  4.42000   1.000 18.36536 ?  257 PRO A CB   1 
ATOM   3789 C  CG   . PRO A 1 253 ? 20.68400 30.29600  4.35900   1.000 19.85238 ?  257 PRO A CG   1 
ATOM   3790 C  CD   . PRO A 1 253 ? 21.25300 30.80800  3.07800   1.000 18.37852 ?  257 PRO A CD   1 
ATOM   3791 H  HA   . PRO A 1 253 ? 21.82500 27.80900  2.89100   1.000 19.52000 ?  257 PRO A HA   1 
ATOM   3792 H  HB2  . PRO A 1 253 ? 20.14300 28.40400  4.83200   1.000 22.03000 ?  257 PRO A HB2  1 
ATOM   3793 H  HB3  . PRO A 1 253 ? 21.71200 28.64300  4.91000   1.000 22.03000 ?  257 PRO A HB3  1 
ATOM   3794 H  HG2  . PRO A 1 253 ? 19.73100 30.47500  4.39600   1.000 23.82000 ?  257 PRO A HG2  1 
ATOM   3795 H  HG3  . PRO A 1 253 ? 21.12900 30.71500  5.11300   1.000 23.82000 ?  257 PRO A HG3  1 
ATOM   3796 H  HD2  . PRO A 1 253 ? 20.68700 31.50000  2.70200   1.000 22.05000 ?  257 PRO A HD2  1 
ATOM   3797 H  HD3  . PRO A 1 253 ? 22.15100 31.15000  3.21200   1.000 22.05000 ?  257 PRO A HD3  1 
ATOM   3798 N  N    . ILE A 1 254 ? 19.88400 26.30300  2.80300   1.000 14.40173 ?  258 ILE A N    1 
ATOM   3799 C  CA   . ILE A 1 254 ? 18.81700 25.34500  2.52400   1.000 14.44910 ?  258 ILE A CA   1 
ATOM   3800 C  C    . ILE A 1 254 ? 18.25600 24.88000  3.86100   1.000 13.95167 ?  258 ILE A C    1 
ATOM   3801 O  O    . ILE A 1 254 ? 19.01700 24.59700  4.79100   1.000 14.79125 ?  258 ILE A O    1 
ATOM   3802 C  CB   . ILE A 1 254 ? 19.40300 24.12200  1.78600   1.000 15.92296 ?  258 ILE A CB   1 
ATOM   3803 C  CG1  . ILE A 1 254 ? 20.24600 24.54800  0.58700   1.000 18.63908 ?  258 ILE A CG1  1 
ATOM   3804 C  CG2  . ILE A 1 254 ? 18.31600 23.12600  1.42300   1.000 16.15720 ?  258 ILE A CG2  1 
ATOM   3805 C  CD1  . ILE A 1 254 ? 19.54300 25.32500  -0.41600  1.000 20.24716 ?  258 ILE A CD1  1 
ATOM   3806 H  H    . ILE A 1 254 ? 20.55600 25.94100  3.20000   1.000 17.28000 ?  258 ILE A H    1 
ATOM   3807 H  HA   . ILE A 1 254 ? 18.11800 25.76200  1.99600   1.000 17.34000 ?  258 ILE A HA   1 
ATOM   3808 H  HB   . ILE A 1 254 ? 20.00500 23.66400  2.39400   1.000 19.10000 ?  258 ILE A HB   1 
ATOM   3809 H  HG12 . ILE A 1 254 ? 20.98400 25.09000  0.90800   1.000 22.37000 ?  258 ILE A HG12 1 
ATOM   3810 H  HG13 . ILE A 1 254 ? 20.58500 23.75100  0.15100   1.000 22.37000 ?  258 ILE A HG13 1 
ATOM   3811 H  HG21 . ILE A 1 254 ? 18.69200 22.44700  0.84100   1.000 19.39000 ?  258 ILE A HG21 1 
ATOM   3812 H  HG22 . ILE A 1 254 ? 17.97900 22.71600  2.23500   1.000 19.39000 ?  258 ILE A HG22 1 
ATOM   3813 H  HG23 . ILE A 1 254 ? 17.60000 23.59300  0.96600   1.000 19.39000 ?  258 ILE A HG23 1 
ATOM   3814 H  HD11 . ILE A 1 254 ? 20.13200 25.47200  -1.17200  1.000 24.29000 ?  258 ILE A HD11 1 
ATOM   3815 H  HD12 . ILE A 1 254 ? 18.75600 24.83500  -0.70000  1.000 24.29000 ?  258 ILE A HD12 1 
ATOM   3816 H  HD13 . ILE A 1 254 ? 19.28200 26.17600  -0.03000  1.000 24.29000 ?  258 ILE A HD13 1 
ATOM   3817 N  N    A VAL A 1 255 ? 16.93400 24.77500  3.94900   0.830 13.47530 ?  259 VAL A N    1 
ATOM   3818 N  N    B VAL A 1 255 ? 16.93900 24.78300  3.95900   0.170 13.58584 ?  259 VAL A N    1 
ATOM   3819 C  CA   A VAL A 1 255 ? 16.27300 24.22800  5.12500   0.830 13.39897 ?  259 VAL A CA   1 
ATOM   3820 C  CA   B VAL A 1 255 ? 16.28300 24.22500  5.13700   0.170 13.29370 ?  259 VAL A CA   1 
ATOM   3821 C  C    A VAL A 1 255 ? 15.54300 22.97200  4.67800   0.830 12.99366 ?  259 VAL A C    1 
ATOM   3822 C  C    B VAL A 1 255 ? 15.52800 22.98300  4.69300   0.170 13.08841 ?  259 VAL A C    1 
ATOM   3823 O  O    A VAL A 1 255 ? 14.89100 22.97500  3.62600   0.830 14.55174 ?  259 VAL A O    1 
ATOM   3824 O  O    B VAL A 1 255 ? 14.85300 23.00300  3.65800   0.170 13.51215 ?  259 VAL A O    1 
ATOM   3825 C  CB   A VAL A 1 255 ? 15.31500 25.25500  5.75000   0.830 14.56227 ?  259 VAL A CB   1 
ATOM   3826 C  CB   B VAL A 1 255 ? 15.36000 25.25800  5.81100   0.170 13.36213 ?  259 VAL A CB   1 
ATOM   3827 C  CG1  A VAL A 1 255 ? 14.77900 24.75400  7.07400   0.830 16.47303 ?  259 VAL A CG1  1 
ATOM   3828 C  CG1  B VAL A 1 255 ? 14.25800 25.69400  4.86700   0.170 13.14105 ?  259 VAL A CG1  1 
ATOM   3829 C  CG2  A VAL A 1 255 ? 16.01600 26.60400  5.94400   0.830 15.14655 ?  259 VAL A CG2  1 
ATOM   3830 C  CG2  B VAL A 1 255 ? 14.78200 24.70200  7.10300   0.170 13.97536 ?  259 VAL A CG2  1 
ATOM   3831 H  H    A VAL A 1 255 ? 16.39000 25.01900  3.32900   0.830 16.17000 ?  259 VAL A H    1 
ATOM   3832 H  H    B VAL A 1 255 ? 16.39200 25.03700  3.34600   0.170 16.30000 ?  259 VAL A H    1 
ATOM   3833 H  HA   A VAL A 1 255 ? 16.92100 23.98200  5.80400   0.830 16.08000 ?  259 VAL A HA   1 
ATOM   3834 H  HA   B VAL A 1 255 ? 16.94100 23.95400  5.79600   0.170 15.95000 ?  259 VAL A HA   1 
ATOM   3835 H  HB   A VAL A 1 255 ? 14.56700 25.38100  5.14500   0.830 17.47000 ?  259 VAL A HB   1 
ATOM   3836 H  HB   B VAL A 1 255 ? 15.88400 26.04200  6.03400   0.170 16.03000 ?  259 VAL A HB   1 
ATOM   3837 H  HG11 A VAL A 1 255 ? 14.03800 25.31600  7.34800   0.830 19.76000 ?  259 VAL A HG11 1 
ATOM   3838 H  HG11 B VAL A 1 255 ? 13.60600 26.21400  5.36200   0.170 15.77000 ?  259 VAL A HG11 1 
ATOM   3839 H  HG12 A VAL A 1 255 ? 14.47800 23.83800  6.96600   0.830 19.76000 ?  259 VAL A HG12 1 
ATOM   3840 H  HG12 B VAL A 1 255 ? 14.64400 26.23500  4.16000   0.170 15.77000 ?  259 VAL A HG12 1 
ATOM   3841 H  HG13 A VAL A 1 255 ? 15.48700 24.79300  7.73600   0.830 19.76000 ?  259 VAL A HG13 1 
ATOM   3842 H  HG13 B VAL A 1 255 ? 13.83700 24.90700  4.48800   0.170 15.77000 ?  259 VAL A HG13 1 
ATOM   3843 H  HG21 A VAL A 1 255 ? 15.42300 27.20200  6.42500   0.830 18.17000 ?  259 VAL A HG21 1 
ATOM   3844 H  HG21 B VAL A 1 255 ? 14.07800 25.29200  7.41300   0.170 16.77000 ?  259 VAL A HG21 1 
ATOM   3845 H  HG22 A VAL A 1 255 ? 16.83000 26.46600  6.45300   0.830 18.17000 ?  259 VAL A HG22 1 
ATOM   3846 H  HG22 B VAL A 1 255 ? 14.42200 23.81700  6.93300   0.170 16.77000 ?  259 VAL A HG22 1 
ATOM   3847 H  HG23 A VAL A 1 255 ? 16.22900 26.97700  5.07500   0.830 18.17000 ?  259 VAL A HG23 1 
ATOM   3848 H  HG23 B VAL A 1 255 ? 15.48700 24.65000  7.76700   0.170 16.77000 ?  259 VAL A HG23 1 
ATOM   3849 N  N    . LEU A 1 256 ? 15.66200 21.89700  5.44900   1.000 12.75679 ?  260 LEU A N    1 
ATOM   3850 C  CA   . LEU A 1 256 ? 14.98800 20.67100  5.04700   1.000 12.74890 ?  260 LEU A CA   1 
ATOM   3851 C  C    . LEU A 1 256 ? 14.62400 19.78600  6.22000   1.000 12.45412 ?  260 LEU A C    1 
ATOM   3852 O  O    . LEU A 1 256 ? 15.22000 19.85800  7.30100   1.000 12.99366 ?  260 LEU A O    1 
ATOM   3853 C  CB   . LEU A 1 256 ? 15.77800 19.88300  3.99800   1.000 13.44898 ?  260 LEU A CB   1 
ATOM   3854 C  CG   . LEU A 1 256 ? 17.03200 19.13300  4.44000   1.000 14.38067 ?  260 LEU A CG   1 
ATOM   3855 C  CD1  . LEU A 1 256 ? 17.46200 18.09900  3.40000   1.000 15.85716 ?  260 LEU A CD1  1 
ATOM   3856 C  CD2  . LEU A 1 256 ? 18.21100 20.07300  4.72300   1.000 15.35447 ?  260 LEU A CD2  1 
ATOM   3857 H  H    A LEU A 1 256 ? 16.11000 21.85400  6.18200   0.830 15.31000 ?  260 LEU A H    1 
ATOM   3858 H  H    B LEU A 1 256 ? 16.12200 21.84800  6.17400   0.170 15.31000 ?  260 LEU A H    1 
ATOM   3859 H  HA   . LEU A 1 256 ? 14.14200 20.94700  4.65900   1.000 15.30000 ?  260 LEU A HA   1 
ATOM   3860 H  HB2  . LEU A 1 256 ? 15.18000 19.22100  3.61800   1.000 16.14000 ?  260 LEU A HB2  1 
ATOM   3861 H  HB3  . LEU A 1 256 ? 16.05900 20.50900  3.31200   1.000 16.14000 ?  260 LEU A HB3  1 
ATOM   3862 H  HG   . LEU A 1 256 ? 16.80100 18.68000  5.26600   1.000 17.26000 ?  260 LEU A HG   1 
ATOM   3863 H  HD11 . LEU A 1 256 ? 18.25100 17.63600  3.72300   1.000 19.02000 ?  260 LEU A HD11 1 
ATOM   3864 H  HD12 . LEU A 1 256 ? 16.74000 17.46600  3.26600   1.000 19.02000 ?  260 LEU A HD12 1 
ATOM   3865 H  HD13 . LEU A 1 256 ? 17.66300 18.55300  2.56700   1.000 19.02000 ?  260 LEU A HD13 1 
ATOM   3866 H  HD21 . LEU A 1 256 ? 18.98000 19.54500  4.98700   1.000 18.42000 ?  260 LEU A HD21 1 
ATOM   3867 H  HD22 . LEU A 1 256 ? 18.41400 20.57500  3.91900   1.000 18.42000 ?  260 LEU A HD22 1 
ATOM   3868 H  HD23 . LEU A 1 256 ? 17.96600 20.68000  5.43900   1.000 18.42000 ?  260 LEU A HD23 1 
ATOM   3869 N  N    . ALA A 1 257 ? 13.64300 18.92000  5.95400   1.000 12.14619 ?  261 ALA A N    1 
ATOM   3870 C  CA   . ALA A 1 257 ? 13.12600 17.96800  6.92100   1.000 11.91722 ?  261 ALA A CA   1 
ATOM   3871 C  C    . ALA A 1 257 ? 12.87400 16.63800  6.22400   1.000 12.02513 ?  261 ALA A C    1 
ATOM   3872 O  O    . ALA A 1 257 ? 12.33000 16.59700  5.11100   1.000 12.43307 ?  261 ALA A O    1 
ATOM   3873 C  CB   . ALA A 1 257 ? 11.82500 18.47000  7.55400   1.000 13.12526 ?  261 ALA A CB   1 
ATOM   3874 H  H    . ALA A 1 257 ? 13.25100 18.86700  5.19000   1.000 14.57000 ?  261 ALA A H    1 
ATOM   3875 H  HA   . ALA A 1 257 ? 13.77800 17.83200  7.62600   1.000 14.30000 ?  261 ALA A HA   1 
ATOM   3876 H  HB1  . ALA A 1 257 ? 11.53400 17.83200  8.22400   1.000 15.75000 ?  261 ALA A HB1  1 
ATOM   3877 H  HB2  . ALA A 1 257 ? 11.98700 19.33300  7.96600   1.000 15.75000 ?  261 ALA A HB2  1 
ATOM   3878 H  HB3  . ALA A 1 257 ? 11.15000 18.55500  6.86300   1.000 15.75000 ?  261 ALA A HB3  1 
ATOM   3879 N  N    . VAL A 1 258 ? 13.26200 15.55500  6.89600   1.000 11.56191 ?  262 VAL A N    1 
ATOM   3880 C  CA   . VAL A 1 258 ? 13.07400 14.19500  6.40600   1.000 11.31188 ?  262 VAL A CA   1 
ATOM   3881 C  C    . VAL A 1 258 ? 12.50200 13.37600  7.54900   1.000 11.53559 ?  262 VAL A C    1 
ATOM   3882 O  O    . VAL A 1 258 ? 13.15000 13.23300  8.59500   1.000 12.20409 ?  262 VAL A O    1 
ATOM   3883 C  CB   . VAL A 1 258 ? 14.39400 13.56100  5.94300   1.000 12.80153 ?  262 VAL A CB   1 
ATOM   3884 C  CG1  . VAL A 1 258 ? 14.16100 12.14500  5.48700   1.000 14.08327 ?  262 VAL A CG1  1 
ATOM   3885 C  CG2  . VAL A 1 258 ? 15.04600 14.40600  4.85000   1.000 13.73586 ?  262 VAL A CG2  1 
ATOM   3886 H  H    . VAL A 1 258 ? 13.64900 15.58700  7.66300   1.000 13.87000 ?  262 VAL A H    1 
ATOM   3887 H  HA   . VAL A 1 258 ? 12.44800 14.20600  5.66500   1.000 13.57000 ?  262 VAL A HA   1 
ATOM   3888 H  HB   . VAL A 1 258 ? 15.01300 13.53200  6.69000   1.000 15.36000 ?  262 VAL A HB   1 
ATOM   3889 H  HG11 . VAL A 1 258 ? 14.98100 11.79800  5.10400   1.000 16.89000 ?  262 VAL A HG11 1 
ATOM   3890 H  HG12 . VAL A 1 258 ? 13.89800 11.60600  6.25000   1.000 16.89000 ?  262 VAL A HG12 1 
ATOM   3891 H  HG13 . VAL A 1 258 ? 13.45600 12.14000  4.82000   1.000 16.89000 ?  262 VAL A HG13 1 
ATOM   3892 H  HG21 . VAL A 1 258 ? 15.90000 14.01200  4.61400   1.000 16.48000 ?  262 VAL A HG21 1 
ATOM   3893 H  HG22 . VAL A 1 258 ? 14.46400 14.42300  4.07500   1.000 16.48000 ?  262 VAL A HG22 1 
ATOM   3894 H  HG23 . VAL A 1 258 ? 15.17800 15.30700  5.18400   1.000 16.48000 ?  262 VAL A HG23 1 
ATOM   3895 N  N    . TYR A 1 259 ? 11.30400 12.83700  7.35100   1.000 11.24082 ?  263 TYR A N    1 
ATOM   3896 C  CA   . TYR A 1 259 ? 10.58400 12.05600  8.34900   1.000 11.57507 ?  263 TYR A CA   1 
ATOM   3897 C  C    . TYR A 1 259 ? 10.24500 10.69300  7.75900   1.000 11.56191 ?  263 TYR A C    1 
ATOM   3898 O  O    . TYR A 1 259 ? 9.92500  10.58900  6.57300   1.000 12.12251 ?  263 TYR A O    1 
ATOM   3899 C  CB   . TYR A 1 259 ? 9.28600  12.80300  8.80300   1.000 11.59876 ?  263 TYR A CB   1 
ATOM   3900 C  CG   . TYR A 1 259 ? 9.58100  13.90100  9.79200   1.000 11.25135 ?  263 TYR A CG   1 
ATOM   3901 C  CD1  . TYR A 1 259 ? 10.26800 15.04800  9.43300   1.000 11.63561 ?  263 TYR A CD1  1 
ATOM   3902 C  CD2  . TYR A 1 259 ? 9.22500  13.74800  11.12400  1.000 11.23029 ?  263 TYR A CD2  1 
ATOM   3903 C  CE1  . TYR A 1 259 ? 10.60700 16.01100  10.35500  1.000 11.80931 ?  263 TYR A CE1  1 
ATOM   3904 C  CE2  . TYR A 1 259 ? 9.54500  14.71900  12.06600  1.000 11.05396 ?  263 TYR A CE2  1 
ATOM   3905 C  CZ   . TYR A 1 259 ? 10.25300 15.84800  11.67800  1.000 11.45137 ?  263 TYR A CZ   1 
ATOM   3906 O  OH   . TYR A 1 259 ? 10.64900 16.81700  12.58000  1.000 12.05408 ?  263 TYR A OH   1 
ATOM   3907 H  H    . TYR A 1 259 ? 10.86900 12.91400  6.61300   1.000 13.49000 ?  263 TYR A H    1 
ATOM   3908 H  HA   . TYR A 1 259 ? 11.13400 11.91400  9.13600   1.000 13.89000 ?  263 TYR A HA   1 
ATOM   3909 H  HB2  . TYR A 1 259 ? 8.86000  13.20000  8.02700   1.000 13.91000 ?  263 TYR A HB2  1 
ATOM   3910 H  HB3  . TYR A 1 259 ? 8.68400  12.16900  9.22300   1.000 13.91000 ?  263 TYR A HB3  1 
ATOM   3911 H  HD1  . TYR A 1 259 ? 10.50700 15.17000  8.54200   1.000 13.96000 ?  263 TYR A HD1  1 
ATOM   3912 H  HD2  . TYR A 1 259 ? 8.76600  12.98500  11.39100  1.000 13.47000 ?  263 TYR A HD2  1 
ATOM   3913 H  HE1  . TYR A 1 259 ? 11.07300 16.77000  10.08700  1.000 14.17000 ?  263 TYR A HE1  1 
ATOM   3914 H  HE2  . TYR A 1 259 ? 9.28500  14.61200  12.95200  1.000 13.26000 ?  263 TYR A HE2  1 
ATOM   3915 H  HH   . TYR A 1 259 ? 10.55600 16.53400  13.36500  1.000 14.46000 ?  263 TYR A HH   1 
ATOM   3916 N  N    . THR A 1 260 ? 10.29400 9.65100   8.58800   1.000 11.19608 ?  264 THR A N    1 
ATOM   3917 C  CA   . THR A 1 260 ? 9.90400  8.32300   8.17100   1.000 11.58560 ?  264 THR A CA   1 
ATOM   3918 C  C    . THR A 1 260 ? 8.94100  7.67800   9.15800   1.000 11.96986 ?  264 THR A C    1 
ATOM   3919 O  O    . THR A 1 260 ? 8.89200  8.01800   10.34200  1.000 12.35411 ?  264 THR A O    1 
ATOM   3920 C  CB   . THR A 1 260 ? 11.09600 7.36500   7.96700   1.000 12.39359 ?  264 THR A CB   1 
ATOM   3921 O  OG1  . THR A 1 260 ? 11.60400 6.84600   9.20500   1.000 12.91207 ?  264 THR A OG1  1 
ATOM   3922 C  CG2  . THR A 1 260 ? 12.22800 8.04100   7.23600   1.000 12.73311 ?  264 THR A CG2  1 
ATOM   3923 H  H    . THR A 1 260 ? 10.55400 9.69800   9.40700   1.000 13.43000 ?  264 THR A H    1 
ATOM   3924 H  HA   . THR A 1 260 ? 9.44700  8.43900   7.32300   1.000 13.90000 ?  264 THR A HA   1 
ATOM   3925 H  HB   . THR A 1 260 ? 10.76500 6.62400   7.43700   1.000 14.87000 ?  264 THR A HB   1 
ATOM   3926 H  HG1  . THR A 1 260 ? 11.09200 6.24700   9.49700   1.000 15.49000 ?  264 THR A HG1  1 
ATOM   3927 H  HG21 . THR A 1 260 ? 12.94400 7.40700   7.07400   1.000 15.28000 ?  264 THR A HG21 1 
ATOM   3928 H  HG22 . THR A 1 260 ? 11.91500 8.38600   6.38500   1.000 15.28000 ?  264 THR A HG22 1 
ATOM   3929 H  HG23 . THR A 1 260 ? 12.57300 8.77700   7.76600   1.000 15.28000 ?  264 THR A HG23 1 
ATOM   3930 N  N    A ARG A 1 261 ? 8.17800  6.72400   8.63700   0.450 11.92511 ?  265 ARG A N    1 
ATOM   3931 N  N    B ARG A 1 261 ? 8.18900  6.71800   8.63500   0.550 12.25410 ?  265 ARG A N    1 
ATOM   3932 C  CA   A ARG A 1 261 ? 7.41200  5.78800   9.44600   0.450 12.14093 ?  265 ARG A CA   1 
ATOM   3933 C  CA   B ARG A 1 261 ? 7.37000  5.81000   9.42300   0.550 12.63309 ?  265 ARG A CA   1 
ATOM   3934 C  C    A ARG A 1 261 ? 7.18000  4.54400   8.60600   0.450 12.56203 ?  265 ARG A C    1 
ATOM   3935 C  C    B ARG A 1 261 ? 7.16300  4.55100   8.59800   0.550 12.93839 ?  265 ARG A C    1 
ATOM   3936 O  O    A ARG A 1 261 ? 7.48100  4.51200   7.41200   0.450 13.38055 ?  265 ARG A O    1 
ATOM   3937 O  O    B ARG A 1 261 ? 7.46400  4.51500   7.40400   0.550 13.79902 ?  265 ARG A O    1 
ATOM   3938 C  CB   A ARG A 1 261 ? 6.10300  6.40200   9.95200   0.450 12.71731 ?  265 ARG A CB   1 
ATOM   3939 C  CB   B ARG A 1 261 ? 6.04800  6.46300   9.84000   0.550 14.18854 ?  265 ARG A CB   1 
ATOM   3940 C  CG   A ARG A 1 261 ? 5.14300  6.78600   8.86300   0.450 13.50688 ?  265 ARG A CG   1 
ATOM   3941 C  CG   B ARG A 1 261 ? 5.08600  6.70000   8.70200   0.550 15.84400 ?  265 ARG A CG   1 
ATOM   3942 C  CD   A ARG A 1 261 ? 3.85200  7.30600   9.43800   0.450 15.03865 ?  265 ARG A CD   1 
ATOM   3943 C  CD   B ARG A 1 261 ? 3.76600  7.24100   9.19300   0.550 17.91531 ?  265 ARG A CD   1 
ATOM   3944 N  NE   A ARG A 1 261 ? 3.40800  8.51000   8.74200   0.450 16.85465 ?  265 ARG A NE   1 
ATOM   3945 N  NE   B ARG A 1 261 ? 2.73100  7.12400   8.16900   0.550 18.90490 ?  265 ARG A NE   1 
ATOM   3946 C  CZ   A ARG A 1 261 ? 2.90900  8.52500   7.51000   0.450 17.52315 ?  265 ARG A CZ   1 
ATOM   3947 C  CZ   B ARG A 1 261 ? 2.06600  6.00500   7.90500   0.550 21.77366 ?  265 ARG A CZ   1 
ATOM   3948 N  NH1  A ARG A 1 261 ? 2.75000  7.40800   6.80900   0.450 17.84161 ?  265 ARG A NH1  1 
ATOM   3949 N  NH1  B ARG A 1 261 ? 2.27600  4.89500   8.59600   0.550 22.62113 ?  265 ARG A NH1  1 
ATOM   3950 N  NH2  A ARG A 1 261 ? 2.59400  9.69100   6.95500   0.450 16.91782 ?  265 ARG A NH2  1 
ATOM   3951 N  NH2  B ARG A 1 261 ? 1.16500  6.00100   6.92700   0.550 23.36070 ?  265 ARG A NH2  1 
ATOM   3952 H  H    A ARG A 1 261 ? 8.08500  6.59500   7.79200   0.450 14.31000 ?  265 ARG A H    1 
ATOM   3953 H  H    B ARG A 1 261 ? 8.13400  6.56600   7.79000   0.550 14.70000 ?  265 ARG A H    1 
ATOM   3954 H  HA   A ARG A 1 261 ? 7.92100  5.53600   10.23200  0.450 14.56000 ?  265 ARG A HA   1 
ATOM   3955 H  HA   B ARG A 1 261 ? 7.83100  5.56300   10.24000  0.550 15.15000 ?  265 ARG A HA   1 
ATOM   3956 H  HB2  A ARG A 1 261 ? 5.65700  5.75700   10.52300  0.450 15.25000 ?  265 ARG A HB2  1 
ATOM   3957 H  HB2  B ARG A 1 261 ? 5.60700  5.88600   10.48300  0.550 17.02000 ?  265 ARG A HB2  1 
ATOM   3958 H  HB3  A ARG A 1 261 ? 6.31100  7.20400   10.45600  0.450 15.25000 ?  265 ARG A HB3  1 
ATOM   3959 H  HB3  B ARG A 1 261 ? 6.24200  7.32300   10.24500  0.550 17.02000 ?  265 ARG A HB3  1 
ATOM   3960 H  HG2  A ARG A 1 261 ? 5.53700  7.48300   8.31500   0.450 16.20000 ?  265 ARG A HG2  1 
ATOM   3961 H  HG2  B ARG A 1 261 ? 5.46900  7.34500   8.08700   0.550 19.01000 ?  265 ARG A HG2  1 
ATOM   3962 H  HG3  A ARG A 1 261 ? 4.94500  6.00800   8.31800   0.450 16.20000 ?  265 ARG A HG3  1 
ATOM   3963 H  HG3  B ARG A 1 261 ? 4.92000  5.86200   8.24300   0.550 19.01000 ?  265 ARG A HG3  1 
ATOM   3964 H  HD2  A ARG A 1 261 ? 3.16300  6.62900   9.34800   0.450 18.04000 ?  265 ARG A HD2  1 
ATOM   3965 H  HD2  B ARG A 1 261 ? 3.48300  6.73900   9.97300   0.550 21.50000 ?  265 ARG A HD2  1 
ATOM   3966 H  HD3  A ARG A 1 261 ? 3.98100  7.52400   10.37500  0.450 18.04000 ?  265 ARG A HD3  1 
ATOM   3967 H  HD3  B ARG A 1 261 ? 3.86700  8.17800   9.42000   0.550 21.50000 ?  265 ARG A HD3  1 
ATOM   3968 H  HE   A ARG A 1 261 ? 3.47400  9.26000   9.15700   0.450 20.22000 ?  265 ARG A HE   1 
ATOM   3969 H  HE   B ARG A 1 261 ? 2.54000  7.82400   7.70800   0.550 22.68000 ?  265 ARG A HE   1 
ATOM   3970 H  HH11 A ARG A 1 261 ? 2.97100  6.65100   7.15000   0.450 21.41000 ?  265 ARG A HH11 1 
ATOM   3971 H  HH11 B ARG A 1 261 ? 2.85400  4.88700   9.23300   0.550 27.14000 ?  265 ARG A HH11 1 
ATOM   3972 H  HH12 A ARG A 1 261 ? 2.42500  7.44300   6.01300   0.450 21.41000 ?  265 ARG A HH12 1 
ATOM   3973 H  HH12 B ARG A 1 261 ? 1.83400  4.18200   8.40800   0.550 27.14000 ?  265 ARG A HH12 1 
ATOM   3974 H  HH21 A ARG A 1 261 ? 2.71400  10.42100  7.39300   0.450 20.30000 ?  265 ARG A HH21 1 
ATOM   3975 H  HH21 B ARG A 1 261 ? 1.01900  6.71800   6.47500   0.550 28.03000 ?  265 ARG A HH21 1 
ATOM   3976 H  HH22 A ARG A 1 261 ? 2.27100  9.71500   6.15900   0.450 20.30000 ?  265 ARG A HH22 1 
ATOM   3977 H  HH22 B ARG A 1 261 ? 0.72900  5.28200   6.74800   0.550 28.03000 ?  265 ARG A HH22 1 
ATOM   3978 N  N    . ALA A 1 262 ? 6.62000  3.52300   9.24200   1.000 12.91997 ?  266 ALA A N    1 
ATOM   3979 C  CA   . ALA A 1 262 ? 6.44100  2.22000   8.62400   1.000 13.59637 ?  266 ALA A CA   1 
ATOM   3980 C  C    . ALA A 1 262 ? 5.27000  1.52800   9.29400   1.000 13.73849 ?  266 ALA A C    1 
ATOM   3981 O  O    . ALA A 1 262 ? 4.90500  1.87700   10.42300  1.000 13.51215 ?  266 ALA A O    1 
ATOM   3982 C  CB   . ALA A 1 262 ? 7.71700  1.37400   8.72800   1.000 14.63597 ?  266 ALA A CB   1 
ATOM   3983 H  H    A ALA A 1 262 ? 6.32900  3.56200   10.05000  0.450 15.50000 ?  266 ALA A H    1 
ATOM   3984 H  H    B ALA A 1 262 ? 6.34300  3.55800   10.05500  0.550 15.50000 ?  266 ALA A H    1 
ATOM   3985 H  HA   . ALA A 1 262 ? 6.22600  2.32400   7.68400   1.000 16.32000 ?  266 ALA A HA   1 
ATOM   3986 H  HB1  . ALA A 1 262 ? 7.56000  0.51200   8.31200   1.000 17.56000 ?  266 ALA A HB1  1 
ATOM   3987 H  HB2  . ALA A 1 262 ? 8.43900  1.83400   8.27200   1.000 17.56000 ?  266 ALA A HB2  1 
ATOM   3988 H  HB3  . ALA A 1 262 ? 7.94000  1.25300   9.66400   1.000 17.56000 ?  266 ALA A HB3  1 
ATOM   3989 N  N    . PRO A 1 263 ? 4.65700  0.53300   8.63700   1.000 13.89903 ?  267 PRO A N    1 
ATOM   3990 C  CA   . PRO A 1 263 ? 3.33400  0.07000   9.10700   1.000 13.49372 ?  267 PRO A CA   1 
ATOM   3991 C  C    . PRO A 1 263 ? 3.38400  -0.80500  10.34800  1.000 12.90418 ?  267 PRO A C    1 
ATOM   3992 O  O    . PRO A 1 263 ? 2.37800  -0.85700  11.06100  1.000 13.30423 ?  267 PRO A O    1 
ATOM   3993 C  CB   . PRO A 1 263 ? 2.78500  -0.70000  7.91600   1.000 14.98864 ?  267 PRO A CB   1 
ATOM   3994 C  CG   . PRO A 1 263 ? 3.98000  -1.04300  7.09000   1.000 17.25470 ?  267 PRO A CG   1 
ATOM   3995 C  CD   . PRO A 1 263 ? 4.96200  0.07100   7.26200   1.000 14.75703 ?  267 PRO A CD   1 
ATOM   3996 H  HA   . PRO A 1 263 ? 2.77400  0.84200   9.28600   1.000 16.19000 ?  267 PRO A HA   1 
ATOM   3997 H  HB2  . PRO A 1 263 ? 2.33300  -1.50200  8.22200   1.000 17.98000 ?  267 PRO A HB2  1 
ATOM   3998 H  HB3  . PRO A 1 263 ? 2.16800  -0.14200  7.41800   1.000 17.98000 ?  267 PRO A HB3  1 
ATOM   3999 H  HG2  . PRO A 1 263 ? 4.35800  -1.88000  7.40200   1.000 20.70000 ?  267 PRO A HG2  1 
ATOM   4000 H  HG3  . PRO A 1 263 ? 3.71700  -1.12300  6.16000   1.000 20.70000 ?  267 PRO A HG3  1 
ATOM   4001 H  HD2  . PRO A 1 263 ? 5.87400  -0.25200  7.19400   1.000 17.71000 ?  267 PRO A HD2  1 
ATOM   4002 H  HD3  . PRO A 1 263 ? 4.81000  0.77600   6.61300   1.000 17.71000 ?  267 PRO A HD3  1 
ATOM   4003 N  N    . ASN A 1 264 ? 4.46400  -1.54100  10.60800  1.000 13.65690 ?  268 ASN A N    1 
ATOM   4004 C  CA   . ASN A 1 264 ? 4.47800  -2.54600  11.65800  1.000 13.95167 ?  268 ASN A CA   1 
ATOM   4005 C  C    . ASN A 1 264 ? 5.26300  -2.05500  12.85500  1.000 13.30423 ?  268 ASN A C    1 
ATOM   4006 O  O    . ASN A 1 264 ? 6.28800  -1.38300  12.70700  1.000 13.71480 ?  268 ASN A O    1 
ATOM   4007 C  CB   . ASN A 1 264 ? 5.11100  -3.83500  11.14400  1.000 15.20445 ?  268 ASN A CB   1 
ATOM   4008 C  CG   . ASN A 1 264 ? 4.39800  -4.39300  9.97000   1.000 18.89963 ?  268 ASN A CG   1 
ATOM   4009 O  OD1  . ASN A 1 264 ? 3.18000  -4.51000  9.96400   1.000 19.23915 ?  268 ASN A OD1  1 
ATOM   4010 N  ND2  . ASN A 1 264 ? 5.16200  -4.69000  8.92400   1.000 22.24740 ?  268 ASN A ND2  1 
ATOM   4011 H  H    . ASN A 1 264 ? 5.20800  -1.47100  10.18200  1.000 16.39000 ?  268 ASN A H    1 
ATOM   4012 H  HA   . ASN A 1 264 ? 3.56700  -2.72100  11.94400  1.000 16.74000 ?  268 ASN A HA   1 
ATOM   4013 H  HB2  . ASN A 1 264 ? 6.02800  -3.65500  10.88100  1.000 18.24000 ?  268 ASN A HB2  1 
ATOM   4014 H  HB3  . ASN A 1 264 ? 5.09400  -4.50000  11.85000  1.000 18.24000 ?  268 ASN A HB3  1 
ATOM   4015 H  HD21 . ASN A 1 264 ? 4.80700  -5.01800  8.21200   1.000 26.69000 ?  268 ASN A HD21 1 
ATOM   4016 H  HD22 . ASN A 1 264 ? 6.01000  -4.55500  8.95900   1.000 26.69000 ?  268 ASN A HD22 1 
ATOM   4017 N  N    . LYS A 1 265 ? 4.78800  -2.42000  14.04400  1.000 13.19895 ?  269 LYS A N    1 
ATOM   4018 C  CA   . LYS A 1 265 ? 5.40200  -1.89700  15.25300  1.000 13.88324 ?  269 LYS A CA   1 
ATOM   4019 C  C    . LYS A 1 265 ? 6.88900  -2.24100  15.31200  1.000 15.22551 ?  269 LYS A C    1 
ATOM   4020 O  O    . LYS A 1 265 ? 7.70700  -1.41400  15.73900  1.000 15.84137 ?  269 LYS A O    1 
ATOM   4021 C  CB   . LYS A 1 265 ? 4.67500  -2.43000  16.49000  1.000 14.34119 ?  269 LYS A CB   1 
ATOM   4022 C  CG   . LYS A 1 265 ? 5.15700  -1.78900  17.77800  1.000 16.05192 ?  269 LYS A CG   1 
ATOM   4023 C  CD   . LYS A 1 265 ? 4.30800  -2.21000  18.95700  1.000 18.85226 ?  269 LYS A CD   1 
ATOM   4024 C  CE   . LYS A 1 265 ? 4.78500  -1.52600  20.24600  1.000 21.78419 ?  269 LYS A CE   1 
ATOM   4025 N  NZ   . LYS A 1 265 ? 3.93100  -1.85700  21.42500  1.000 24.79771 ?  269 LYS A NZ   1 
ATOM   4026 H  H    . LYS A 1 265 ? 4.12800  -2.95600  14.17200  1.000 15.83000 ?  269 LYS A H    1 
ATOM   4027 H  HA   . LYS A 1 265 ? 5.31700  -0.93000  15.25100  1.000 16.65000 ?  269 LYS A HA   1 
ATOM   4028 H  HB2  . LYS A 1 265 ? 3.72600  -2.24800  16.40200  1.000 17.21000 ?  269 LYS A HB2  1 
ATOM   4029 H  HB3  . LYS A 1 265 ? 4.82500  -3.38600  16.55700  1.000 17.21000 ?  269 LYS A HB3  1 
ATOM   4030 H  HG2  . LYS A 1 265 ? 6.07300  -2.06000  17.94900  1.000 19.26000 ?  269 LYS A HG2  1 
ATOM   4031 H  HG3  . LYS A 1 265 ? 5.10700  -0.82400  17.69500  1.000 19.26000 ?  269 LYS A HG3  1 
ATOM   4032 H  HD2  . LYS A 1 265 ? 3.38500  -1.95700  18.79800  1.000 22.62000 ?  269 LYS A HD2  1 
ATOM   4033 H  HD3  . LYS A 1 265 ? 4.37200  -3.17100  19.07600  1.000 22.62000 ?  269 LYS A HD3  1 
ATOM   4034 H  HE2  . LYS A 1 265 ? 5.69000  -1.81500  20.44000  1.000 26.13000 ?  269 LYS A HE2  1 
ATOM   4035 H  HE3  . LYS A 1 265 ? 4.76300  -0.56500  20.12000  1.000 26.13000 ?  269 LYS A HE3  1 
ATOM   4036 H  HZ1  . LYS A 1 265 ? 3.92900  -2.73700  21.56300  1.000 29.76000 ?  269 LYS A HZ1  1 
ATOM   4037 H  HZ2  . LYS A 1 265 ? 4.24500  -1.45100  22.15200  1.000 29.76000 ?  269 LYS A HZ2  1 
ATOM   4038 H  HZ3  . LYS A 1 265 ? 3.09500  -1.58600  21.28200  1.000 29.76000 ?  269 LYS A HZ3  1 
ATOM   4039 N  N    A ASP A 1 266 ? 7.27200  -3.44400  14.90600  0.590 16.07561 ?  270 ASP A N    1 
ATOM   4040 N  N    B ASP A 1 266 ? 7.25400  -3.45500  14.86800  0.410 15.53344 ?  270 ASP A N    1 
ATOM   4041 C  CA   A ASP A 1 266 ? 8.68100  -3.82100  14.99800  0.590 17.86004 ?  270 ASP A CA   1 
ATOM   4042 C  CA   B ASP A 1 266 ? 8.63000  -3.93800  14.93400  0.410 16.52303 ?  270 ASP A CA   1 
ATOM   4043 C  C    A ASP A 1 266 ? 9.47100  -3.54900  13.72300  0.590 16.75201 ?  270 ASP A C    1 
ATOM   4044 C  C    B ASP A 1 266 ? 9.47900  -3.50800  13.74500  0.410 15.93875 ?  270 ASP A C    1 
ATOM   4045 O  O    A ASP A 1 266 ? 10.59800 -4.03000  13.60000  0.590 18.37852 ?  270 ASP A O    1 
ATOM   4046 O  O    B ASP A 1 266 ? 10.66600 -3.84400  13.71400  0.410 17.02309 ?  270 ASP A O    1 
ATOM   4047 C  CB   A ASP A 1 266 ? 8.84200  -5.26500  15.47300  0.590 20.72091 ?  270 ASP A CB   1 
ATOM   4048 C  CB   B ASP A 1 266 ? 8.63500  -5.46700  15.02300  0.410 17.94162 ?  270 ASP A CB   1 
ATOM   4049 C  CG   A ASP A 1 266 ? 8.45900  -6.27600  14.42600  0.590 23.27911 ?  270 ASP A CG   1 
ATOM   4050 C  CG   B ASP A 1 266 ? 8.12200  -5.96600  16.35100  0.410 19.73921 ?  270 ASP A CG   1 
ATOM   4051 O  OD1  A ASP A 1 266 ? 7.91800  -5.89000  13.37500  0.590 24.89246 ?  270 ASP A OD1  1 
ATOM   4052 O  OD1  B ASP A 1 266 ? 8.13600  -5.17000  17.31500  0.410 20.70248 ?  270 ASP A OD1  1 
ATOM   4053 O  OD2  A ASP A 1 266 ? 8.72000  -7.47100  14.67000  0.590 25.27935 -1 270 ASP A OD2  1 
ATOM   4054 O  OD2  B ASP A 1 266 ? 7.70900  -7.13900  16.42600  0.410 20.56036 -1 270 ASP A OD2  1 
ATOM   4055 H  H    A ASP A 1 266 ? 6.75000  -4.04600  14.58200  0.590 19.29000 ?  270 ASP A H    1 
ATOM   4056 H  H    B ASP A 1 266 ? 6.70900  -4.02300  14.52000  0.410 18.64000 ?  270 ASP A H    1 
ATOM   4057 H  HA   A ASP A 1 266 ? 9.08800  -3.27200  15.68700  0.590 21.43000 ?  270 ASP A HA   1 
ATOM   4058 H  HA   B ASP A 1 266 ? 9.04100  -3.57700  15.73500  0.410 19.82000 ?  270 ASP A HA   1 
ATOM   4059 H  HB2  A ASP A 1 266 ? 9.77100  -5.41600  15.70900  0.590 24.86000 ?  270 ASP A HB2  1 
ATOM   4060 H  HB2  B ASP A 1 266 ? 8.06700  -5.82700  14.32500  0.410 21.53000 ?  270 ASP A HB2  1 
ATOM   4061 H  HB3  A ASP A 1 266 ? 8.27600  -5.40700  16.24700  0.590 24.86000 ?  270 ASP A HB3  1 
ATOM   4062 H  HB3  B ASP A 1 266 ? 9.54400  -5.78800  14.91000  0.410 21.53000 ?  270 ASP A HB3  1 
ATOM   4063 N  N    . ASP A 1 267 ? 8.93200  -2.77100  12.78600  1.000 15.36237 ?  271 ASP A N    1 
ATOM   4064 C  CA   . ASP A 1 267 ? 9.75200  -2.32100  11.66600  1.000 15.68609 ?  271 ASP A CA   1 
ATOM   4065 C  C    . ASP A 1 267 ? 10.85400 -1.40100  12.19300  1.000 16.50987 ?  271 ASP A C    1 
ATOM   4066 O  O    . ASP A 1 267 ? 10.61300 -0.52200  13.02700  1.000 17.67054 ?  271 ASP A O    1 
ATOM   4067 C  CB   . ASP A 1 267 ? 8.92500  -1.54000  10.64900  1.000 15.37290 ?  271 ASP A CB   1 
ATOM   4068 C  CG   . ASP A 1 267 ? 8.06700  -2.42300  9.77400   1.000 15.94402 ?  271 ASP A CG   1 
ATOM   4069 O  OD1  . ASP A 1 267 ? 8.35700  -3.63900  9.62300   1.000 18.48116 ?  271 ASP A OD1  1 
ATOM   4070 O  OD2  . ASP A 1 267 ? 7.08500  -1.88800  9.21300   1.000 15.87032 -1 271 ASP A OD2  1 
ATOM   4071 H  H    . ASP A 1 267 ? 8.11700  -2.49900  12.77900  1.000 18.43000 ?  271 ASP A H    1 
ATOM   4072 H  HA   . ASP A 1 267 ? 10.12900 -3.09600  11.22100  1.000 18.82000 ?  271 ASP A HA   1 
ATOM   4073 H  HB2  . ASP A 1 267 ? 8.33800  -0.93000  11.12300  1.000 18.44000 ?  271 ASP A HB2  1 
ATOM   4074 H  HB3  . ASP A 1 267 ? 9.52500  -1.04300  10.07200  1.000 18.44000 ?  271 ASP A HB3  1 
ATOM   4075 N  N    . LYS A 1 268 ? 12.06900 -1.58100  11.69000  1.000 17.94426 ?  272 LYS A N    1 
ATOM   4076 C  CA   . LYS A 1 268 ? 13.20200 -0.79000  12.15700  1.000 18.77067 ?  272 LYS A CA   1 
ATOM   4077 C  C    . LYS A 1 268 ? 13.31400 0.51100   11.35800  1.000 17.17048 ?  272 LYS A C    1 
ATOM   4078 O  O    . LYS A 1 268 ? 12.97400 0.57200   10.17000  1.000 18.39168 ?  272 LYS A O    1 
ATOM   4079 C  CB   . LYS A 1 268 ? 14.49700 -1.58800  12.06500  1.000 22.83432 ?  272 LYS A CB   1 
ATOM   4080 C  CG   . LYS A 1 268 ? 14.53300 -2.84500  12.95400  1.000 26.99008 ?  272 LYS A CG   1 
ATOM   4081 C  CD   . LYS A 1 268 ? 13.96300 -2.59300  14.35500  1.000 31.20111 ?  272 LYS A CD   1 
ATOM   4082 C  CE   . LYS A 1 268 ? 13.80700 -3.88700  15.14500  1.000 34.08567 ?  272 LYS A CE   1 
ATOM   4083 N  NZ   . LYS A 1 268 ? 12.74100 -3.75800  16.17500  1.000 35.27791 ?  272 LYS A NZ   1 
ATOM   4084 H  H    . LYS A 1 268 ? 12.26400 -2.15400  11.07900  1.000 21.53000 ?  272 LYS A H    1 
ATOM   4085 H  HA   . LYS A 1 268 ? 13.06900 -0.55600  13.08900  1.000 22.52000 ?  272 LYS A HA   1 
ATOM   4086 H  HB2  . LYS A 1 268 ? 14.62000 -1.87400  11.14600  1.000 27.40000 ?  272 LYS A HB2  1 
ATOM   4087 H  HB3  . LYS A 1 268 ? 15.23300 -1.01600  12.33500  1.000 27.40000 ?  272 LYS A HB3  1 
ATOM   4088 H  HG2  . LYS A 1 268 ? 14.00600 -3.54400  12.53600  1.000 32.39000 ?  272 LYS A HG2  1 
ATOM   4089 H  HG3  . LYS A 1 268 ? 15.45300 -3.13800  13.05200  1.000 32.39000 ?  272 LYS A HG3  1 
ATOM   4090 H  HD2  . LYS A 1 268 ? 14.56300 -2.00900  14.84400  1.000 37.44000 ?  272 LYS A HD2  1 
ATOM   4091 H  HD3  . LYS A 1 268 ? 13.08900 -2.17900  14.27500  1.000 37.44000 ?  272 LYS A HD3  1 
ATOM   4092 H  HE2  . LYS A 1 268 ? 13.56500 -4.60700  14.54100  1.000 40.90000 ?  272 LYS A HE2  1 
ATOM   4093 H  HE3  . LYS A 1 268 ? 14.64200 -4.09600  15.59100  1.000 40.90000 ?  272 LYS A HE3  1 
ATOM   4094 H  HZ1  . LYS A 1 268 ? 12.64700 -4.52700  16.61400  1.000 42.33000 ?  272 LYS A HZ1  1 
ATOM   4095 H  HZ2  . LYS A 1 268 ? 12.95400 -3.11800  16.75500  1.000 42.33000 ?  272 LYS A HZ2  1 
ATOM   4096 H  HZ3  . LYS A 1 268 ? 11.96700 -3.55000  15.78700  1.000 42.33000 ?  272 LYS A HZ3  1 
ATOM   4097 N  N    . HIS A 1 269 ? 13.75500 1.57200   12.03200  1.000 16.46776 ?  273 HIS A N    1 
ATOM   4098 C  CA   . HIS A 1 269 ? 14.11500 2.79600   11.32300  1.000 16.04403 ?  273 HIS A CA   1 
ATOM   4099 C  C    . HIS A 1 269 ? 15.45200 2.59700   10.62100  1.000 15.87032 ?  273 HIS A C    1 
ATOM   4100 O  O    . HIS A 1 269 ? 16.17400 1.62300   10.85200  1.000 17.50210 ?  273 HIS A O    1 
ATOM   4101 C  CB   . HIS A 1 269 ? 14.14400 3.99300   12.28400  1.000 16.78886 ?  273 HIS A CB   1 
ATOM   4102 C  CG   . HIS A 1 269 ? 15.33900 4.04300   13.18000  1.000 17.84688 ?  273 HIS A CG   1 
ATOM   4103 N  ND1  . HIS A 1 269 ? 15.39700 3.36500   14.37400  1.000 21.23149 ?  273 HIS A ND1  1 
ATOM   4104 C  CD2  . HIS A 1 269 ? 16.50300 4.72300   13.07700  1.000 19.12598 ?  273 HIS A CD2  1 
ATOM   4105 C  CE1  . HIS A 1 269 ? 16.55900 3.59800   14.95500  1.000 21.41573 ?  273 HIS A CE1  1 
ATOM   4106 N  NE2  . HIS A 1 269 ? 17.25100 4.41500   14.18400  1.000 20.51825 ?  273 HIS A NE2  1 
ATOM   4107 H  H    . HIS A 1 269 ? 13.85400 1.60700   12.88600  1.000 19.76000 ?  273 HIS A H    1 
ATOM   4108 H  HA   . HIS A 1 269 ? 13.45000 3.00300   10.64800  1.000 19.25000 ?  273 HIS A HA   1 
ATOM   4109 H  HB2  . HIS A 1 269 ? 14.13700 4.80900   11.76000  1.000 20.14000 ?  273 HIS A HB2  1 
ATOM   4110 H  HB3  . HIS A 1 269 ? 13.35600 3.95400   12.84900  1.000 20.14000 ?  273 HIS A HB3  1 
ATOM   4111 H  HD1  . HIS A 1 269 ? 14.77400 2.86600   14.69400  1.000 25.48000 ?  273 HIS A HD1  1 
ATOM   4112 H  HD2  . HIS A 1 269 ? 16.75000 5.29300   12.38500  1.000 22.95000 ?  273 HIS A HD2  1 
ATOM   4113 H  HE1  . HIS A 1 269 ? 16.84100 3.24600   15.76800  1.000 25.70000 ?  273 HIS A HE1  1 
ATOM   4114 N  N    . SER A 1 270 ? 15.77200 3.53000   9.73600   1.000 14.71492 ?  274 SER A N    1 
ATOM   4115 C  CA   . SER A 1 270 ? 17.01200 3.49400   8.98100   1.000 14.91231 ?  274 SER A CA   1 
ATOM   4116 C  C    . SER A 1 270 ? 17.59200 4.89500   8.92700   1.000 14.72282 ?  274 SER A C    1 
ATOM   4117 O  O    . SER A 1 270 ? 16.97100 5.81100   8.38100   1.000 15.43606 ?  274 SER A O    1 
ATOM   4118 C  CB   . SER A 1 270 ? 16.76400 2.98400   7.56400   1.000 16.56778 ?  274 SER A CB   1 
ATOM   4119 O  OG   . SER A 1 270 ? 17.93800 3.18800   6.79800   1.000 17.60211 ?  274 SER A OG   1 
ATOM   4120 H  H    . SER A 1 270 ? 15.27600 4.20800   9.55300   1.000 17.65000 ?  274 SER A H    1 
ATOM   4121 H  HA   . SER A 1 270 ? 17.64500 2.91000   9.42600   1.000 17.89000 ?  274 SER A HA   1 
ATOM   4122 H  HB2  . SER A 1 270 ? 16.55500 2.03700   7.59200   1.000 19.88000 ?  274 SER A HB2  1 
ATOM   4123 H  HB3  . SER A 1 270 ? 16.02700 3.47500   7.16700   1.000 19.88000 ?  274 SER A HB3  1 
ATOM   4124 H  HG   . SER A 1 270 ? 17.92200 2.70200   6.11300   1.000 21.12000 ?  274 SER A HG   1 
ATOM   4125 N  N    . GLU A 1 271 ? 18.81500 5.04400   9.43900   1.000 14.43331 ?  275 GLU A N    1 
ATOM   4126 C  CA   . GLU A 1 271 ? 19.53000 6.29800   9.27000   1.000 14.69650 ?  275 GLU A CA   1 
ATOM   4127 C  C    . GLU A 1 271 ? 19.94200 6.48000   7.81900   1.000 14.85441 ?  275 GLU A C    1 
ATOM   4128 O  O    . GLU A 1 271 ? 19.85400 7.58500   7.26900   1.000 14.95969 ?  275 GLU A O    1 
ATOM   4129 C  CB   . GLU A 1 271 ? 20.74000 6.33500   10.19700  1.000 15.45448 ?  275 GLU A CB   1 
ATOM   4130 C  CG   . GLU A 1 271 ? 20.33800 6.24400   11.65100  1.000 15.82821 ?  275 GLU A CG   1 
ATOM   4131 C  CD   . GLU A 1 271 ? 21.38900 6.82600   12.54300  1.000 16.45987 ?  275 GLU A CD   1 
ATOM   4132 O  OE1  . GLU A 1 271 ? 22.41900 6.14000   12.77500  1.000 17.66528 ?  275 GLU A OE1  1 
ATOM   4133 O  OE2  . GLU A 1 271 ? 21.20700 7.96000   12.99100  1.000 16.43355 -1 275 GLU A OE2  1 
ATOM   4134 H  H    . GLU A 1 271 ? 19.24200 4.44200   9.88100   1.000 17.32000 ?  275 GLU A H    1 
ATOM   4135 H  HA   . GLU A 1 271 ? 18.95500 7.04000   9.51500   1.000 17.63000 ?  275 GLU A HA   1 
ATOM   4136 H  HB2  . GLU A 1 271 ? 21.32000 5.58400   9.99500   1.000 18.54000 ?  275 GLU A HB2  1 
ATOM   4137 H  HB3  . GLU A 1 271 ? 21.21800 7.16800   10.06600  1.000 18.54000 ?  275 GLU A HB3  1 
ATOM   4138 H  HG2  . GLU A 1 271 ? 19.51300 6.73500   11.78800  1.000 18.99000 ?  275 GLU A HG2  1 
ATOM   4139 H  HG3  . GLU A 1 271 ? 20.21300 5.31300   11.89200  1.000 18.99000 ?  275 GLU A HG3  1 
ATOM   4140 N  N    . ALA A 1 272 ? 20.37000 5.39500   7.16900   1.000 16.23353 ?  276 ALA A N    1 
ATOM   4141 C  CA   . ALA A 1 272 ? 20.81800 5.49800   5.78700   1.000 16.47566 ?  276 ALA A CA   1 
ATOM   4142 C  C    . ALA A 1 272 ? 19.71000 6.00600   4.86400   1.000 16.28090 ?  276 ALA A C    1 
ATOM   4143 O  O    . ALA A 1 272 ? 19.98600 6.74000   3.91400   1.000 15.85716 ?  276 ALA A O    1 
ATOM   4144 C  CB   . ALA A 1 272 ? 21.30200 4.13800   5.30500   1.000 18.56802 ?  276 ALA A CB   1 
ATOM   4145 H  H    . ALA A 1 272 ? 20.40900 4.60300   7.50200   1.000 19.47000 ?  276 ALA A H    1 
ATOM   4146 H  HA   . ALA A 1 272 ? 21.55300 6.13100   5.75100   1.000 19.77000 ?  276 ALA A HA   1 
ATOM   4147 H  HB1  . ALA A 1 272 ? 21.63500 4.22400   4.39800   1.000 22.28000 ?  276 ALA A HB1  1 
ATOM   4148 H  HB2  . ALA A 1 272 ? 22.01200 3.82900   5.89000   1.000 22.28000 ?  276 ALA A HB2  1 
ATOM   4149 H  HB3  . ALA A 1 272 ? 20.56100 3.51300   5.32700   1.000 22.28000 ?  276 ALA A HB3  1 
ATOM   4150 N  N    A VAL A 1 273 ? 18.46000 5.61300   5.11900   0.590 16.22826 ?  277 VAL A N    1 
ATOM   4151 N  N    B VAL A 1 273 ? 18.45500 5.61600   5.11000   0.410 16.27564 ?  277 VAL A N    1 
ATOM   4152 C  CA   A VAL A 1 273 ? 17.35200 6.06700   4.28700   0.590 15.45185 ?  277 VAL A CA   1 
ATOM   4153 C  CA   B VAL A 1 273 ? 17.37700 6.09200   4.24800   0.410 15.79926 ?  277 VAL A CA   1 
ATOM   4154 C  C    A VAL A 1 273 ? 17.15300 7.57000   4.44000   0.590 14.80177 ?  277 VAL A C    1 
ATOM   4155 C  C    B VAL A 1 273 ? 17.18300 7.59300   4.42600   0.410 14.94390 ?  277 VAL A C    1 
ATOM   4156 O  O    A VAL A 1 273 ? 16.81900 8.27000   3.47500   0.590 15.15708 ?  277 VAL A O    1 
ATOM   4157 O  O    B VAL A 1 273 ? 16.88200 8.31200   3.46700   0.410 15.11497 ?  277 VAL A O    1 
ATOM   4158 C  CB   A VAL A 1 273 ? 16.07600 5.27200   4.62900   0.590 16.40460 ?  277 VAL A CB   1 
ATOM   4159 C  CB   B VAL A 1 273 ? 16.07100 5.31200   4.48500   0.410 16.92308 ?  277 VAL A CB   1 
ATOM   4160 C  CG1  A VAL A 1 273 ? 14.85700 5.93600   4.03600   0.590 16.60725 ?  277 VAL A CG1  1 
ATOM   4161 C  CG1  B VAL A 1 273 ? 15.35000 5.81900   5.72800   0.410 17.56263 ?  277 VAL A CG1  1 
ATOM   4162 C  CG2  A VAL A 1 273 ? 16.21400 3.83000   4.15600   0.590 17.20206 ?  277 VAL A CG2  1 
ATOM   4163 C  CG2  B VAL A 1 273 ? 15.16200 5.43900   3.27600   0.410 17.61001 ?  277 VAL A CG2  1 
ATOM   4164 H  H    A VAL A 1 273 ? 18.23200 5.08800   5.76100   0.590 19.47000 ?  277 VAL A H    1 
ATOM   4165 H  H    B VAL A 1 273 ? 18.21200 5.09400   5.74900   0.410 19.53000 ?  277 VAL A H    1 
ATOM   4166 H  HA   A VAL A 1 273 ? 17.56500 5.89700   3.35700   0.590 18.54000 ?  277 VAL A HA   1 
ATOM   4167 H  HA   B VAL A 1 273 ? 17.63900 5.92400   3.32900   0.410 18.96000 ?  277 VAL A HA   1 
ATOM   4168 H  HB   A VAL A 1 273 ? 15.95600 5.25800   5.59200   0.590 19.68000 ?  277 VAL A HB   1 
ATOM   4169 H  HB   B VAL A 1 273 ? 16.29000 4.37800   4.62200   0.410 20.31000 ?  277 VAL A HB   1 
ATOM   4170 H  HG11 A VAL A 1 273 ? 14.12600 5.29800   4.02200   0.590 19.93000 ?  277 VAL A HG11 1 
ATOM   4171 H  HG11 B VAL A 1 273 ? 14.80900 5.10200   6.09300   0.410 21.07000 ?  277 VAL A HG11 1 
ATOM   4172 H  HG12 A VAL A 1 273 ? 14.61800 6.70100   4.58200   0.590 19.93000 ?  277 VAL A HG12 1 
ATOM   4173 H  HG12 B VAL A 1 273 ? 16.00900 6.10200   6.38100   0.410 21.07000 ?  277 VAL A HG12 1 
ATOM   4174 H  HG13 A VAL A 1 273 ? 15.06200 6.22400   3.13300   0.590 19.93000 ?  277 VAL A HG13 1 
ATOM   4175 H  HG13 B VAL A 1 273 ? 14.78500 6.56800   5.48200   0.410 21.07000 ?  277 VAL A HG13 1 
ATOM   4176 H  HG21 A VAL A 1 273 ? 15.49900 3.30100   4.54200   0.590 20.64000 ?  277 VAL A HG21 1 
ATOM   4177 H  HG21 B VAL A 1 273 ? 14.29400 5.06300   3.49300   0.410 21.13000 ?  277 VAL A HG21 1 
ATOM   4178 H  HG22 A VAL A 1 273 ? 16.15600 3.80800   3.18800   0.590 20.64000 ?  277 VAL A HG22 1 
ATOM   4179 H  HG22 B VAL A 1 273 ? 15.06800 6.37700   3.04700   0.410 21.13000 ?  277 VAL A HG22 1 
ATOM   4180 H  HG23 A VAL A 1 273 ? 17.07300 3.48400   4.44400   0.590 20.64000 ?  277 VAL A HG23 1 
ATOM   4181 H  HG23 B VAL A 1 273 ? 15.55500 4.95500   2.53300   0.410 21.13000 ?  277 VAL A HG23 1 
ATOM   4182 N  N    . ILE A 1 274 ? 17.33200 8.08800   5.65900   1.000 14.49647 ?  278 ILE A N    1 
ATOM   4183 C  CA   . ILE A 1 274 ? 17.22800 9.52400   5.89500   1.000 13.95430 ?  278 ILE A CA   1 
ATOM   4184 C  C    . ILE A 1 274 ? 18.33100 10.27200  5.14800   1.000 14.27540 ?  278 ILE A C    1 
ATOM   4185 O  O    . ILE A 1 274 ? 18.07200 11.28000  4.48200   1.000 14.30171 ?  278 ILE A O    1 
ATOM   4186 C  CB   . ILE A 1 274 ? 17.21100 9.81700   7.41000   1.000 13.79376 ?  278 ILE A CB   1 
ATOM   4187 C  CG1  . ILE A 1 274 ? 15.94000 9.23300   8.03600   1.000 13.97536 ?  278 ILE A CG1  1 
ATOM   4188 C  CG2  . ILE A 1 274 ? 17.32400 11.31200  7.65200   1.000 14.26224 ?  278 ILE A CG2  1 
ATOM   4189 C  CD1  . ILE A 1 274 ? 15.92600 9.31000   9.55500   1.000 14.46489 ?  278 ILE A CD1  1 
ATOM   4190 H  H    A ILE A 1 274 ? 17.51400 7.62800   6.36300   0.590 17.39000 ?  278 ILE A H    1 
ATOM   4191 H  H    B ILE A 1 274 ? 17.49200 7.61900   6.36200   0.410 17.39000 ?  278 ILE A H    1 
ATOM   4192 H  HA   . ILE A 1 274 ? 16.38600 9.84400   5.53600   1.000 16.74000 ?  278 ILE A HA   1 
ATOM   4193 H  HB   . ILE A 1 274 ? 17.97400 9.39100   7.83200   1.000 16.55000 ?  278 ILE A HB   1 
ATOM   4194 H  HG12 . ILE A 1 274 ? 15.17200 9.72500   7.70600   1.000 16.77000 ?  278 ILE A HG12 1 
ATOM   4195 H  HG13 . ILE A 1 274 ? 15.86700 8.29800   7.78500   1.000 16.77000 ?  278 ILE A HG13 1 
ATOM   4196 H  HG21 . ILE A 1 274 ? 17.25000 11.48500  8.60300   1.000 17.11000 ?  278 ILE A HG21 1 
ATOM   4197 H  HG22 . ILE A 1 274 ? 18.18400 11.62100  7.32600   1.000 17.11000 ?  278 ILE A HG22 1 
ATOM   4198 H  HG23 . ILE A 1 274 ? 16.60900 11.76400  7.17700   1.000 17.11000 ?  278 ILE A HG23 1 
ATOM   4199 H  HD11 . ILE A 1 274 ? 15.15800 8.82100   9.88900   1.000 17.36000 ?  278 ILE A HD11 1 
ATOM   4200 H  HD12 . ILE A 1 274 ? 16.74400 8.91800   9.89900   1.000 17.36000 ?  278 ILE A HD12 1 
ATOM   4201 H  HD13 . ILE A 1 274 ? 15.86800 10.24100  9.82300   1.000 17.36000 ?  278 ILE A HD13 1 
ATOM   4202 N  N    . ALA A 1 275 ? 19.57600 9.78300   5.23400   1.000 14.48332 ?  279 ALA A N    1 
ATOM   4203 C  CA   . ALA A 1 275 ? 20.67300 10.40700  4.49900   1.000 14.31487 ?  279 ALA A CA   1 
ATOM   4204 C  C    . ALA A 1 275 ? 20.41200 10.35400  3.00300   1.000 14.42278 ?  279 ALA A C    1 
ATOM   4205 O  O    . ALA A 1 275 ? 20.65200 11.32800  2.29300   1.000 14.81757 ?  279 ALA A O    1 
ATOM   4206 C  CB   . ALA A 1 275 ? 21.98100 9.69500   4.82700   1.000 15.15445 ?  279 ALA A CB   1 
ATOM   4207 H  H    . ALA A 1 275 ? 19.80500 9.10100   5.70500   1.000 17.38000 ?  279 ALA A H    1 
ATOM   4208 H  HA   . ALA A 1 275 ? 20.75300 11.33500  4.76800   1.000 17.18000 ?  279 ALA A HA   1 
ATOM   4209 H  HB1  . ALA A 1 275 ? 22.70600 10.13300  4.35400   1.000 18.18000 ?  279 ALA A HB1  1 
ATOM   4210 H  HB2  . ALA A 1 275 ? 22.13400 9.74200   5.78400   1.000 18.18000 ?  279 ALA A HB2  1 
ATOM   4211 H  HB3  . ALA A 1 275 ? 21.91500 8.76900   4.54800   1.000 18.18000 ?  279 ALA A HB3  1 
ATOM   4212 N  N    . ALA A 1 276 ? 19.90800 9.22700   2.50900   1.000 14.88336 ?  280 ALA A N    1 
ATOM   4213 C  CA   . ALA A 1 276 ? 19.66800 9.09000   1.07800   1.000 14.89389 ?  280 ALA A CA   1 
ATOM   4214 C  C    . ALA A 1 276 ? 18.58100 10.04800  0.61700   1.000 14.57543 ?  280 ALA A C    1 
ATOM   4215 O  O    . ALA A 1 276 ? 18.67800 10.63900  -0.47000  1.000 15.12023 ?  280 ALA A O    1 
ATOM   4216 C  CB   . ALA A 1 276 ? 19.29500 7.65700   0.75500   1.000 15.82032 ?  280 ALA A CB   1 
ATOM   4217 H  H    . ALA A 1 276 ? 19.70000 8.53500   2.97500   1.000 17.86000 ?  280 ALA A H    1 
ATOM   4218 H  HA   . ALA A 1 276 ? 20.48100 9.30200   0.59400   1.000 17.87000 ?  280 ALA A HA   1 
ATOM   4219 H  HB1  . ALA A 1 276 ? 19.14300 7.57800   -0.20000  1.000 18.98000 ?  280 ALA A HB1  1 
ATOM   4220 H  HB2  . ALA A 1 276 ? 20.02100 7.07400   1.02400   1.000 18.98000 ?  280 ALA A HB2  1 
ATOM   4221 H  HB3  . ALA A 1 276 ? 18.48700 7.42500   1.23900   1.000 18.98000 ?  280 ALA A HB3  1 
ATOM   4222 N  N    . ALA A 1 277 ? 17.53200 10.20900  1.43000   1.000 14.47542 ?  281 ALA A N    1 
ATOM   4223 C  CA   . ALA A 1 277 ? 16.47700 11.15300  1.08100   1.000 14.01747 ?  281 ALA A CA   1 
ATOM   4224 C  C    . ALA A 1 277 ? 16.99200 12.58600  1.08000   1.000 14.15433 ?  281 ALA A C    1 
ATOM   4225 O  O    . ALA A 1 277 ? 16.62000 13.38000  0.20900   1.000 14.70439 ?  281 ALA A O    1 
ATOM   4226 C  CB   . ALA A 1 277 ? 15.30300 11.01800  2.05800   1.000 14.54911 ?  281 ALA A CB   1 
ATOM   4227 H  H    . ALA A 1 277 ? 17.41300 9.79100   2.17200   1.000 17.36000 ?  281 ALA A H    1 
ATOM   4228 H  HA   . ALA A 1 277 ? 16.15800 10.94200  0.19000   1.000 16.82000 ?  281 ALA A HA   1 
ATOM   4229 H  HB1  . ALA A 1 277 ? 14.61400 11.65700  1.81400   1.000 17.46000 ?  281 ALA A HB1  1 
ATOM   4230 H  HB2  . ALA A 1 277 ? 14.95100 10.11600  2.00600   1.000 17.46000 ?  281 ALA A HB2  1 
ATOM   4231 H  HB3  . ALA A 1 277 ? 15.61800 11.19900  2.95700   1.000 17.46000 ?  281 ALA A HB3  1 
ATOM   4232 N  N    . ALA A 1 278 ? 17.86500 12.92600  2.02900   1.000 14.47279 ?  282 ALA A N    1 
ATOM   4233 C  CA   . ALA A 1 278 ? 18.46700 14.25100  2.04200   1.000 15.08602 ?  282 ALA A CA   1 
ATOM   4234 C  C    . ALA A 1 278 ? 19.30600 14.47700  0.78900   1.000 15.38869 ?  282 ALA A C    1 
ATOM   4235 O  O    . ALA A 1 278 ? 19.29300 15.57300  0.21700   1.000 15.94139 ?  282 ALA A O    1 
ATOM   4236 C  CB   . ALA A 1 278 ? 19.31500 14.42200  3.29700   1.000 15.50975 ?  282 ALA A CB   1 
ATOM   4237 H  H    . ALA A 1 278 ? 18.12100 12.41200  2.66900   1.000 17.36000 ?  282 ALA A H    1 
ATOM   4238 H  HA   . ALA A 1 278 ? 17.76500 14.92000  2.06000   1.000 18.10000 ?  282 ALA A HA   1 
ATOM   4239 H  HB1  . ALA A 1 278 ? 19.72100 15.30300  3.28600   1.000 18.61000 ?  282 ALA A HB1  1 
ATOM   4240 H  HB2  . ALA A 1 278 ? 18.74600 14.33000  4.07700   1.000 18.61000 ?  282 ALA A HB2  1 
ATOM   4241 H  HB3  . ALA A 1 278 ? 20.00400 13.74000  3.30800   1.000 18.61000 ?  282 ALA A HB3  1 
ATOM   4242 N  N    A ARG A 1 279 ? 20.03700 13.44700  0.34600   0.370 15.57292 ?  283 ARG A N    1 
ATOM   4243 N  N    B ARG A 1 279 ? 20.05600 13.45800  0.35400   0.630 15.21235 ?  283 ARG A N    1 
ATOM   4244 C  CA   A ARG A 1 279 ? 20.82700 13.55800  -0.87600  0.370 16.18615 ?  283 ARG A CA   1 
ATOM   4245 C  CA   B ARG A 1 279 ? 20.82400 13.58500  -0.88100  0.630 15.97297 ?  283 ARG A CA   1 
ATOM   4246 C  C    A ARG A 1 279 ? 19.94200 13.82500  -2.08600  0.370 15.73610 ?  283 ARG A C    1 
ATOM   4247 C  C    B ARG A 1 279 ? 19.90800 13.87900  -2.06000  0.630 15.73083 ?  283 ARG A C    1 
ATOM   4248 O  O    A ARG A 1 279 ? 20.28600 14.64500  -2.94500  0.370 16.20721 ?  283 ARG A O    1 
ATOM   4249 O  O    B ARG A 1 279 ? 20.19000 14.77200  -2.86500  0.630 17.15732 ?  283 ARG A O    1 
ATOM   4250 C  CB   A ARG A 1 279 ? 21.62600 12.26900  -1.07500  0.370 17.39945 ?  283 ARG A CB   1 
ATOM   4251 C  CB   B ARG A 1 279 ? 21.62400 12.31000  -1.14700  0.630 17.68107 ?  283 ARG A CB   1 
ATOM   4252 C  CG   A ARG A 1 279 ? 22.48300 12.22700  -2.33900  0.370 18.98912 ?  283 ARG A CG   1 
ATOM   4253 C  CG   B ARG A 1 279 ? 22.80200 12.13700  -0.22300  0.630 19.47076 ?  283 ARG A CG   1 
ATOM   4254 C  CD   A ARG A 1 279 ? 23.21300 10.88100  -2.47100  0.370 21.06568 ?  283 ARG A CD   1 
ATOM   4255 C  CD   B ARG A 1 279 ? 23.78600 11.06200  -0.68400  0.630 20.93409 ?  283 ARG A CD   1 
ATOM   4256 N  NE   A ARG A 1 279 ? 23.80900 10.67100  -3.78800  0.370 23.55546 ?  283 ARG A NE   1 
ATOM   4257 N  NE   B ARG A 1 279 ? 24.60800 10.71000  0.46300   0.630 22.23424 ?  283 ARG A NE   1 
ATOM   4258 C  CZ   A ARG A 1 279 ? 25.10500 10.48800  -4.00900  0.370 25.95574 ?  283 ARG A CZ   1 
ATOM   4259 C  CZ   B ARG A 1 279 ? 24.32400 9.73800   1.31700   0.630 22.17371 ?  283 ARG A CZ   1 
ATOM   4260 N  NH1  A ARG A 1 279 ? 25.98400 10.46900  -3.01900  0.370 27.02429 ?  283 ARG A NH1  1 
ATOM   4261 N  NH1  B ARG A 1 279 ? 23.34600 8.87600   1.08300   0.630 21.72366 ?  283 ARG A NH1  1 
ATOM   4262 N  NH2  A ARG A 1 279 ? 25.53100 10.31100  -5.25500  0.370 27.00850 ?  283 ARG A NH2  1 
ATOM   4263 N  NH2  B ARG A 1 279 ? 25.03300 9.63400   2.44000   0.630 22.90538 ?  283 ARG A NH2  1 
ATOM   4264 H  H    A ARG A 1 279 ? 20.09100 12.68200  0.73400   0.370 18.68000 ?  283 ARG A H    1 
ATOM   4265 H  H    B ARG A 1 279 ? 20.13500 12.69900  0.75000   0.630 18.25000 ?  283 ARG A H    1 
ATOM   4266 H  HA   A ARG A 1 279 ? 21.44500 14.30100  -0.79200  0.370 19.42000 ?  283 ARG A HA   1 
ATOM   4267 H  HA   B ARG A 1 279 ? 21.45000 14.31900  -0.77900  0.630 19.16000 ?  283 ARG A HA   1 
ATOM   4268 H  HB2  A ARG A 1 279 ? 22.22100 12.15700  -0.31700  0.370 20.88000 ?  283 ARG A HB2  1 
ATOM   4269 H  HB2  B ARG A 1 279 ? 21.04000 11.54500  -1.03200  0.630 21.21000 ?  283 ARG A HB2  1 
ATOM   4270 H  HB3  A ARG A 1 279 ? 21.00400 11.52700  -1.12200  0.370 20.88000 ?  283 ARG A HB3  1 
ATOM   4271 H  HB3  B ARG A 1 279 ? 21.96100 12.33700  -2.05700  0.630 21.21000 ?  283 ARG A HB3  1 
ATOM   4272 H  HG2  A ARG A 1 279 ? 21.91700 12.34600  -3.11700  0.370 22.78000 ?  283 ARG A HG2  1 
ATOM   4273 H  HG2  B ARG A 1 279 ? 23.28400 12.97700  -0.16800  0.630 23.36000 ?  283 ARG A HG2  1 
ATOM   4274 H  HG3  A ARG A 1 279 ? 23.14800 12.93300  -2.30200  0.370 22.78000 ?  283 ARG A HG3  1 
ATOM   4275 H  HG3  B ARG A 1 279 ? 22.47700 11.88400  0.65600   0.630 23.36000 ?  283 ARG A HG3  1 
ATOM   4276 H  HD2  A ARG A 1 279 ? 23.92400 10.84400  -1.81300  0.370 25.28000 ?  283 ARG A HD2  1 
ATOM   4277 H  HD2  B ARG A 1 279 ? 23.30700 10.27600  -0.99100  0.630 25.12000 ?  283 ARG A HD2  1 
ATOM   4278 H  HD3  A ARG A 1 279 ? 22.57800 10.16400  -2.31500  0.370 25.28000 ?  283 ARG A HD3  1 
ATOM   4279 H  HD3  B ARG A 1 279 ? 24.35200 11.40400  -1.39400  0.630 25.12000 ?  283 ARG A HD3  1 
ATOM   4280 H  HE   A ARG A 1 279 ? 23.28300 10.66600  -4.46800  0.370 28.26000 ?  283 ARG A HE   1 
ATOM   4281 H  HE   B ARG A 1 279 ? 25.32700 11.16300  0.59600   0.630 26.68000 ?  283 ARG A HE   1 
ATOM   4282 H  HH11 A ARG A 1 279 ? 25.72000 10.57700  -2.20800  0.370 32.43000 ?  283 ARG A HH11 1 
ATOM   4283 H  HH11 B ARG A 1 279 ? 22.88000 8.94000   0.36300   0.630 26.07000 ?  283 ARG A HH11 1 
ATOM   4284 H  HH12 A ARG A 1 279 ? 26.81800 10.34800  -3.18700  0.370 32.43000 ?  283 ARG A HH12 1 
ATOM   4285 H  HH12 B ARG A 1 279 ? 23.17800 8.25200   1.65000   0.630 26.07000 ?  283 ARG A HH12 1 
ATOM   4286 H  HH21 A ARG A 1 279 ? 24.97000 10.31600  -5.90700  0.370 32.41000 ?  283 ARG A HH21 1 
ATOM   4287 H  HH21 B ARG A 1 279 ? 25.66500 10.19300  2.60200   0.630 27.48000 ?  283 ARG A HH21 1 
ATOM   4288 H  HH22 A ARG A 1 279 ? 26.36900 10.19100  -5.41000  0.370 32.41000 ?  283 ARG A HH22 1 
ATOM   4289 H  HH22 B ARG A 1 279 ? 24.85800 9.00700   3.00200   0.630 27.48000 ?  283 ARG A HH22 1 
ATOM   4290 N  N    . LEU A 1 280 ? 18.80600 13.12600  -2.17800  1.000 15.71241 ?  284 LEU A N    1 
ATOM   4291 C  CA   . LEU A 1 280 ? 17.86500 13.35900  -3.26900  1.000 15.82295 ?  284 LEU A CA   1 
ATOM   4292 C  C    . LEU A 1 280 ? 17.28700 14.76800  -3.21500  1.000 15.82821 ?  284 LEU A C    1 
ATOM   4293 O  O    . LEU A 1 280 ? 17.08500 15.40200  -4.25400  1.000 16.40986 ?  284 LEU A O    1 
ATOM   4294 C  CB   . LEU A 1 280 ? 16.73100 12.33600  -3.23700  1.000 17.05994 ?  284 LEU A CB   1 
ATOM   4295 C  CG   . LEU A 1 280 ? 17.06600 10.88800  -3.57600  1.000 17.64685 ?  284 LEU A CG   1 
ATOM   4296 C  CD1  . LEU A 1 280 ? 15.80200 10.03200  -3.58800  1.000 18.63645 ?  284 LEU A CD1  1 
ATOM   4297 C  CD2  . LEU A 1 280 ? 17.79800 10.75500  -4.90800  1.000 18.24429 ?  284 LEU A CD2  1 
ATOM   4298 H  H    A LEU A 1 280 ? 18.56100 12.51500  -1.62500  0.370 18.85000 ?  284 LEU A H    1 
ATOM   4299 H  H    B LEU A 1 280 ? 18.58800 12.48500  -1.64700  0.630 18.85000 ?  284 LEU A H    1 
ATOM   4300 H  HA   . LEU A 1 280 ? 18.34800 13.25000  -4.10400  1.000 18.98000 ?  284 LEU A HA   1 
ATOM   4301 H  HB2  . LEU A 1 280 ? 16.36000 12.33500  -2.34100  1.000 20.47000 ?  284 LEU A HB2  1 
ATOM   4302 H  HB3  . LEU A 1 280 ? 16.05700 12.62300  -3.87400  1.000 20.47000 ?  284 LEU A HB3  1 
ATOM   4303 H  HG   . LEU A 1 280 ? 17.66400 10.56100  -2.88700  1.000 21.17000 ?  284 LEU A HG   1 
ATOM   4304 H  HD11 . LEU A 1 280 ? 16.04600 9.11200   -3.77700  1.000 22.36000 ?  284 LEU A HD11 1 
ATOM   4305 H  HD12 . LEU A 1 280 ? 15.37400 10.08800  -2.71900  1.000 22.36000 ?  284 LEU A HD12 1 
ATOM   4306 H  HD13 . LEU A 1 280 ? 15.20200 10.36300  -4.27400  1.000 22.36000 ?  284 LEU A HD13 1 
ATOM   4307 H  HD21 . LEU A 1 280 ? 17.91100 9.81400   -5.11400  1.000 21.89000 ?  284 LEU A HD21 1 
ATOM   4308 H  HD22 . LEU A 1 280 ? 17.27300 11.18500  -5.60100  1.000 21.89000 ?  284 LEU A HD22 1 
ATOM   4309 H  HD23 . LEU A 1 280 ? 18.66500 11.18400  -4.83500  1.000 21.89000 ?  284 LEU A HD23 1 
ATOM   4310 N  N    . ALA A 1 281 ? 16.99700 15.27100  -2.01300  1.000 16.05192 ?  285 ALA A N    1 
ATOM   4311 C  CA   . ALA A 1 281 ? 16.45100 16.61800  -1.88600  1.000 16.39144 ?  285 ALA A CA   1 
ATOM   4312 C  C    . ALA A 1 281 ? 17.45500 17.65400  -2.37900  1.000 16.32038 ?  285 ALA A C    1 
ATOM   4313 O  O    . ALA A 1 281 ? 17.09800 18.58700  -3.10900  1.000 17.02046 ?  285 ALA A O    1 
ATOM   4314 C  CB   . ALA A 1 281 ? 16.07700 16.88000  -0.42600  1.000 16.78622 ?  285 ALA A CB   1 
ATOM   4315 H  H    . ALA A 1 281 ? 17.10600 14.85800  -1.26700  1.000 19.26000 ?  285 ALA A H    1 
ATOM   4316 H  HA   . ALA A 1 281 ? 15.64700 16.69600  -2.42300  1.000 19.67000 ?  285 ALA A HA   1 
ATOM   4317 H  HB1  . ALA A 1 281 ? 15.69700 17.76900  -0.35200  1.000 20.14000 ?  285 ALA A HB1  1 
ATOM   4318 H  HB2  . ALA A 1 281 ? 15.42800 16.21800  -0.14200  1.000 20.14000 ?  285 ALA A HB2  1 
ATOM   4319 H  HB3  . ALA A 1 281 ? 16.87600 16.81600  0.12100   1.000 20.14000 ?  285 ALA A HB3  1 
ATOM   4320 N  N    . LEU A 1 282 ? 18.72700 17.51600  -1.98400  1.000 16.54146 ?  286 LEU A N    1 
ATOM   4321 C  CA   . LEU A 1 282 ? 19.73800 18.46200  -2.44700  1.000 17.34682 ?  286 LEU A CA   1 
ATOM   4322 C  C    . LEU A 1 282 ? 19.91000 18.37300  -3.95600  1.000 17.65212 ?  286 LEU A C    1 
ATOM   4323 O  O    . LEU A 1 282 ? 20.03800 19.39500  -4.63200  1.000 18.79699 ?  286 LEU A O    1 
ATOM   4324 C  CB   . LEU A 1 282 ? 21.06100 18.20500  -1.72900  1.000 19.34179 ?  286 LEU A CB   1 
ATOM   4325 C  CG   . LEU A 1 282 ? 21.04700 18.52100  -0.23200  1.000 21.34993 ?  286 LEU A CG   1 
ATOM   4326 C  CD1  . LEU A 1 282 ? 22.34200 18.01300  0.40500   1.000 22.41848 ?  286 LEU A CD1  1 
ATOM   4327 C  CD2  . LEU A 1 282 ? 20.86200 20.00100  0.03900   1.000 22.02896 ?  286 LEU A CD2  1 
ATOM   4328 H  H    . LEU A 1 282 ? 19.02000 16.89800  -1.46300  1.000 19.84000 ?  286 LEU A H    1 
ATOM   4329 H  HA   . LEU A 1 282 ? 19.45700 19.36500  -2.23000  1.000 20.82000 ?  286 LEU A HA   1 
ATOM   4330 H  HB2  . LEU A 1 282 ? 21.28800 17.26700  -1.82900  1.000 23.21000 ?  286 LEU A HB2  1 
ATOM   4331 H  HB3  . LEU A 1 282 ? 21.74600 18.75700  -2.13900  1.000 23.21000 ?  286 LEU A HB3  1 
ATOM   4332 H  HG   . LEU A 1 282 ? 20.29000 18.07100  0.17400   1.000 25.62000 ?  286 LEU A HG   1 
ATOM   4333 H  HD11 . LEU A 1 282 ? 22.31400 18.18600  1.35900   1.000 26.90000 ?  286 LEU A HD11 1 
ATOM   4334 H  HD12 . LEU A 1 282 ? 22.42100 17.06000  0.24400   1.000 26.90000 ?  286 LEU A HD12 1 
ATOM   4335 H  HD13 . LEU A 1 282 ? 23.09400 18.47900  0.00600   1.000 26.90000 ?  286 LEU A HD13 1 
ATOM   4336 H  HD21 . LEU A 1 282 ? 20.97200 20.16400  0.98800   1.000 26.43000 ?  286 LEU A HD21 1 
ATOM   4337 H  HD22 . LEU A 1 282 ? 21.52700 20.49900  -0.46200  1.000 26.43000 ?  286 LEU A HD22 1 
ATOM   4338 H  HD23 . LEU A 1 282 ? 19.97200 20.26400  -0.24200  1.000 26.43000 ?  286 LEU A HD23 1 
ATOM   4339 N  N    . GLU A 1 283 ? 19.88600 17.15500  -4.50900  1.000 17.59685 ?  287 GLU A N    1 
ATOM   4340 C  CA   . GLU A 1 283 ? 19.97300 17.00200  -5.96200  1.000 19.01544 ?  287 GLU A CA   1 
ATOM   4341 C  C    . GLU A 1 283 ? 18.78500 17.66000  -6.64600  1.000 19.21020 ?  287 GLU A C    1 
ATOM   4342 O  O    . GLU A 1 283 ? 18.93500 18.32700  -7.68300  1.000 18.24956 ?  287 GLU A O    1 
ATOM   4343 C  CB   . GLU A 1 283 ? 20.03100 15.52100  -6.32600  1.000 21.36572 ?  287 GLU A CB   1 
ATOM   4344 C  CG   . GLU A 1 283 ? 21.32900 14.84500  -5.92200  1.000 26.16893 ?  287 GLU A CG   1 
ATOM   4345 C  CD   . GLU A 1 283 ? 21.29000 13.35300  -6.16900  1.000 31.91172 ?  287 GLU A CD   1 
ATOM   4346 O  OE1  . GLU A 1 283 ? 20.38100 12.88500  -6.88100  1.000 34.87523 ?  287 GLU A OE1  1 
ATOM   4347 O  OE2  . GLU A 1 283 ? 22.18800 12.64900  -5.65900  1.000 34.89629 -1 287 GLU A OE2  1 
ATOM   4348 H  H    . GLU A 1 283 ? 19.82100 16.41700  -4.07300  1.000 21.11000 ?  287 GLU A H    1 
ATOM   4349 H  HA   . GLU A 1 283 ? 20.78700 17.42700  -6.27600  1.000 22.81000 ?  287 GLU A HA   1 
ATOM   4350 H  HB2  . GLU A 1 283 ? 19.30500 15.06100  -5.87800  1.000 25.63000 ?  287 GLU A HB2  1 
ATOM   4351 H  HB3  . GLU A 1 283 ? 19.93700 15.43200  -7.28700  1.000 25.63000 ?  287 GLU A HB3  1 
ATOM   4352 H  HG2  . GLU A 1 283 ? 22.05900 15.22000  -6.44000  1.000 31.40000 ?  287 GLU A HG2  1 
ATOM   4353 H  HG3  . GLU A 1 283 ? 21.48400 14.99200  -4.97500  1.000 31.40000 ?  287 GLU A HG3  1 
ATOM   4354 N  N    . GLY A 1 284 ? 17.58900 17.49100  -6.07000  1.000 17.69159 ?  288 GLY A N    1 
ATOM   4355 C  CA   . GLY A 1 284 ? 16.40700 18.08700  -6.66300  1.000 18.17060 ?  288 GLY A CA   1 
ATOM   4356 C  C    . GLY A 1 284 ? 16.46000 19.59900  -6.68200  1.000 18.43379 ?  288 GLY A C    1 
ATOM   4357 O  O    . GLY A 1 284 ? 15.86500 20.23800  -7.55300  1.000 20.56826 ?  288 GLY A O    1 
ATOM   4358 H  H    . GLY A 1 284 ? 17.44600 17.04300  -5.35000  1.000 21.22000 ?  288 GLY A H    1 
ATOM   4359 H  HA2  . GLY A 1 284 ? 16.31600 17.77400  -7.57700  1.000 21.80000 ?  288 GLY A HA2  1 
ATOM   4360 H  HA3  . GLY A 1 284 ? 15.62500 17.81600  -6.15800  1.000 21.80000 ?  288 GLY A HA3  1 
ATOM   4361 N  N    . LEU A 1 285 ? 17.16600 20.19100  -5.72800  1.000 17.96531 ?  289 LEU A N    1 
ATOM   4362 C  CA   . LEU A 1 285 ? 17.34600 21.63500  -5.68300  1.000 18.57065 ?  289 LEU A CA   1 
ATOM   4363 C  C    . LEU A 1 285 ? 18.50200 22.11100  -6.55800  1.000 19.63130 ?  289 LEU A C    1 
ATOM   4364 O  O    . LEU A 1 285 ? 18.72200 23.32300  -6.66400  1.000 19.96292 ?  289 LEU A O    1 
ATOM   4365 C  CB   . LEU A 1 285 ? 17.55100 22.09900  -4.23900  1.000 17.65212 ?  289 LEU A CB   1 
ATOM   4366 C  CG   . LEU A 1 285 ? 16.32500 21.97900  -3.33000  1.000 17.08889 ?  289 LEU A CG   1 
ATOM   4367 C  CD1  . LEU A 1 285 ? 16.70600 22.36800  -1.91000  1.000 18.01532 ?  289 LEU A CD1  1 
ATOM   4368 C  CD2  . LEU A 1 285 ? 15.15200 22.83300  -3.83300  1.000 18.06269 ?  289 LEU A CD2  1 
ATOM   4369 H  H    . LEU A 1 285 ? 17.55600 19.77200  -5.08700  1.000 21.56000 ?  289 LEU A H    1 
ATOM   4370 H  HA   . LEU A 1 285 ? 16.53700 22.05900  -6.00800  1.000 22.28000 ?  289 LEU A HA   1 
ATOM   4371 H  HB2  . LEU A 1 285 ? 18.25800 21.56500  -3.84400  1.000 21.18000 ?  289 LEU A HB2  1 
ATOM   4372 H  HB3  . LEU A 1 285 ? 17.81100 23.03400  -4.25300  1.000 21.18000 ?  289 LEU A HB3  1 
ATOM   4373 H  HG   . LEU A 1 285 ? 16.01900 21.05900  -3.33600  1.000 20.51000 ?  289 LEU A HG   1 
ATOM   4374 H  HD11 . LEU A 1 285 ? 15.92300 22.29800  -1.34200  1.000 21.62000 ?  289 LEU A HD11 1 
ATOM   4375 H  HD12 . LEU A 1 285 ? 17.39900 21.76700  -1.59400  1.000 21.62000 ?  289 LEU A HD12 1 
ATOM   4376 H  HD13 . LEU A 1 285 ? 17.03500 23.28000  -1.91000  1.000 21.62000 ?  289 LEU A HD13 1 
ATOM   4377 H  HD21 . LEU A 1 285 ? 14.45300 22.83700  -3.16200  1.000 21.67000 ?  289 LEU A HD21 1 
ATOM   4378 H  HD22 . LEU A 1 285 ? 15.46500 23.73800  -3.99000  1.000 21.67000 ?  289 LEU A HD22 1 
ATOM   4379 H  HD23 . LEU A 1 285 ? 14.81600 22.45200  -4.65900  1.000 21.67000 ?  289 LEU A HD23 1 
ATOM   4380 N  N    . GLY A 1 286 ? 19.24500 21.19800  -7.18400  1.000 19.84975 ?  290 GLY A N    1 
ATOM   4381 C  CA   . GLY A 1 286 ? 20.38700 21.60900  -7.97800  1.000 21.62891 ?  290 GLY A CA   1 
ATOM   4382 C  C    . GLY A 1 286 ? 21.56900 22.06900  -7.16800  1.000 23.28437 ?  290 GLY A C    1 
ATOM   4383 O  O    . GLY A 1 286 ? 22.43800 22.77400  -7.68600  1.000 25.01616 ?  290 GLY A O    1 
ATOM   4384 H  H    . GLY A 1 286 ? 19.10600 20.34900  -7.16300  1.000 23.82000 ?  290 GLY A H    1 
ATOM   4385 H  HA2  . GLY A 1 286 ? 20.67400 20.86100  -8.52500  1.000 25.95000 ?  290 GLY A HA2  1 
ATOM   4386 H  HA3  . GLY A 1 286 ? 20.12000 22.33900  -8.55700  1.000 25.95000 ?  290 GLY A HA3  1 
ATOM   4387 N  N    . VAL A 1 287 ? 21.62800 21.68800  -5.90300  1.000 23.93971 ?  291 VAL A N    1 
ATOM   4388 C  CA   . VAL A 1 287 ? 22.73700 22.04500  -5.02700  1.000 25.40831 ?  291 VAL A CA   1 
ATOM   4389 C  C    . VAL A 1 287 ? 23.81900 20.99100  -5.21200  1.000 26.69004 ?  291 VAL A C    1 
ATOM   4390 O  O    . VAL A 1 287 ? 23.61400 19.82500  -4.86700  1.000 28.74818 ?  291 VAL A O    1 
ATOM   4391 C  CB   . VAL A 1 287 ? 22.27900 22.13400  -3.56500  1.000 26.16103 ?  291 VAL A CB   1 
ATOM   4392 C  CG1  . VAL A 1 287 ? 23.46100 22.39000  -2.65600  1.000 27.16905 ?  291 VAL A CG1  1 
ATOM   4393 C  CG2  . VAL A 1 287 ? 21.23100 23.22600  -3.41600  1.000 25.76888 ?  291 VAL A CG2  1 
ATOM   4394 H  H    . VAL A 1 287 ? 21.02600 21.21000  -5.51700  1.000 28.73000 ?  291 VAL A H    1 
ATOM   4395 H  HA   . VAL A 1 287 ? 23.10000 22.90700  -5.28500  1.000 30.48000 ?  291 VAL A HA   1 
ATOM   4396 H  HB   . VAL A 1 287 ? 21.88000 21.29100  -3.30000  1.000 31.39000 ?  291 VAL A HB   1 
ATOM   4397 H  HG11 . VAL A 1 287 ? 23.13600 22.66300  -1.78400  1.000 32.60000 ?  291 VAL A HG11 1 
ATOM   4398 H  HG12 . VAL A 1 287 ? 23.98000 21.57400  -2.57500  1.000 32.60000 ?  291 VAL A HG12 1 
ATOM   4399 H  HG13 . VAL A 1 287 ? 24.00900 23.09200  -3.04000  1.000 32.60000 ?  291 VAL A HG13 1 
ATOM   4400 H  HG21 . VAL A 1 287 ? 20.89300 23.21700  -2.50700  1.000 30.92000 ?  291 VAL A HG21 1 
ATOM   4401 H  HG22 . VAL A 1 287 ? 21.64000 24.08400  -3.60900  1.000 30.92000 ?  291 VAL A HG22 1 
ATOM   4402 H  HG23 . VAL A 1 287 ? 20.50800 23.05600  -4.04000  1.000 30.92000 ?  291 VAL A HG23 1 
ATOM   4403 N  N    . ASN A 1 288 ? 24.96700 21.40300  -5.75100  1.000 26.05049 ?  292 ASN A N    1 
ATOM   4404 C  CA   . ASN A 1 288 ? 26.05500 20.47300  -5.98400  1.000 25.78467 ?  292 ASN A CA   1 
ATOM   4405 C  C    . ASN A 1 288 ? 26.70600 20.11600  -4.65600  1.000 27.37433 ?  292 ASN A C    1 
ATOM   4406 O  O    . ASN A 1 288 ? 27.11700 21.00200  -3.89800  1.000 28.12969 ?  292 ASN A O    1 
ATOM   4407 C  CB   . ASN A 1 288 ? 27.10000 21.10100  -6.89800  1.000 25.52938 ?  292 ASN A CB   1 
ATOM   4408 C  CG   . ASN A 1 288 ? 28.21100 20.13800  -7.23900  1.000 25.55043 ?  292 ASN A CG   1 
ATOM   4409 O  OD1  . ASN A 1 288 ? 27.95600 19.06500  -7.77600  1.000 28.94031 ?  292 ASN A OD1  1 
ATOM   4410 N  ND2  . ASN A 1 288 ? 29.45600 20.51400  -6.93600  1.000 22.60271 ?  292 ASN A ND2  1 
ATOM   4411 H  H    . ASN A 1 288 ? 25.13400 22.21300  -5.98800  1.000 31.26000 ?  292 ASN A H    1 
ATOM   4412 H  HA   . ASN A 1 288 ? 25.71200 19.67100  -6.40800  1.000 30.94000 ?  292 ASN A HA   1 
ATOM   4413 H  HB2  . ASN A 1 288 ? 26.67500 21.37700  -7.72500  1.000 30.63000 ?  292 ASN A HB2  1 
ATOM   4414 H  HB3  . ASN A 1 288 ? 27.49200 21.86900  -6.45400  1.000 30.63000 ?  292 ASN A HB3  1 
ATOM   4415 H  HD21 . ASN A 1 288 ? 30.11800 19.99300  -7.11400  1.000 27.12000 ?  292 ASN A HD21 1 
ATOM   4416 H  HD22 . ASN A 1 288 ? 29.59700 21.27600  -6.56400  1.000 27.12000 ?  292 ASN A HD22 1 
ATOM   4417 N  N    . GLY A 1 289 ? 26.80300 18.82000  -4.37200  1.000 28.80609 ?  293 GLY A N    1 
ATOM   4418 C  CA   . GLY A 1 289 ? 27.46100 18.36400  -3.15700  1.000 30.77211 ?  293 GLY A CA   1 
ATOM   4419 C  C    . GLY A 1 289 ? 28.73300 17.56200  -3.37800  1.000 32.69076 ?  293 GLY A C    1 
ATOM   4420 O  O    . GLY A 1 289 ? 29.26300 17.50800  -4.48300  1.000 34.96209 ?  293 GLY A O    1 
ATOM   4421 H  H    . GLY A 1 289 ? 26.49600 18.18800  -4.86700  1.000 34.56000 ?  293 GLY A H    1 
ATOM   4422 H  HA2  . GLY A 1 289 ? 27.69100 19.13800  -2.61900  1.000 36.92000 ?  293 GLY A HA2  1 
ATOM   4423 H  HA3  . GLY A 1 289 ? 26.84300 17.80600  -2.65900  1.000 36.92000 ?  293 GLY A HA3  1 
HETATM 4424 C  C1   A GOL B 2 .   ? 26.14500 30.39000  9.59800   0.630 22.48691 ?  301 GOL A C1   1 
HETATM 4425 C  C1   B GOL B 2 .   ? 25.95200 30.42600  9.48900   0.370 28.36656 ?  301 GOL A C1   1 
HETATM 4426 O  O1   A GOL B 2 .   ? 26.89700 29.20200  9.70400   0.630 21.79209 ?  301 GOL A O1   1 
HETATM 4427 O  O1   B GOL B 2 .   ? 26.64200 29.18600  9.36700   0.370 28.44815 ?  301 GOL A O1   1 
HETATM 4428 C  C2   A GOL B 2 .   ? 25.29300 30.54400  10.87000  0.630 22.71062 ?  301 GOL A C2   1 
HETATM 4429 C  C2   B GOL B 2 .   ? 25.18000 30.36700  10.81200  0.370 28.03231 ?  301 GOL A C2   1 
HETATM 4430 O  O2   A GOL B 2 .   ? 26.05700 30.60000  12.01500  0.630 21.91052 ?  301 GOL A O2   1 
HETATM 4431 O  O2   B GOL B 2 .   ? 26.02300 30.42800  11.92200  0.370 27.84544 ?  301 GOL A O2   1 
HETATM 4432 C  C3   A GOL B 2 .   ? 24.45800 31.82900  10.62800  0.630 22.77378 ?  301 GOL A C3   1 
HETATM 4433 C  C3   B GOL B 2 .   ? 24.16400 31.54000  10.81900  0.370 27.46382 ?  301 GOL A C3   1 
HETATM 4434 O  O3   A GOL B 2 .   ? 23.37600 31.82200  11.56200  0.630 23.47387 ?  301 GOL A O3   1 
HETATM 4435 O  O3   B GOL B 2 .   ? 24.84800 32.75000  11.15100  0.370 27.03745 ?  301 GOL A O3   1 
HETATM 4436 H  H11  A GOL B 2 .   ? 25.55800 30.38600  8.82500   0.630 26.98000 ?  301 GOL A H11  1 
HETATM 4437 H  H11  B GOL B 2 .   ? 25.33200 30.58300  8.75900   0.370 34.03000 ?  301 GOL A H11  1 
HETATM 4438 H  H12  A GOL B 2 .   ? 26.70700 31.17500  9.50000   0.630 26.98000 ?  301 GOL A H12  1 
HETATM 4439 H  H12  B GOL B 2 .   ? 26.55100 31.18900  9.49700   0.370 34.03000 ?  301 GOL A H12  1 
HETATM 4440 H  HO1  A GOL B 2 .   ? 26.72000 28.74000  9.00400   0.630 26.15000 ?  301 GOL A HO1  1 
HETATM 4441 H  HO1  B GOL B 2 .   ? 26.06400 28.54800  9.53800   0.370 34.13000 ?  301 GOL A HO1  1 
HETATM 4442 H  H2   A GOL B 2 .   ? 24.71600 29.77400  10.99200  0.630 27.25000 ?  301 GOL A H2   1 
HETATM 4443 H  H2   B GOL B 2 .   ? 24.71000 29.51900  10.84800  0.370 33.64000 ?  301 GOL A H2   1 
HETATM 4444 H  HO2  A GOL B 2 .   ? 26.50800 31.31500  12.00600  0.630 26.29000 ?  301 GOL A HO2  1 
HETATM 4445 H  HO2  B GOL B 2 .   ? 25.79700 29.81800  12.47400  0.370 33.41000 ?  301 GOL A HO2  1 
HETATM 4446 H  H31  A GOL B 2 .   ? 24.16600 31.84000  9.70400   0.630 27.33000 ?  301 GOL A H31  1 
HETATM 4447 H  H31  B GOL B 2 .   ? 23.45500 31.32300  11.44400  0.370 32.95000 ?  301 GOL A H31  1 
HETATM 4448 H  H32  A GOL B 2 .   ? 25.04000 32.59900  10.72200  0.630 27.33000 ?  301 GOL A H32  1 
HETATM 4449 H  H32  B GOL B 2 .   ? 23.73600 31.57500  9.94900   0.370 32.95000 ?  301 GOL A H32  1 
HETATM 4450 H  HO3  A GOL B 2 .   ? 23.56900 32.35400  12.18300  0.630 28.17000 ?  301 GOL A HO3  1 
HETATM 4451 H  HO3  B GOL B 2 .   ? 25.23900 32.63000  11.90400  0.370 32.44000 ?  301 GOL A HO3  1 
HETATM 4452 S  S    . SO4 C 3 .   ? 21.04100 2.21400   9.65100   0.740 21.87631 ?  302 SO4 A S    1 
HETATM 4453 O  O1   . SO4 C 3 .   ? 21.28300 3.05400   8.49100   0.740 21.29729 ?  302 SO4 A O1   1 
HETATM 4454 O  O2   . SO4 C 3 .   ? 20.64200 0.93000   9.20100   0.740 27.47171 ?  302 SO4 A O2   1 
HETATM 4455 O  O3   . SO4 C 3 .   ? 22.26800 2.02900   10.45500  0.740 26.78742 -1 302 SO4 A O3   1 
HETATM 4456 O  O4   . SO4 C 3 .   ? 20.02700 2.76400   10.61100  0.740 18.26798 ?  302 SO4 A O4   1 
HETATM 4457 S  S    . SO4 D 3 .   ? -0.07800 6.56400   -1.19200  1.000 60.68096 ?  303 SO4 A S    1 
HETATM 4458 O  O1   . SO4 D 3 .   ? 0.05100  7.96300   -1.56000  1.000 63.02861 ?  303 SO4 A O1   1 
HETATM 4459 O  O2   . SO4 D 3 .   ? -1.15100 6.00400   -1.95000  1.000 65.80263 ?  303 SO4 A O2   1 
HETATM 4460 O  O3   . SO4 D 3 .   ? -0.35800 6.37900   0.20800   1.000 68.15028 -1 303 SO4 A O3   1 
HETATM 4461 O  O4   . SO4 D 3 .   ? 1.14800  5.85200   -1.51500  1.000 56.77260 ?  303 SO4 A O4   1 
HETATM 4462 C  C12  A XR9 E 4 .   ? 14.18200 9.80500   22.09300  0.620 14.52279 ?  304 XR9 A C12  1 
HETATM 4463 C  C11  A XR9 E 4 .   ? 13.09600 9.20300   22.73200  0.620 17.65475 ?  304 XR9 A C11  1 
HETATM 4464 C  C9   A XR9 E 4 .   ? 14.51700 7.74700   23.95500  0.620 17.12837 ?  304 XR9 A C9   1 
HETATM 4465 C  C7   A XR9 E 4 .   ? 15.45000 9.33400   22.43200  0.620 16.64673 ?  304 XR9 A C7   1 
HETATM 4466 C  C4   A XR9 E 4 .   ? 16.54000 10.02400  21.66900  0.620 18.27588 ?  304 XR9 A C4   1 
HETATM 4467 N  N6   A XR9 E 4 .   ? 17.57500 8.15100   20.08300  0.620 24.24501 ?  304 XR9 A N6   1 
HETATM 4468 B  B2   A XR9 E 4 .   ? 14.35700 10.90700  20.96000  0.620 12.88576 ?  304 XR9 A B2   1 
HETATM 4469 C  C10  A XR9 E 4 .   ? 13.26100 8.19200   23.63800  0.620 17.62580 ?  304 XR9 A C10  1 
HETATM 4470 C  C5   A XR9 E 4 .   ? 17.12000 8.95200   20.80900  0.620 22.68956 ?  304 XR9 A C5   1 
HETATM 4471 C  C8   A XR9 E 4 .   ? 15.62100 8.31100   23.36000  0.620 17.15995 ?  304 XR9 A C8   1 
HETATM 4472 O  O1   A XR9 E 4 .   ? 13.82100 10.41100  19.71300  0.620 12.07250 ?  304 XR9 A O1   1 
HETATM 4473 O  O3   A XR9 E 4 .   ? 15.88400 10.93600  20.80600  0.620 15.22288 ?  304 XR9 A O3   1 
HETATM 4474 H  H11  A XR9 E 4 .   ? 12.18900 9.50100   22.52200  0.620 16.92000 ?  304 XR9 A H11  1 
HETATM 4475 H  H9   A XR9 E 4 .   ? 14.62900 7.02900   24.60600  0.620 16.59000 ?  304 XR9 A H9   1 
HETATM 4476 H  H4   A XR9 E 4 .   ? 17.20300 10.45200  22.24800  0.620 17.99000 ?  304 XR9 A H4   1 
HETATM 4477 H  H10  A XR9 E 4 .   ? 12.47600 7.78400   24.05700  0.620 17.54000 ?  304 XR9 A H10  1 
HETATM 4478 H  H8   A XR9 E 4 .   ? 16.51800 7.99300   23.58700  0.620 16.89000 ?  304 XR9 A H8   1 
HETATM 4479 H  H1   A XR9 E 4 .   ? 13.06700 10.05500  19.91900  0.620 11.80000 ?  304 XR9 A H1   1 
HETATM 4480 S  S    B SO4 F 3 .   ? 17.45700 10.70100  18.93700  0.380 15.93875 ?  305 SO4 A S    1 
HETATM 4481 O  O1   B SO4 F 3 .   ? 17.89800 9.71900   17.98500  0.380 19.08650 ?  305 SO4 A O1   1 
HETATM 4482 O  O2   B SO4 F 3 .   ? 16.73900 11.67700  18.16100  0.380 14.28329 ?  305 SO4 A O2   1 
HETATM 4483 O  O3   B SO4 F 3 .   ? 16.67900 10.12600  19.95300  0.380 20.91040 ?  305 SO4 A O3   1 
HETATM 4484 O  O4   B SO4 F 3 .   ? 18.65500 11.30300  19.48300  0.380 16.37038 ?  305 SO4 A O4   1 
HETATM 4485 S  S    A SO4 G 3 .   ? -2.88900 6.00900   25.07000  0.810 52.89582 ?  306 SO4 A S    1 
HETATM 4486 O  O1   A SO4 G 3 .   ? -2.20700 5.77600   23.82600  0.810 56.93577 ?  306 SO4 A O1   1 
HETATM 4487 O  O2   A SO4 G 3 .   ? -4.31400 5.73800   24.89600  0.810 64.51300 ?  306 SO4 A O2   1 
HETATM 4488 O  O3   A SO4 G 3 .   ? -2.32200 5.13300   26.07400  0.810 66.14740 ?  306 SO4 A O3   1 
HETATM 4489 O  O4   A SO4 G 3 .   ? -2.66800 7.41500   25.44100  0.810 49.70596 ?  306 SO4 A O4   1 
HETATM 4490 NA NA   A NA  H 5 .   ? 16.93800 11.46400  18.38000  0.610 31.84066 ?  307 NA  A NA   1 
HETATM 4491 O  O    . HOH I 6 .   ? 6.33900  24.87600  -1.69600  1.000 66.30005 ?  401 HOH A O    1 
HETATM 4492 O  O    . HOH I 6 .   ? 6.47100  -7.17700  12.27000  1.000 32.04332 ?  402 HOH A O    1 
HETATM 4493 O  O    . HOH I 6 .   ? 23.37100 30.99200  30.91000  1.000 56.14094 ?  403 HOH A O    1 
HETATM 4494 O  O    . HOH I 6 .   ? 8.61900  -5.91300  11.16000  1.000 39.22312 ?  404 HOH A O    1 
HETATM 4495 O  O    . HOH I 6 .   ? 11.02500 33.32900  7.73500   1.000 32.18544 ?  405 HOH A O    1 
HETATM 4496 O  O    . HOH I 6 .   ? 23.44400 17.41900  -4.95600  1.000 48.62951 ?  406 HOH A O    1 
HETATM 4497 O  O    . HOH I 6 .   ? 31.59600 17.06800  -4.91800  1.000 24.98194 ?  407 HOH A O    1 
HETATM 4498 O  O    . HOH I 6 .   ? 7.09400  26.66700  2.08200   1.000 32.71708 ?  408 HOH A O    1 
HETATM 4499 O  O    . HOH I 6 .   ? 5.78300  8.53900   32.31500  1.000 44.78958 ?  409 HOH A O    1 
HETATM 4500 O  O    . HOH I 6 .   ? 14.12800 41.64000  25.04700  1.000 63.29443 ?  410 HOH A O    1 
HETATM 4501 O  O    . HOH I 6 .   ? 6.18400  26.60700  -5.95500  1.000 45.54493 ?  411 HOH A O    1 
HETATM 4502 O  O    . HOH I 6 .   ? 6.77200  -8.91700  14.91300  1.000 32.84078 ?  412 HOH A O    1 
HETATM 4503 O  O    . HOH I 6 .   ? 12.35000 7.80300   36.37400  1.000 44.17635 ?  413 HOH A O    1 
HETATM 4504 O  O    B HOH I 6 .   ? 13.80000 10.40400  19.68300  0.370 33.70141 ?  414 HOH A O    1 
HETATM 4505 O  O    . HOH I 6 .   ? 16.51100 24.09700  45.84500  1.000 50.89031 ?  415 HOH A O    1 
HETATM 4506 O  O    . HOH I 6 .   ? 11.32200 11.68700  21.88800  1.000 23.09224 ?  416 HOH A O    1 
HETATM 4507 O  O    . HOH I 6 .   ? 28.03400 9.51000   35.47000  1.000 51.34300 ?  417 HOH A O    1 
HETATM 4508 O  O    . HOH I 6 .   ? 9.55700  -9.18200  13.02800  1.000 57.33319 ?  418 HOH A O    1 
HETATM 4509 O  O    . HOH I 6 .   ? 12.76400 34.53700  5.83700   1.000 56.75681 ?  419 HOH A O    1 
HETATM 4510 O  O    . HOH I 6 .   ? 25.11300 15.57800  -1.16800  1.000 46.08710 ?  420 HOH A O    1 
HETATM 4511 O  O    . HOH I 6 .   ? 3.77400  29.25000  25.07900  1.000 27.57962 ?  421 HOH A O    1 
HETATM 4512 O  O    . HOH I 6 .   ? 20.14700 18.59000  43.98300  1.000 63.18389 ?  422 HOH A O    1 
HETATM 4513 O  O    . HOH I 6 .   ? 2.24200  28.72900  -7.28300  1.000 52.69053 ?  423 HOH A O    1 
HETATM 4514 O  O    . HOH I 6 .   ? 24.54400 30.61500  33.91800  1.000 35.43056 ?  424 HOH A O    1 
HETATM 4515 O  O    . HOH I 6 .   ? 9.00900  29.63300  6.54200   1.000 20.78407 ?  425 HOH A O    1 
HETATM 4516 O  O    . HOH I 6 .   ? 15.33600 32.89300  4.84700   1.000 41.24179 ?  426 HOH A O    1 
HETATM 4517 O  O    A HOH I 6 .   ? 18.42400 9.23900   17.43000  0.440 17.30997 ?  427 HOH A O    1 
HETATM 4518 O  O    . HOH I 6 .   ? 9.61500  -1.14700  -5.24000  1.000 33.06975 ?  428 HOH A O    1 
HETATM 4519 O  O    . HOH I 6 .   ? 21.42900 10.12200  -4.72400  1.000 35.94378 ?  429 HOH A O    1 
HETATM 4520 O  O    . HOH I 6 .   ? 28.34800 29.26600  7.37600   1.000 23.67389 ?  430 HOH A O    1 
HETATM 4521 O  O    . HOH I 6 .   ? 19.02000 16.17500  43.17600  1.000 31.06425 ?  431 HOH A O    1 
HETATM 4522 O  O    . HOH I 6 .   ? 6.00900  21.85000  12.75300  1.000 12.97787 ?  432 HOH A O    1 
HETATM 4523 O  O    . HOH I 6 .   ? 24.85600 29.40600  2.74800   1.000 24.23185 ?  433 HOH A O    1 
HETATM 4524 O  O    . HOH I 6 .   ? 3.93800  23.78200  33.87700  1.000 50.71661 ?  434 HOH A O    1 
HETATM 4525 O  O    . HOH I 6 .   ? 19.35700 0.96800   6.83500   1.000 49.34013 ?  435 HOH A O    1 
HETATM 4526 O  O    . HOH I 6 .   ? 1.33600  -1.42100  21.28200  1.000 46.41872 ?  436 HOH A O    1 
HETATM 4527 O  O    . HOH I 6 .   ? 3.89800  -4.47000  21.79000  1.000 24.71612 ?  437 HOH A O    1 
HETATM 4528 O  O    . HOH I 6 .   ? 28.03600 32.34000  11.86700  1.000 43.70524 ?  438 HOH A O    1 
HETATM 4529 O  O    . HOH I 6 .   ? 11.93800 -5.91400  12.32300  1.000 53.31692 ?  439 HOH A O    1 
HETATM 4530 O  O    . HOH I 6 .   ? 25.22400 32.47500  -5.13700  1.000 46.48715 ?  440 HOH A O    1 
HETATM 4531 O  O    . HOH I 6 .   ? 22.59500 24.05500  40.12600  1.000 23.83444 ?  441 HOH A O    1 
HETATM 4532 O  O    . HOH I 6 .   ? 13.01100 32.57300  -7.64000  1.000 38.18353 ?  442 HOH A O    1 
HETATM 4533 O  O    . HOH I 6 .   ? 13.06000 34.21700  34.32300  1.000 54.73551 ?  443 HOH A O    1 
HETATM 4534 O  O    . HOH I 6 .   ? 28.94500 27.43300  5.25400   1.000 27.33486 ?  444 HOH A O    1 
HETATM 4535 O  O    . HOH I 6 .   ? 1.15100  -4.23500  8.26400   1.000 25.01879 ?  445 HOH A O    1 
HETATM 4536 O  O    . HOH I 6 .   ? 6.58300  10.82800  31.71000  1.000 46.85562 ?  446 HOH A O    1 
HETATM 4537 O  O    . HOH I 6 .   ? 20.95900 28.29100  -2.18900  1.000 23.93971 ?  447 HOH A O    1 
HETATM 4538 O  O    . HOH I 6 .   ? 19.87200 15.39300  19.50900  1.000 20.48667 ?  448 HOH A O    1 
HETATM 4539 O  O    . HOH I 6 .   ? 11.79900 15.57100  42.11700  1.000 30.53524 ?  449 HOH A O    1 
HETATM 4540 O  O    . HOH I 6 .   ? 25.43600 11.60200  21.30000  1.000 39.00994 ?  450 HOH A O    1 
HETATM 4541 O  O    . HOH I 6 .   ? 28.45100 12.05200  18.19700  1.000 54.24861 ?  451 HOH A O    1 
HETATM 4542 O  O    . HOH I 6 .   ? 2.01400  7.46100   4.12500   1.000 21.03673 ?  452 HOH A O    1 
HETATM 4543 O  O    . HOH I 6 .   ? 16.81800 27.32300  -7.17000  1.000 46.02920 ?  453 HOH A O    1 
HETATM 4544 O  O    . HOH I 6 .   ? 11.89400 -0.12700  20.73500  1.000 49.86914 ?  454 HOH A O    1 
HETATM 4545 O  O    . HOH I 6 .   ? 4.42600  5.78200   13.03100  1.000 14.13327 ?  455 HOH A O    1 
HETATM 4546 O  O    . HOH I 6 .   ? 1.39800  20.98900  7.09800   1.000 22.84221 ?  456 HOH A O    1 
HETATM 4547 O  O    . HOH I 6 .   ? 0.93500  7.58200   18.96200  1.000 13.28054 ?  457 HOH A O    1 
HETATM 4548 O  O    . HOH I 6 .   ? 23.84600 4.35300   11.34900  1.000 41.02334 ?  458 HOH A O    1 
HETATM 4549 O  O    . HOH I 6 .   ? 2.24800  25.06500  5.34000   1.000 22.71062 ?  459 HOH A O    1 
HETATM 4550 O  O    . HOH I 6 .   ? 1.36300  8.58600   14.94500  1.000 13.39634 ?  460 HOH A O    1 
HETATM 4551 O  O    . HOH I 6 .   ? 28.59900 19.46800  20.68400  1.000 27.15062 ?  461 HOH A O    1 
HETATM 4552 O  O    . HOH I 6 .   ? 23.17400 31.06600  37.87800  1.000 35.65954 ?  462 HOH A O    1 
HETATM 4553 O  O    . HOH I 6 .   ? 17.11600 25.38500  -5.96900  1.000 26.20051 ?  463 HOH A O    1 
HETATM 4554 O  O    . HOH I 6 .   ? 8.38400  16.98000  -10.82300 1.000 37.13603 ?  464 HOH A O    1 
HETATM 4555 O  O    . HOH I 6 .   ? 19.56100 2.28200   13.23300  1.000 59.31501 ?  465 HOH A O    1 
HETATM 4556 O  O    . HOH I 6 .   ? 4.18400  20.65500  -1.66700  1.000 19.18388 ?  466 HOH A O    1 
HETATM 4557 O  O    . HOH I 6 .   ? 28.15000 29.34200  14.66300  1.000 27.64016 ?  467 HOH A O    1 
HETATM 4558 O  O    . HOH I 6 .   ? 22.96800 10.00600  13.22200  1.000 17.35208 ?  468 HOH A O    1 
HETATM 4559 O  O    . HOH I 6 .   ? 5.53000  4.34400   -2.66900  1.000 23.11593 ?  469 HOH A O    1 
HETATM 4560 O  O    . HOH I 6 .   ? 18.25200 8.34900   32.93200  1.000 39.53895 ?  470 HOH A O    1 
HETATM 4561 O  O    . HOH I 6 .   ? 24.27600 28.46400  31.53600  1.000 22.66061 ?  471 HOH A O    1 
HETATM 4562 O  O    . HOH I 6 .   ? 28.83100 10.86700  4.32100   1.000 38.12826 ?  472 HOH A O    1 
HETATM 4563 O  O    . HOH I 6 .   ? 10.67800 35.50700  19.86300  1.000 59.67558 ?  473 HOH A O    1 
HETATM 4564 O  O    . HOH I 6 .   ? 4.31900  9.31300   18.56200  1.000 20.42350 ?  474 HOH A O    1 
HETATM 4565 O  O    . HOH I 6 .   ? 1.81600  9.68100   17.46300  1.000 15.49659 ?  475 HOH A O    1 
HETATM 4566 O  O    . HOH I 6 .   ? 7.31000  -2.62700  6.55000   1.000 27.55067 ?  476 HOH A O    1 
HETATM 4567 O  O    . HOH I 6 .   ? 26.59700 7.61900   7.96100   1.000 27.63752 ?  477 HOH A O    1 
HETATM 4568 O  O    . HOH I 6 .   ? 18.87300 35.32900  7.91300   1.000 33.47770 ?  478 HOH A O    1 
HETATM 4569 O  O    . HOH I 6 .   ? 22.84400 32.68000  24.88500  1.000 38.38355 ?  479 HOH A O    1 
HETATM 4570 O  O    . HOH I 6 .   ? 16.82000 2.06400   -1.77900  1.000 40.33905 ?  480 HOH A O    1 
HETATM 4571 O  O    . HOH I 6 .   ? 22.16800 15.45000  10.49300  1.000 13.16210 ?  481 HOH A O    1 
HETATM 4572 O  O    . HOH I 6 .   ? 3.40000  4.14900   10.96600  1.000 16.09930 ?  482 HOH A O    1 
HETATM 4573 O  O    . HOH I 6 .   ? 3.54400  27.83200  2.93200   1.000 39.12574 ?  483 HOH A O    1 
HETATM 4574 O  O    . HOH I 6 .   ? 28.48800 12.98200  8.93100   1.000 28.50342 ?  484 HOH A O    1 
HETATM 4575 O  O    . HOH I 6 .   ? 19.53700 15.98400  17.98200  1.000 29.77725 ?  485 HOH A O    1 
HETATM 4576 O  O    . HOH I 6 .   ? 3.83500  26.23000  8.64900   1.000 18.33641 ?  486 HOH A O    1 
HETATM 4577 O  O    . HOH I 6 .   ? 18.65600 34.78100  25.54600  1.000 29.13507 ?  487 HOH A O    1 
HETATM 4578 O  O    . HOH I 6 .   ? 8.98200  3.90500   21.91000  1.000 32.81972 ?  488 HOH A O    1 
HETATM 4579 O  O    . HOH I 6 .   ? 28.27000 18.54400  15.92400  1.000 29.42458 ?  489 HOH A O    1 
HETATM 4580 O  O    . HOH I 6 .   ? 20.81700 33.05000  11.09100  1.000 26.32158 ?  490 HOH A O    1 
HETATM 4581 O  O    . HOH I 6 .   ? 27.89300 25.17900  18.00000  1.000 29.00611 ?  491 HOH A O    1 
HETATM 4582 O  O    . HOH I 6 .   ? 28.91400 18.68100  23.39900  1.000 39.38104 ?  492 HOH A O    1 
HETATM 4583 O  O    . HOH I 6 .   ? 20.18400 9.71300   15.87600  1.000 28.75082 ?  493 HOH A O    1 
HETATM 4584 O  O    . HOH I 6 .   ? 23.41000 6.79000   15.25300  1.000 34.97788 ?  494 HOH A O    1 
HETATM 4585 O  O    . HOH I 6 .   ? 29.24400 19.60200  7.10600   1.000 29.84568 ?  495 HOH A O    1 
HETATM 4586 O  O    . HOH I 6 .   ? 3.29600  2.10800   20.09900  1.000 23.55282 ?  496 HOH A O    1 
HETATM 4587 O  O    . HOH I 6 .   ? 25.34800 15.33600  14.83500  1.000 16.23616 ?  497 HOH A O    1 
HETATM 4588 O  O    . HOH I 6 .   ? 1.38900  0.11300   19.02900  1.000 26.67951 ?  498 HOH A O    1 
HETATM 4589 O  O    . HOH I 6 .   ? 22.45700 6.58000   2.69500   1.000 19.79448 ?  499 HOH A O    1 
HETATM 4590 O  O    . HOH I 6 .   ? 12.18100 22.72800  -7.46400  1.000 23.52914 ?  500 HOH A O    1 
HETATM 4591 O  O    . HOH I 6 .   ? 21.40700 36.11800  14.44000  1.000 43.24729 ?  501 HOH A O    1 
HETATM 4592 O  O    . HOH I 6 .   ? 23.87000 6.92300   7.12300   1.000 20.69459 ?  502 HOH A O    1 
HETATM 4593 O  O    . HOH I 6 .   ? 22.89900 10.10700  38.33900  1.000 24.98721 ?  503 HOH A O    1 
HETATM 4594 O  O    . HOH I 6 .   ? 5.57500  27.60600  10.31600  1.000 15.30710 ?  504 HOH A O    1 
HETATM 4595 O  O    . HOH I 6 .   ? 0.00000  0.00000   9.94100   0.490 13.46477 ?  505 HOH A O    1 
HETATM 4596 O  O    . HOH I 6 .   ? 6.42600  1.52100   1.05900   1.000 26.23999 ?  506 HOH A O    1 
HETATM 4597 O  O    . HOH I 6 .   ? 25.68000 22.93800  41.89800  1.000 18.78646 ?  507 HOH A O    1 
HETATM 4598 O  O    . HOH I 6 .   ? 6.27500  34.31400  18.92700  1.000 25.61886 ?  508 HOH A O    1 
HETATM 4599 O  O    . HOH I 6 .   ? 24.01300 34.57300  20.17900  1.000 31.88277 ?  509 HOH A O    1 
HETATM 4600 O  O    . HOH I 6 .   ? -3.91500 16.68400  9.83000   1.000 49.47962 ?  510 HOH A O    1 
HETATM 4601 O  O    . HOH I 6 .   ? 19.65900 18.44800  40.21600  1.000 26.36895 ?  511 HOH A O    1 
HETATM 4602 O  O    . HOH I 6 .   ? 31.48100 26.58800  5.48400   1.000 22.70535 ?  512 HOH A O    1 
HETATM 4603 O  O    . HOH I 6 .   ? 6.20500  11.97800  18.56200  1.000 13.89377 ?  513 HOH A O    1 
HETATM 4604 O  O    . HOH I 6 .   ? 7.89900  30.69700  24.40300  1.000 25.40831 ?  514 HOH A O    1 
HETATM 4605 O  O    . HOH I 6 .   ? 28.15600 32.25200  17.29300  1.000 31.40640 ?  515 HOH A O    1 
HETATM 4606 O  O    . HOH I 6 .   ? 19.09400 34.02200  36.82700  1.000 45.41860 ?  516 HOH A O    1 
HETATM 4607 O  O    . HOH I 6 .   ? 16.11100 12.59900  -11.49000 1.000 26.53476 ?  517 HOH A O    1 
HETATM 4608 O  O    . HOH I 6 .   ? 10.68400 26.66700  3.66100   1.000 37.29131 ?  518 HOH A O    1 
HETATM 4609 O  O    . HOH I 6 .   ? 0.90100  5.51600   2.54300   1.000 45.50282 ?  519 HOH A O    1 
HETATM 4610 O  O    . HOH I 6 .   ? 12.48900 4.28000   15.43300  1.000 19.30758 ?  520 HOH A O    1 
HETATM 4611 O  O    . HOH I 6 .   ? 7.98300  35.19000  17.02000  1.000 26.86112 ?  521 HOH A O    1 
HETATM 4612 O  O    . HOH I 6 .   ? 25.69500 11.20700  15.40600  1.000 17.53368 ?  522 HOH A O    1 
HETATM 4613 O  O    . HOH I 6 .   ? 8.61800  26.30100  -4.28500  1.000 33.17766 ?  523 HOH A O    1 
HETATM 4614 O  O    . HOH I 6 .   ? 2.59400  6.15500   24.85700  1.000 23.47913 ?  524 HOH A O    1 
HETATM 4615 O  O    . HOH I 6 .   ? 13.14400 19.65700  -7.84400  1.000 23.25016 ?  525 HOH A O    1 
HETATM 4616 O  O    . HOH I 6 .   ? 14.22900 5.92400   9.50800   1.000 15.47028 ?  526 HOH A O    1 
HETATM 4617 O  O    . HOH I 6 .   ? 16.92800 38.92000  27.47900  1.000 45.80812 ?  527 HOH A O    1 
HETATM 4618 O  O    . HOH I 6 .   ? -1.09600 29.86900  14.27800  1.000 22.00527 ?  528 HOH A O    1 
HETATM 4619 O  O    . HOH I 6 .   ? 2.38000  35.98400  17.22200  1.000 45.71074 ?  529 HOH A O    1 
HETATM 4620 O  O    . HOH I 6 .   ? 11.63400 16.56000  -6.48300  1.000 23.86076 ?  530 HOH A O    1 
HETATM 4621 O  O    . HOH I 6 .   ? -0.20900 31.06600  20.63100  1.000 23.35280 ?  531 HOH A O    1 
HETATM 4622 O  O    . HOH I 6 .   ? 21.70200 34.01600  13.48600  1.000 43.19465 ?  532 HOH A O    1 
HETATM 4623 O  O    . HOH I 6 .   ? 9.08200  12.05500  -6.95400  1.000 49.78492 ?  533 HOH A O    1 
HETATM 4624 O  O    . HOH I 6 .   ? 6.11600  14.62900  -4.86200  1.000 22.37374 ?  534 HOH A O    1 
HETATM 4625 O  O    . HOH I 6 .   ? 23.69900 4.48100   8.30100   1.000 30.84844 ?  535 HOH A O    1 
HETATM 4626 O  O    . HOH I 6 .   ? 2.32900  0.41200   20.97900  1.000 96.04046 ?  536 HOH A O    1 
HETATM 4627 O  O    . HOH I 6 .   ? 28.28300 21.34100  12.90600  1.000 23.50808 ?  537 HOH A O    1 
HETATM 4628 O  O    B HOH I 6 .   ? 2.45500  9.73500   7.06900   0.530 21.15780 ?  538 HOH A O    1 
HETATM 4629 O  O    . HOH I 6 .   ? 25.14600 31.94700  20.36700  1.000 28.07705 ?  539 HOH A O    1 
HETATM 4630 O  O    . HOH I 6 .   ? 25.52900 24.37200  -5.86200  1.000 30.86423 ?  540 HOH A O    1 
HETATM 4631 O  O    . HOH I 6 .   ? 14.10800 -1.16100  6.10100   1.000 34.81733 ?  541 HOH A O    1 
HETATM 4632 O  O    . HOH I 6 .   ? 17.91000 -0.33400  9.78600   1.000 50.51658 ?  542 HOH A O    1 
HETATM 4633 O  O    . HOH I 6 .   ? 17.42800 39.94400  22.16500  1.000 33.04344 ?  543 HOH A O    1 
HETATM 4634 O  O    . HOH I 6 .   ? 1.47900  25.00800  9.51600   1.000 17.76002 ?  544 HOH A O    1 
HETATM 4635 O  O    . HOH I 6 .   ? 31.73600 24.14600  -1.03000  1.000 15.24656 ?  545 HOH A O    1 
HETATM 4636 O  O    . HOH I 6 .   ? 0.38900  7.50100   10.81000  1.000 20.50509 ?  546 HOH A O    1 
HETATM 4637 O  O    . HOH I 6 .   ? -2.43800 14.23200  26.11600  1.000 38.32302 ?  547 HOH A O    1 
HETATM 4638 O  O    . HOH I 6 .   ? -5.27300 10.08400  19.41300  1.000 24.08183 ?  548 HOH A O    1 
HETATM 4639 O  O    . HOH I 6 .   ? 15.31300 7.49100   37.93400  1.000 58.77810 ?  549 HOH A O    1 
HETATM 4640 O  O    . HOH I 6 .   ? 35.21400 21.28400  7.60600   1.000 30.40101 ?  550 HOH A O    1 
HETATM 4641 O  O    . HOH I 6 .   ? 24.25600 20.79600  28.16300  1.000 26.28210 ?  551 HOH A O    1 
HETATM 4642 O  O    . HOH I 6 .   ? 18.33900 33.14300  3.19300   1.000 42.04715 ?  552 HOH A O    1 
HETATM 4643 O  O    . HOH I 6 .   ? 14.61200 33.98000  14.13100  1.000 19.41022 ?  553 HOH A O    1 
HETATM 4644 O  O    . HOH I 6 .   ? 15.66300 2.56800   0.74200   1.000 26.48212 ?  554 HOH A O    1 
HETATM 4645 O  O    . HOH I 6 .   ? -5.05700 5.62000   14.69000  1.000 17.73634 ?  555 HOH A O    1 
HETATM 4646 O  O    . HOH I 6 .   ? 8.99900  32.45200  6.50900   1.000 33.88827 ?  556 HOH A O    1 
HETATM 4647 O  O    . HOH I 6 .   ? 7.56500  -1.62600  0.40400   1.000 45.23174 ?  557 HOH A O    1 
HETATM 4648 O  O    . HOH I 6 .   ? -0.42600 30.52300  9.77400   1.000 35.74376 ?  558 HOH A O    1 
HETATM 4649 O  O    B HOH I 6 .   ? -1.99100 5.63100   23.47300  0.720 19.94976 ?  559 HOH A O    1 
HETATM 4650 O  O    . HOH I 6 .   ? 15.63400 5.89500   -5.02200  1.000 27.09535 ?  560 HOH A O    1 
HETATM 4651 O  O    . HOH I 6 .   ? 10.99600 -2.23400  -3.04500  1.000 33.19872 ?  561 HOH A O    1 
HETATM 4652 O  O    . HOH I 6 .   ? 4.23300  3.41200   5.82400   1.000 25.53727 ?  562 HOH A O    1 
HETATM 4653 O  O    . HOH I 6 .   ? -0.67800 28.05200  8.66100   1.000 58.98339 ?  563 HOH A O    1 
HETATM 4654 O  O    . HOH I 6 .   ? 3.94000  8.67300   -4.10200  1.000 50.46658 ?  564 HOH A O    1 
HETATM 4655 O  O    . HOH I 6 .   ? 19.73900 5.52600   15.03700  1.000 26.80321 ?  565 HOH A O    1 
HETATM 4656 O  O    . HOH I 6 .   ? 24.91100 26.83600  25.57300  1.000 40.02585 ?  566 HOH A O    1 
HETATM 4657 O  O    . HOH I 6 .   ? 28.07400 29.21600  20.47300  1.000 40.13639 ?  567 HOH A O    1 
HETATM 4658 O  O    . HOH I 6 .   ? 9.04800  1.95800   -7.76700  1.000 50.08232 ?  568 HOH A O    1 
HETATM 4659 O  O    . HOH I 6 .   ? -1.32000 12.64100  7.52400   1.000 27.31117 ?  569 HOH A O    1 
HETATM 4660 O  O    . HOH I 6 .   ? 5.04500  21.22700  -9.16700  1.000 47.60571 ?  570 HOH A O    1 
HETATM 4661 O  O    . HOH I 6 .   ? 0.04800  20.90500  28.30600  1.000 36.87021 ?  571 HOH A O    1 
HETATM 4662 O  O    . HOH I 6 .   ? 27.78300 17.33600  7.67500   1.000 25.61097 ?  572 HOH A O    1 
HETATM 4663 O  O    . HOH I 6 .   ? 12.50200 15.47400  33.81600  1.000 27.37170 ?  573 HOH A O    1 
HETATM 4664 O  O    . HOH I 6 .   ? 20.26700 7.97400   30.66500  1.000 34.63836 ?  574 HOH A O    1 
HETATM 4665 O  O    . HOH I 6 .   ? 11.54900 22.96100  35.23800  1.000 51.80358 ?  575 HOH A O    1 
HETATM 4666 O  O    . HOH I 6 .   ? 12.53200 -3.76400  9.86400   1.000 31.52483 ?  576 HOH A O    1 
HETATM 4667 O  O    . HOH I 6 .   ? 22.35600 32.74700  7.28600   1.000 38.76517 ?  577 HOH A O    1 
HETATM 4668 O  O    . HOH I 6 .   ? 12.56400 39.45500  15.93300  1.000 46.05815 ?  578 HOH A O    1 
HETATM 4669 O  O    . HOH I 6 .   ? -3.15900 11.77900  25.25700  1.000 23.69758 ?  579 HOH A O    1 
HETATM 4670 O  O    . HOH I 6 .   ? 4.48400  28.89200  31.41000  1.000 42.46035 ?  580 HOH A O    1 
HETATM 4671 O  O    . HOH I 6 .   ? 25.15900 13.61700  39.67600  1.000 20.92093 ?  581 HOH A O    1 
HETATM 4672 O  O    . HOH I 6 .   ? 10.38600 35.17800  9.69800   1.000 30.32995 ?  582 HOH A O    1 
HETATM 4673 O  O    . HOH I 6 .   ? 3.40400  32.48400  9.31400   1.000 48.33211 ?  583 HOH A O    1 
HETATM 4674 O  O    . HOH I 6 .   ? 20.12700 25.52200  -7.92100  1.000 36.92285 ?  584 HOH A O    1 
HETATM 4675 O  O    . HOH I 6 .   ? 28.45000 17.43900  10.27700  1.000 23.51861 ?  585 HOH A O    1 
HETATM 4676 O  O    . HOH I 6 .   ? -0.02100 10.02000  9.74800   1.000 30.90634 ?  586 HOH A O    1 
HETATM 4677 O  O    . HOH I 6 .   ? 26.43300 19.18200  45.04300  1.000 44.01054 ?  587 HOH A O    1 
HETATM 4678 O  O    . HOH I 6 .   ? 12.37400 30.70600  1.28400   1.000 54.35125 ?  588 HOH A O    1 
HETATM 4679 O  O    . HOH I 6 .   ? 15.72800 37.58100  9.22400   1.000 44.27373 ?  589 HOH A O    1 
HETATM 4680 O  O    . HOH I 6 .   ? 8.97500  17.93400  34.26500  1.000 32.80657 ?  590 HOH A O    1 
HETATM 4681 O  O    . HOH I 6 .   ? 17.90400 34.56100  29.67200  1.000 31.04320 ?  591 HOH A O    1 
HETATM 4682 O  O    . HOH I 6 .   ? -5.61800 11.25000  15.45500  1.000 18.67592 ?  592 HOH A O    1 
HETATM 4683 O  O    . HOH I 6 .   ? 11.21000 -0.31800  8.03300   1.000 27.52962 ?  593 HOH A O    1 
HETATM 4684 O  O    . HOH I 6 .   ? 26.02900 16.34300  -5.69400  1.000 48.00839 ?  594 HOH A O    1 
HETATM 4685 O  O    . HOH I 6 .   ? 26.81900 24.54000  21.78800  1.000 42.07610 ?  595 HOH A O    1 
HETATM 4686 O  O    . HOH I 6 .   ? 26.84200 12.58000  0.39900   1.000 52.95635 ?  596 HOH A O    1 
HETATM 4687 O  O    . HOH I 6 .   ? -0.08500 15.92400  28.47900  1.000 55.43559 ?  597 HOH A O    1 
HETATM 4688 O  O    . HOH I 6 .   ? 20.08600 9.14300   -2.54300  1.000 22.27372 ?  598 HOH A O    1 
HETATM 4689 O  O    . HOH I 6 .   ? 10.39500 14.32000  -6.89700  1.000 36.02011 ?  599 HOH A O    1 
HETATM 4690 O  O    . HOH I 6 .   ? 11.32400 40.25600  22.73800  1.000 52.46682 ?  600 HOH A O    1 
HETATM 4691 O  O    . HOH I 6 .   ? 27.53200 23.87700  -4.27900  1.000 38.39671 ?  601 HOH A O    1 
HETATM 4692 O  O    . HOH I 6 .   ? 9.06600  10.56500  11.90300  1.000 12.46202 ?  602 HOH A O    1 
HETATM 4693 O  O    . HOH I 6 .   ? 28.76500 25.09700  -2.28700  1.000 28.46131 ?  603 HOH A O    1 
HETATM 4694 O  O    . HOH I 6 .   ? 28.54000 23.16700  10.99100  1.000 28.67975 ?  604 HOH A O    1 
HETATM 4695 O  O    . HOH I 6 .   ? -2.54300 23.19800  9.47400   1.000 46.71876 ?  605 HOH A O    1 
HETATM 4696 O  O    . HOH I 6 .   ? 3.92300  4.14400   1.79400   1.000 50.36393 ?  606 HOH A O    1 
HETATM 4697 O  O    . HOH I 6 .   ? 0.14900  17.73100  30.72200  1.000 49.62174 ?  607 HOH A O    1 
HETATM 4698 O  O    . HOH I 6 .   ? 18.74100 10.95800  -8.41700  1.000 40.23640 ?  608 HOH A O    1 
HETATM 4699 O  O    . HOH I 6 .   ? 18.62600 14.49800  -10.51100 1.000 46.52137 ?  609 HOH A O    1 
HETATM 4700 O  O    . HOH I 6 .   ? 27.39000 26.20900  -3.77100  1.000 58.58860 ?  610 HOH A O    1 
HETATM 4701 O  O    . HOH I 6 .   ? 20.30600 34.47200  31.89400  1.000 44.78432 ?  611 HOH A O    1 
HETATM 4702 O  O    . HOH I 6 .   ? 11.62300 1.46000   14.97100  1.000 28.95610 ?  612 HOH A O    1 
HETATM 4703 O  O    . HOH I 6 .   ? 29.78900 26.11200  11.64600  1.000 42.04188 ?  613 HOH A O    1 
HETATM 4704 O  O    . HOH I 6 .   ? 10.81000 6.34100   -7.49100  1.000 28.78503 ?  614 HOH A O    1 
HETATM 4705 O  O    . HOH I 6 .   ? 16.61300 41.20500  16.52100  1.000 46.82404 ?  615 HOH A O    1 
HETATM 4706 O  O    . HOH I 6 .   ? 7.86900  7.66100   30.42000  1.000 24.70033 ?  616 HOH A O    1 
HETATM 4707 O  O    . HOH I 6 .   ? 9.08800  9.17800   -6.58400  1.000 22.71851 ?  617 HOH A O    1 
HETATM 4708 O  O    . HOH I 6 .   ? -3.71800 5.92100   19.43000  1.000 23.31332 ?  618 HOH A O    1 
HETATM 4709 O  O    . HOH I 6 .   ? 26.33800 27.55400  22.19300  1.000 33.42243 ?  619 HOH A O    1 
HETATM 4710 O  O    . HOH I 6 .   ? 8.29200  37.61700  13.25800  1.000 46.89246 ?  620 HOH A O    1 
HETATM 4711 O  O    . HOH I 6 .   ? 13.94700 5.60200   20.70100  1.000 38.75201 ?  621 HOH A O    1 
HETATM 4712 O  O    . HOH I 6 .   ? 4.14000  35.57200  13.98900  1.000 72.13233 ?  622 HOH A O    1 
HETATM 4713 O  O    . HOH I 6 .   ? 18.31500 26.12800  42.24900  1.000 55.74089 ?  623 HOH A O    1 
HETATM 4714 O  O    . HOH I 6 .   ? 22.26300 7.76400   -1.46800  1.000 28.37445 ?  624 HOH A O    1 
HETATM 4715 O  O    . HOH I 6 .   ? 29.21200 16.56700  14.04200  1.000 52.35891 ?  625 HOH A O    1 
HETATM 4716 O  O    . HOH I 6 .   ? -1.31800 17.92300  27.10700  1.000 55.79616 ?  626 HOH A O    1 
HETATM 4717 O  O    . HOH I 6 .   ? 15.14600 -0.35400  8.33600   1.000 38.96783 ?  627 HOH A O    1 
HETATM 4718 O  O    . HOH I 6 .   ? 13.34100 11.53000  43.30600  1.000 38.34670 ?  628 HOH A O    1 
HETATM 4719 O  O    . HOH I 6 .   ? 10.94400 13.59600  33.62600  1.000 32.30124 ?  629 HOH A O    1 
HETATM 4720 O  O    . HOH I 6 .   ? 23.14400 15.53500  -3.07300  1.000 28.52710 ?  630 HOH A O    1 
HETATM 4721 O  O    . HOH I 6 .   ? 19.86500 7.84500   34.63400  1.000 49.36381 ?  631 HOH A O    1 
HETATM 4722 O  O    . HOH I 6 .   ? 19.08800 5.51200   30.01900  1.000 41.18389 ?  632 HOH A O    1 
HETATM 4723 O  O    . HOH I 6 .   ? 0.58100  4.63100   23.72400  1.000 25.36357 ?  633 HOH A O    1 
HETATM 4724 O  O    . HOH I 6 .   ? 19.31500 30.02200  -4.74200  1.000 39.58633 ?  634 HOH A O    1 
HETATM 4725 O  O    . HOH I 6 .   ? 17.57700 0.51600   13.29600  1.000 47.56886 ?  635 HOH A O    1 
HETATM 4726 O  O    . HOH I 6 .   ? 2.44600  11.98500  28.65300  1.000 24.30555 ?  636 HOH A O    1 
HETATM 4727 O  O    . HOH I 6 .   ? 12.57200 17.06300  39.87700  1.000 28.06389 ?  637 HOH A O    1 
HETATM 4728 O  O    . HOH I 6 .   ? 21.63400 31.30900  -3.71100  1.000 36.39910 ?  638 HOH A O    1 
HETATM 4729 O  O    . HOH I 6 .   ? 4.55600  -4.73300  5.95400   1.000 47.85047 ?  639 HOH A O    1 
HETATM 4730 O  O    . HOH I 6 .   ? 34.39200 25.89700  2.89900   1.000 18.40484 ?  640 HOH A O    1 
HETATM 4731 O  O    . HOH I 6 .   ? -0.66600 9.74200   6.02100   1.000 31.18532 ?  641 HOH A O    1 
HETATM 4732 O  O    . HOH I 6 .   ? 14.01000 33.22400  2.18100   1.000 55.18030 ?  642 HOH A O    1 
HETATM 4733 O  O    . HOH I 6 .   ? 10.54000 -1.59400  16.90000  1.000 48.26368 ?  643 HOH A O    1 
HETATM 4734 O  O    . HOH I 6 .   ? 12.80100 19.77100  -15.67500 1.000 45.61336 ?  644 HOH A O    1 
HETATM 4735 O  O    . HOH I 6 .   ? 15.03600 24.25300  40.96100  1.000 47.24777 ?  645 HOH A O    1 
HETATM 4736 O  O    . HOH I 6 .   ? 24.76000 19.68100  25.67000  1.000 29.43511 ?  646 HOH A O    1 
HETATM 4737 O  O    . HOH I 6 .   ? 1.69200  21.74600  -8.78400  1.000 64.18928 ?  647 HOH A O    1 
HETATM 4738 O  O    . HOH I 6 .   ? 26.32000 10.44600  37.45000  1.000 27.82965 ?  648 HOH A O    1 
HETATM 4739 O  O    . HOH I 6 .   ? 18.58200 39.64100  24.74800  1.000 58.71230 ?  649 HOH A O    1 
HETATM 4740 O  O    . HOH I 6 .   ? 29.91000 30.12300  11.27400  1.000 45.93972 ?  650 HOH A O    1 
HETATM 4741 O  O    . HOH I 6 .   ? 5.13500  23.26100  -2.26000  1.000 32.73814 ?  651 HOH A O    1 
HETATM 4742 O  O    . HOH I 6 .   ? -1.18200 11.01000  12.02100  1.000 33.61192 ?  652 HOH A O    1 
HETATM 4743 O  O    . HOH I 6 .   ? 4.68000  32.63300  22.24400  1.000 47.56360 ?  653 HOH A O    1 
HETATM 4744 O  O    . HOH I 6 .   ? 23.02700 11.25300  23.11700  1.000 63.20231 ?  654 HOH A O    1 
HETATM 4745 O  O    . HOH I 6 .   ? 22.71500 16.65400  46.05100  1.000 62.34169 ?  655 HOH A O    1 
HETATM 4746 O  O    . HOH I 6 .   ? 13.86700 -4.33400  0.79000   1.000 61.59686 ?  656 HOH A O    1 
HETATM 4747 O  O    B HOH I 6 .   ? 2.47700  23.57200  -2.64000  0.620 33.87248 ?  657 HOH A O    1 
HETATM 4748 O  O    . HOH I 6 .   ? 3.28500  11.56900  31.15700  1.000 43.36046 ?  658 HOH A O    1 
HETATM 4749 O  O    . HOH I 6 .   ? 14.75600 0.41300   15.53300  1.000 41.29706 ?  659 HOH A O    1 
HETATM 4750 O  O    . HOH I 6 .   ? 15.80200 5.59200   33.70500  1.000 57.18580 ?  660 HOH A O    1 
HETATM 4751 O  O    . HOH I 6 .   ? 0.52300  2.18700   8.25400   1.000 17.83372 ?  661 HOH A O    1 
HETATM 4752 O  O    . HOH I 6 .   ? 14.93500 23.33800  -7.85500  1.000 38.74149 ?  662 HOH A O    1 
HETATM 4753 O  O    . HOH I 6 .   ? 2.64100  28.69400  7.74500   1.000 54.14070 ?  663 HOH A O    1 
HETATM 4754 O  O    . HOH I 6 .   ? 11.48100 38.84700  18.31100  1.000 52.77738 ?  664 HOH A O    1 
HETATM 4755 O  O    . HOH I 6 .   ? 10.87300 -2.89700  7.65600   1.000 57.09106 ?  665 HOH A O    1 
HETATM 4756 O  O    . HOH I 6 .   ? -2.45300 10.06900  27.38200  1.000 50.66923 ?  666 HOH A O    1 
HETATM 4757 O  O    . HOH I 6 .   ? 11.07500 -3.76500  1.50300   1.000 53.97489 ?  667 HOH A O    1 
HETATM 4758 O  O    . HOH I 6 .   ? 25.02600 24.94700  44.14600  1.000 39.18101 ?  668 HOH A O    1 
HETATM 4759 O  O    . HOH I 6 .   ? 26.82300 23.20300  24.95600  1.000 58.08328 ?  669 HOH A O    1 
HETATM 4760 O  O    . HOH I 6 .   ? 23.14200 24.83000  37.59600  1.000 20.64458 ?  670 HOH A O    1 
HETATM 4761 O  O    . HOH I 6 .   ? 20.92400 25.46500  42.73900  1.000 56.33044 ?  671 HOH A O    1 
HETATM 4762 O  O    . HOH I 6 .   ? 5.60800  4.52300   -7.26800  1.000 56.32517 ?  672 HOH A O    1 
HETATM 4763 O  O    . HOH I 6 .   ? 24.41800 36.69500  14.43200  1.000 59.12025 ?  673 HOH A O    1 
HETATM 4764 O  O    . HOH I 6 .   ? 24.48700 6.92800   4.42600   1.000 31.09320 ?  674 HOH A O    1 
HETATM 4765 O  O    . HOH I 6 .   ? 22.84700 35.28300  36.61700  1.000 42.81566 ?  675 HOH A O    1 
HETATM 4766 O  O    . HOH I 6 .   ? 9.12500  36.98900  22.77800  1.000 63.85239 ?  676 HOH A O    1 
HETATM 4767 O  O    . HOH I 6 .   ? 16.26900 3.56600   -3.83200  1.000 36.49385 ?  677 HOH A O    1 
HETATM 4768 O  O    . HOH I 6 .   ? 6.03100  5.02700   24.36500  1.000 58.16750 ?  678 HOH A O    1 
HETATM 4769 O  O    . HOH I 6 .   ? 20.99200 7.64800   16.38400  1.000 63.46550 ?  679 HOH A O    1 
HETATM 4770 O  O    . HOH I 6 .   ? 23.13100 38.75500  17.29900  1.000 63.80765 ?  680 HOH A O    1 
HETATM 4771 O  O    . HOH I 6 .   ? -1.24900 6.34500   4.51100   1.000 45.52651 ?  681 HOH A O    1 
HETATM 4772 O  O    . HOH I 6 .   ? 7.42200  33.89700  12.16500  1.000 48.57951 ?  682 HOH A O    1 
HETATM 4773 O  O    . HOH I 6 .   ? 21.09000 3.72700   14.86200  1.000 62.88386 ?  683 HOH A O    1 
HETATM 4774 O  O    . HOH I 6 .   ? 16.12100 35.43100  1.60900   1.000 71.46910 ?  684 HOH A O    1 
HETATM 4775 O  O    . HOH I 6 .   ? 16.10200 0.75800   2.58600   1.000 50.91663 ?  685 HOH A O    1 
HETATM 4776 O  O    . HOH I 6 .   ? 6.68300  3.91000   22.42300  1.000 57.90957 ?  686 HOH A O    1 
HETATM 4777 O  O    . HOH I 6 .   ? 29.50600 15.06600  10.73900  1.000 52.91950 ?  687 HOH A O    1 
HETATM 4778 O  O    . HOH I 6 .   ? 3.05000  -7.32900  7.86300   1.000 48.25315 ?  688 HOH A O    1 
HETATM 4779 O  O    . HOH I 6 .   ? 29.38300 23.43000  16.47300  1.000 53.39324 ?  689 HOH A O    1 
HETATM 4780 O  O    . HOH I 6 .   ? 3.32800  31.19700  23.24900  1.000 40.29957 ?  690 HOH A O    1 
HETATM 4781 O  O    . HOH I 6 .   ? 12.70000 33.70700  -1.94100  1.000 57.58059 ?  691 HOH A O    1 
HETATM 4782 O  O    . HOH I 6 .   ? 0.19800  25.26800  7.21000   1.000 28.34287 ?  692 HOH A O    1 
HETATM 4783 O  O    . HOH I 6 .   ? 16.89600 5.00600   26.28300  1.000 66.13161 ?  693 HOH A O    1 
HETATM 4784 O  O    . HOH I 6 .   ? 24.75900 25.89200  27.68200  1.000 47.85574 ?  694 HOH A O    1 
HETATM 4785 O  O    . HOH I 6 .   ? 5.06900  15.54000  -7.22700  1.000 53.00372 ?  695 HOH A O    1 
HETATM 4786 O  O    . HOH I 6 .   ? -1.63100 23.35300  6.94100   1.000 51.56408 ?  696 HOH A O    1 
HETATM 4787 O  O    A HOH I 6 .   ? 2.81200  3.96500   8.24500   0.520 24.22922 ?  697 HOH A O    1 
HETATM 4788 O  O    . HOH I 6 .   ? 28.79800 32.38400  14.71500  1.000 54.34862 ?  698 HOH A O    1 
HETATM 4789 O  O    . HOH I 6 .   ? -0.67700 32.77900  18.60900  1.000 43.63155 ?  699 HOH A O    1 
HETATM 4790 O  O    . HOH I 6 .   ? 24.75900 8.78200   16.29200  1.000 40.64698 ?  700 HOH A O    1 
HETATM 4791 O  O    . HOH I 6 .   ? 24.56400 9.83400   19.21500  1.000 54.81710 ?  701 HOH A O    1 
HETATM 4792 O  O    . HOH I 6 .   ? 2.97200  29.85400  -8.63500  1.000 54.45916 ?  702 HOH A O    1 
HETATM 4793 O  O    . HOH I 6 .   ? 1.39800  17.41600  33.59500  1.000 53.41430 ?  703 HOH A O    1 
HETATM 4794 O  O    . HOH I 6 .   ? 3.62900  5.27300   -4.24700  1.000 47.24777 ?  704 HOH A O    1 
HETATM 4795 O  O    . HOH I 6 .   ? 19.67600 35.54400  28.19000  1.000 45.15278 ?  705 HOH A O    1 
HETATM 4796 O  O    . HOH I 6 .   ? 13.64000 7.31500   40.94400  1.000 67.17648 ?  706 HOH A O    1 
HETATM 4797 O  O    . HOH I 6 .   ? 10.01500 5.37900   24.09200  1.000 29.43511 ?  707 HOH A O    1 
HETATM 4798 O  O    A HOH I 6 .   ? 6.88800  5.35500   29.65300  0.560 44.99224 ?  708 HOH A O    1 
HETATM 4799 O  O    B HOH I 6 .   ? 6.30100  5.41800   27.45000  0.440 46.27660 ?  708 HOH A O    1 
HETATM 4800 O  O    . HOH I 6 .   ? 15.02800 5.62000   26.25300  1.000 71.67702 ?  709 HOH A O    1 
HETATM 4801 O  O    . HOH I 6 .   ? 18.66000 32.50400  39.05300  1.000 47.18724 ?  710 HOH A O    1 
HETATM 4802 O  O    . HOH I 6 .   ? 30.61200 29.31800  8.95900   1.000 38.19932 ?  711 HOH A O    1 
HETATM 4803 O  O    . HOH I 6 .   ? 25.09900 28.71700  -6.86400  1.000 43.53943 ?  712 HOH A O    1 
HETATM 4804 O  O    . HOH I 6 .   ? 2.50200  7.78000   12.47400  1.000 16.38354 ?  713 HOH A O    1 
HETATM 4805 O  O    . HOH I 6 .   ? 20.61300 33.95900  23.84500  1.000 31.87224 ?  714 HOH A O    1 
HETATM 4806 O  O    . HOH I 6 .   ? 22.03900 34.42800  29.52500  1.000 48.32685 ?  715 HOH A O    1 
HETATM 4807 O  O    . HOH I 6 .   ? 2.94900  21.26400  33.06900  1.000 51.71936 ?  716 HOH A O    1 
HETATM 4808 O  O    . HOH I 6 .   ? 18.65900 3.82800   1.65900   1.000 44.81590 ?  717 HOH A O    1 
HETATM 4809 O  O    . HOH I 6 .   ? 10.38100 8.12000   -8.94400  1.000 66.85538 ?  718 HOH A O    1 
HETATM 4810 O  O    . HOH I 6 .   ? 5.65500  29.69800  5.99800   1.000 54.93290 ?  719 HOH A O    1 
HETATM 4811 O  O    . HOH I 6 .   ? 6.53800  27.31100  -2.13500  1.000 63.23653 ?  720 HOH A O    1 
HETATM 4812 O  O    . HOH I 6 .   ? 14.89100 40.77300  22.43300  1.000 52.18520 ?  721 HOH A O    1 
HETATM 4813 O  O    . HOH I 6 .   ? 5.82300  -8.46100  10.11700  1.000 46.64507 ?  722 HOH A O    1 
HETATM 4814 O  O    . HOH I 6 .   ? 17.24200 10.26300  -10.70000 1.000 36.43595 ?  723 HOH A O    1 
HETATM 4815 O  O    . HOH I 6 .   ? 4.45900  36.39600  19.07700  1.000 46.08184 ?  724 HOH A O    1 
HETATM 4816 O  O    . HOH I 6 .   ? 8.92900  3.99500   -8.41800  1.000 44.93697 ?  725 HOH A O    1 
HETATM 4817 O  O    . HOH I 6 .   ? 28.75100 14.51900  0.14900   1.000 60.29144 ?  726 HOH A O    1 
HETATM 4818 O  O    . HOH I 6 .   ? 24.48400 11.01600  40.46800  1.000 21.84999 ?  727 HOH A O    1 
HETATM 4819 O  O    . HOH I 6 .   ? 16.21900 0.04000   4.89700   1.000 57.87536 ?  728 HOH A O    1 
HETATM 4820 O  O    . HOH I 6 .   ? 27.32900 31.70700  6.25500   1.000 35.83324 ?  729 HOH A O    1 
HETATM 4821 O  O    . HOH I 6 .   ? 5.34000  1.89300   22.12400  1.000 39.06258 ?  730 HOH A O    1 
HETATM 4822 O  O    . HOH I 6 .   ? 14.53600 27.76300  -9.27200  1.000 59.62557 ?  731 HOH A O    1 
HETATM 4823 O  O    . HOH I 6 .   ? -0.28000 13.41000  28.95600  1.000 45.88445 ?  732 HOH A O    1 
HETATM 4824 O  O    . HOH I 6 .   ? 10.74700 16.33000  35.04400  1.000 34.14620 ?  733 HOH A O    1 
HETATM 4825 O  O    . HOH I 6 .   ? 30.75100 19.24000  24.86200  1.000 49.50857 ?  734 HOH A O    1 
HETATM 4826 O  O    . HOH I 6 .   ? 9.11800  16.38800  -13.42600 1.000 38.34407 ?  735 HOH A O    1 
HETATM 4827 O  O    . HOH I 6 .   ? 6.98500  33.09500  23.34300  1.000 35.57532 ?  736 HOH A O    1 
HETATM 4828 O  O    . HOH I 6 .   ? 3.25000  1.79700   4.16200   1.000 49.96652 ?  737 HOH A O    1 
HETATM 4829 O  O    . HOH I 6 .   ? 10.50200 2.01700   22.58600  1.000 59.54661 ?  738 HOH A O    1 
HETATM 4830 O  O    . HOH I 6 .   ? 27.37000 18.79200  26.97100  1.000 54.92237 ?  739 HOH A O    1 
HETATM 4831 O  O    . HOH I 6 .   ? 8.44500  4.23300   26.05700  1.000 56.78312 ?  740 HOH A O    1 
HETATM 4832 O  O    . HOH I 6 .   ? 33.61900 28.11100  4.34900   1.000 26.15577 ?  741 HOH A O    1 
HETATM 4833 O  O    . HOH I 6 .   ? 30.40800 19.57300  10.19300  1.000 65.82631 ?  742 HOH A O    1 
HETATM 4834 O  O    . HOH I 6 .   ? 0.70100  32.13800  23.14100  1.000 56.88840 ?  743 HOH A O    1 
HETATM 4835 O  O    . HOH I 6 .   ? -1.66500 31.21300  11.98600  1.000 30.31153 ?  744 HOH A O    1 
HETATM 4836 O  O    . HOH I 6 .   ? 4.61600  2.55500   -0.66700  1.000 36.69914 ?  745 HOH A O    1 
HETATM 4837 O  O    . HOH I 6 .   ? 29.55500 11.92300  6.68800   1.000 42.88146 ?  746 HOH A O    1 
HETATM 4838 O  O    . HOH I 6 .   ? 22.29600 9.15900   19.31800  1.000 67.96868 ?  747 HOH A O    1 
HETATM 4839 O  O    . HOH I 6 .   ? 22.48500 34.35100  1.11300   1.000 63.52604 ?  748 HOH A O    1 
HETATM 4840 O  O    . HOH I 6 .   ? 21.04400 34.52000  9.22800   1.000 51.45880 ?  749 HOH A O    1 
HETATM 4841 O  O    . HOH I 6 .   ? 7.81600  15.22800  -9.04900  1.000 44.97381 ?  750 HOH A O    1 
HETATM 4842 O  O    . HOH I 6 .   ? 7.04600  35.49200  14.36200  1.000 35.78587 ?  751 HOH A O    1 
HETATM 4843 O  O    . HOH I 6 .   ? 22.49300 4.36000   1.26700   1.000 46.35556 ?  752 HOH A O    1 
HETATM 4844 O  O    . HOH I 6 .   ? 0.93100  29.57200  26.27400  1.000 59.71505 ?  753 HOH A O    1 
HETATM 4845 O  O    . HOH I 6 .   ? 23.50800 31.67100  28.26800  1.000 49.48225 ?  754 HOH A O    1 
HETATM 4846 O  O    . HOH I 6 .   ? 2.30100  -4.10100  5.65600   1.000 39.72845 ?  755 HOH A O    1 
HETATM 4847 O  O    . HOH I 6 .   ? 5.76600  13.72600  33.02100  1.000 57.89115 ?  756 HOH A O    1 
HETATM 4848 O  O    . HOH I 6 .   ? 9.21800  33.29900  3.78500   1.000 62.39432 ?  757 HOH A O    1 
HETATM 4849 O  O    . HOH I 6 .   ? -5.32200 6.24300   17.34200  1.000 35.04104 ?  758 HOH A O    1 
HETATM 4850 O  O    . HOH I 6 .   ? 18.09500 29.39400  42.63100  1.000 63.88661 ?  759 HOH A O    1 
HETATM 4851 O  O    . HOH I 6 .   ? 3.40700  35.32500  21.97200  1.000 61.31261 ?  760 HOH A O    1 
HETATM 4852 O  O    . HOH I 6 .   ? 6.36000  8.92700   -7.20200  1.000 33.23820 ?  761 HOH A O    1 
HETATM 4853 O  O    . HOH I 6 .   ? 7.75600  34.82300  10.20700  1.000 60.29407 ?  762 HOH A O    1 
HETATM 4854 O  O    . HOH I 6 .   ? 25.24000 36.29400  18.66400  1.000 45.07383 ?  763 HOH A O    1 
HETATM 4855 O  O    . HOH I 6 .   ? 19.41700 8.50400   -7.17600  1.000 50.55080 ?  764 HOH A O    1 
HETATM 4856 O  O    . HOH I 6 .   ? -3.36400 30.04000  15.88800  1.000 26.28999 ?  765 HOH A O    1 
HETATM 4857 O  O    . HOH I 6 .   ? 3.89700  -9.02300  8.76000   1.000 51.90359 ?  766 HOH A O    1 
HETATM 4858 O  O    . HOH I 6 .   ? 15.26800 -3.68400  9.21200   1.000 51.05612 ?  767 HOH A O    1 
HETATM 4859 O  O    . HOH I 6 .   ? 7.47500  34.88200  21.33400  1.000 47.96365 ?  768 HOH A O    1 
HETATM 4860 O  O    . HOH I 6 .   ? 17.24800 31.94800  40.46400  1.000 58.28067 ?  769 HOH A O    1 
HETATM 4861 O  O    . HOH I 6 .   ? 4.00600  4.28700   25.94500  1.000 55.83827 ?  770 HOH A O    1 
HETATM 4862 O  O    . HOH I 6 .   ? 10.11100 7.07300   31.86400  1.000 46.32398 ?  771 HOH A O    1 
HETATM 4863 O  O    . HOH I 6 .   ? 20.47200 36.44000  37.04500  1.000 62.75752 ?  772 HOH A O    1 
HETATM 4864 O  O    . HOH I 6 .   ? 19.79200 34.74100  1.54100   1.000 54.74341 ?  773 HOH A O    1 
HETATM 4865 O  O    . HOH I 6 .   ? 0.40200  9.79000   28.10000  1.000 28.42183 ?  774 HOH A O    1 
HETATM 4866 O  O    . HOH I 6 .   ? 30.53500 25.43400  14.60900  1.000 56.16200 ?  775 HOH A O    1 
HETATM 4867 O  O    . HOH I 6 .   ? -6.89500 13.41300  13.87100  1.000 26.79005 ?  776 HOH A O    1 
HETATM 4868 O  O    . HOH I 6 .   ? 19.16700 7.23000   37.51000  1.000 45.39755 ?  777 HOH A O    1 
HETATM 4869 O  O    . HOH I 6 .   ? -2.62500 11.65100  5.20000   1.000 44.32374 ?  778 HOH A O    1 
HETATM 4870 O  O    . HOH I 6 .   ? -4.11300 16.09400  28.12900  1.000 41.56025 ?  779 HOH A O    1 
HETATM 4871 O  O    . HOH I 6 .   ? 20.90100 8.39800   39.11800  1.000 42.56300 ?  780 HOH A O    1 
HETATM 4872 O  O    . HOH I 6 .   ? 0.39400  1.42500   5.63500   1.000 42.89725 ?  781 HOH A O    1 
HETATM 4873 O  O    . HOH I 6 .   ? 15.80700 4.71200   -8.00600  1.000 49.59279 ?  782 HOH A O    1 
HETATM 4874 O  O    . HOH I 6 .   ? 17.91000 42.10400  20.39100  1.000 45.09751 ?  783 HOH A O    1 
HETATM 4875 O  O    . HOH I 6 .   ? 19.82400 9.53300   43.97200  1.000 59.91508 ?  784 HOH A O    1 
HETATM 4876 O  O    . HOH I 6 .   ? 7.11300  34.10300  7.47100   1.000 44.88696 ?  785 HOH A O    1 
HETATM 4877 O  O    . HOH I 6 .   ? 24.39300 27.26100  37.88300  1.000 24.45556 ?  786 HOH A O    1 
HETATM 4878 O  O    . HOH I 6 .   ? 18.33400 7.08400   -3.82300  1.000 49.16905 ?  787 HOH A O    1 
HETATM 4879 O  O    . HOH I 6 .   ? -0.00800 35.42800  19.03200  1.000 67.43703 ?  788 HOH A O    1 
HETATM 4880 O  O    . HOH I 6 .   ? 0.86000  2.13700   22.53300  1.000 39.00468 ?  789 HOH A O    1 
HETATM 4881 O  O    . HOH I 6 .   ? 31.75300 26.69000  9.62200   1.000 44.63693 ?  790 HOH A O    1 
HETATM 4882 O  O    . HOH I 6 .   ? 12.76200 4.83700   -9.43300  1.000 44.23425 ?  791 HOH A O    1 
HETATM 4883 O  O    . HOH I 6 .   ? 12.31900 1.42700   -9.77700  1.000 56.36202 ?  792 HOH A O    1 
HETATM 4884 O  O    . HOH I 6 .   ? 20.05000 33.86000  5.63100   1.000 42.67880 ?  793 HOH A O    1 
HETATM 4885 O  O    . HOH I 6 .   ? 10.64400 16.86200  37.79700  1.000 39.61001 ?  794 HOH A O    1 
HETATM 4886 O  O    . HOH I 6 .   ? 21.13500 4.85900   -1.17100  1.000 63.03387 ?  795 HOH A O    1 
HETATM 4887 O  O    . HOH I 6 .   ? 5.77000  16.63600  34.41500  1.000 66.93697 ?  796 HOH A O    1 
HETATM 4888 O  O    . HOH I 6 .   ? 10.79300 4.20300   32.28400  1.000 52.47998 ?  797 HOH A O    1 
HETATM 4889 O  O    . HOH I 6 .   ? 9.26900  -5.09400  3.03400   1.000 49.85071 ?  798 HOH A O    1 
HETATM 4890 O  O    . HOH I 6 .   ? 12.12400 9.92400   45.55300  1.000 55.27242 ?  799 HOH A O    1 
HETATM 4891 O  O    . HOH I 6 .   ? 5.12200  11.50100  -6.76200  1.000 51.23246 ?  800 HOH A O    1 
HETATM 4892 O  O    . HOH I 6 .   ? -1.71900 2.28500   4.24700   1.000 49.97178 ?  801 HOH A O    1 
HETATM 4893 O  O    . HOH I 6 .   ? 21.31400 11.63900  44.33800  1.000 57.02526 ?  802 HOH A O    1 
HETATM 4894 O  O    . HOH I 6 .   ? 12.56800 27.57800  -13.35700 1.000 54.36704 ?  803 HOH A O    1 
HETATM 4895 O  O    . HOH I 6 .   ? 5.35800  -10.27000 11.40600  1.000 63.05493 ?  804 HOH A O    1 
HETATM 4896 O  O    . HOH I 6 .   ? 23.40700 10.19800  42.82700  1.000 29.99570 ?  805 HOH A O    1 
HETATM 4897 O  O    . HOH I 6 .   ? -4.62200 30.44700  11.45100  1.000 50.23760 ?  806 HOH A O    1 
HETATM 4898 O  O    . HOH I 6 .   ? 3.44800  19.56300  34.90300  1.000 51.91412 ?  807 HOH A O    1 
HETATM 4899 O  O    . HOH I 6 .   ? 15.84400 2.78800   37.27400  1.000 58.94654 ?  808 HOH A O    1 
HETATM 4900 O  O    . HOH I 6 .   ? 19.32600 4.78700   -2.30100  1.000 49.08746 ?  809 HOH A O    1 
HETATM 4901 O  O    . HOH I 6 .   ? 29.79700 33.02300  5.78000   1.000 60.08615 ?  810 HOH A O    1 
HETATM 4902 O  O    . HOH I 6 .   ? 30.25200 31.83300  29.92800  1.000 21.59996 ?  811 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  ? 0.50540 0.73290 0.58380 -0.13450 -0.04420 0.23980  24  HIS A N   
2    C  CA  . HIS A 20  ? 0.50400 0.73090 0.58010 -0.13300 -0.05580 0.23960  24  HIS A CA  
3    C  C   . HIS A 20  ? 0.46040 0.71070 0.54880 -0.12160 -0.08940 0.21710  24  HIS A C   
4    O  O   . HIS A 20  ? 0.43570 0.70860 0.54400 -0.12200 -0.10100 0.21380  24  HIS A O   
5    C  CB  . HIS A 20  ? 0.53220 0.74580 0.59530 -0.14670 -0.04070 0.26270  24  HIS A CB  
6    C  CG  . HIS A 20  ? 0.55620 0.75560 0.61090 -0.16070 -0.02640 0.28460  24  HIS A CG  
7    N  ND1 . HIS A 20  ? 0.56640 0.75910 0.61720 -0.16670 -0.03060 0.29140  24  HIS A ND1 
8    C  CD2 . HIS A 20  ? 0.56470 0.75920 0.61820 -0.16780 -0.01700 0.29230  24  HIS A CD2 
9    C  CE1 . HIS A 20  ? 0.57070 0.76000 0.62060 -0.16920 -0.02000 0.29790  24  HIS A CE1 
10   N  NE2 . HIS A 20  ? 0.56800 0.75740 0.61710 -0.17470 -0.01350 0.30190  24  HIS A NE2 
17   N  N   . MET A 21  ? 0.44720 0.68840 0.51950 -0.09930 -0.11540 0.20150  25  MET A N   
18   C  CA  . MET A 21  ? 0.45950 0.66670 0.50030 -0.07910 -0.12150 0.18140  25  MET A CA  
19   C  C   . MET A 21  ? 0.38400 0.62310 0.43970 -0.06810 -0.11140 0.15070  25  MET A C   
20   O  O   . MET A 21  ? 0.38730 0.63120 0.45390 -0.07520 -0.11680 0.12450  25  MET A O   
21   C  CB  . MET A 21  ? 0.54760 0.68680 0.55360 -0.07190 -0.11350 0.18420  25  MET A CB  
22   C  CG  . MET A 21  ? 0.62800 0.70600 0.60330 -0.06530 -0.10890 0.18160  25  MET A CG  
23   S  SD  . MET A 21  ? 0.69210 0.72430 0.64710 -0.05770 -0.10880 0.17350  25  MET A SD  
24   C  CE  . MET A 21  ? 0.70100 0.72700 0.64540 -0.05810 -0.11380 0.17260  25  MET A CE  
34   N  N   . LEU A 22  ? 0.32110 0.56980 0.37150 -0.04450 -0.08760 0.14330  26  LEU A N   
35   C  CA  . LEU A 22  ? 0.27240 0.51630 0.31670 -0.01970 -0.06290 0.13100  26  LEU A CA  
36   C  C   . LEU A 22  ? 0.22440 0.47520 0.25970 -0.01490 -0.05250 0.09800  26  LEU A C   
37   O  O   . LEU A 22  ? 0.21110 0.45950 0.22670 -0.01400 -0.04280 0.10260  26  LEU A O   
38   C  CB  . LEU A 22  ? 0.30450 0.50970 0.32510 -0.01650 -0.05290 0.13850  26  LEU A CB  
39   C  CG  . LEU A 22  ? 0.33070 0.50910 0.34280 -0.03130 -0.03590 0.13540  26  LEU A CG  
40   C  CD1 . LEU A 22  ? 0.35200 0.51040 0.35610 -0.03090 -0.04400 0.12930  26  LEU A CD1 
41   C  CD2 . LEU A 22  ? 0.34530 0.50930 0.35600 -0.04150 -0.01710 0.13550  26  LEU A CD2 
53   N  N   . THR A 23  ? 0.20830 0.45160 0.23590 -0.01240 -0.02960 0.06090  27  THR A N   
54   C  CA  . THR A 23  ? 0.18720 0.42440 0.22290 -0.01270 -0.01970 0.03630  27  THR A CA  
55   C  C   . THR A 23  ? 0.19030 0.40120 0.20450 -0.00940 -0.00290 0.04000  27  THR A C   
56   O  O   . THR A 23  ? 0.21540 0.39580 0.21600 -0.00790 -0.01870 0.04850  27  THR A O   
57   C  CB  . THR A 23  ? 0.21170 0.42960 0.24660 -0.01910 0.00150  0.01770  27  THR A CB  
58   O  OG1 . THR A 23  ? 0.22380 0.44460 0.29250 -0.01030 0.00010  -0.00890 27  THR A OG1 
59   C  CG2 . THR A 23  ? 0.22710 0.42540 0.23160 -0.01830 0.01160  0.03520  27  THR A CG2 
67   N  N   . ASN A 24  ? 0.18380 0.37880 0.18820 -0.00580 0.01060  0.04350  28  ASN A N   
68   C  CA  . ASN A 24  ? 0.22100 0.36660 0.15890 0.00690  0.02580  0.03480  28  ASN A CA  
69   C  C   . ASN A 24  ? 0.26430 0.38030 0.17190 0.00100  0.02160  0.04800  28  ASN A C   
70   O  O   . ASN A 24  ? 0.29840 0.38860 0.16190 0.00330  0.01330  0.03610  28  ASN A O   
71   C  CB  . ASN A 24  ? 0.24050 0.34930 0.15460 0.00000  0.02260  0.02700  28  ASN A CB  
72   C  CG  . ASN A 24  ? 0.23140 0.33350 0.14660 -0.01930 0.00140  0.01580  28  ASN A CG  
73   O  OD1 . ASN A 24  ? 0.22750 0.32800 0.15220 -0.03940 -0.00030 0.02170  28  ASN A OD1 
74   N  ND2 . ASN A 24  ? 0.22780 0.32690 0.15920 -0.02880 -0.00560 0.00830  28  ASN A ND2 
81   N  N   . LEU A 25  ? 0.27130 0.38600 0.17160 -0.00680 0.03030  0.07330  29  LEU A N   
82   C  CA  . LEU A 25  ? 0.29560 0.39510 0.18880 -0.00860 0.04080  0.08100  29  LEU A CA  
83   C  C   . LEU A 25  ? 0.31430 0.40300 0.15480 -0.01310 0.05760  0.05720  29  LEU A C   
84   O  O   . LEU A 25  ? 0.37090 0.41650 0.17950 -0.00390 0.04580  0.04840  29  LEU A O   
85   C  CB  . LEU A 25  ? 0.32190 0.40740 0.22000 -0.01100 0.05310  0.08750  29  LEU A CB  
86   C  CG  . LEU A 25  ? 0.34710 0.42090 0.27100 -0.01080 0.03730  0.08330  29  LEU A CG  
87   C  CD1 . LEU A 25  ? 0.37070 0.42760 0.30780 -0.01070 0.04120  0.07790  29  LEU A CD1 
88   C  CD2 . LEU A 25  ? 0.36090 0.42730 0.30000 0.00070  0.01160  0.08610  29  LEU A CD2 
100  N  N   . VAL A 26  ? 0.29130 0.39350 0.17100 -0.01800 0.04050  0.03290  30  VAL A N   
101  C  CA  . VAL A 26  ? 0.28530 0.38350 0.17260 -0.02840 0.03660  0.00750  30  VAL A CA  
102  C  C   . VAL A 26  ? 0.28460 0.37600 0.17930 -0.02990 0.02200  0.00750  30  VAL A C   
103  O  O   . VAL A 26  ? 0.31620 0.37480 0.18710 -0.03940 0.03710  0.00730  30  VAL A O   
104  C  CB  . VAL A 26  ? 0.29860 0.38940 0.21280 -0.03170 0.04840  0.01350  30  VAL A CB  
105  C  CG1 . VAL A 26  ? 0.29590 0.38880 0.23650 -0.02920 0.04530  0.01220  30  VAL A CG1 
106  C  CG2 . VAL A 26  ? 0.30010 0.39670 0.24380 -0.03750 0.06820  0.02070  30  VAL A CG2 
116  N  N   . ALA A 27  ? 0.26690 0.36650 0.19400 -0.02860 0.02560  0.02160  31  ALA A N   
117  C  CA  . ALA A 27  ? 0.24520 0.35640 0.22170 -0.03040 0.00560  0.00310  31  ALA A CA  
118  C  C   . ALA A 27  ? 0.22370 0.35070 0.20710 -0.01970 0.00980  0.00060  31  ALA A C   
119  O  O   . ALA A 27  ? 0.25340 0.37350 0.21820 -0.00240 0.01390  0.00020  31  ALA A O   
120  C  CB  . ALA A 27  ? 0.26820 0.36310 0.25370 -0.03550 -0.00800 0.00650  31  ALA A CB  
126  N  N   . GLU A 28  ? 0.20040 0.33000 0.19960 -0.01140 -0.00250 -0.00300 32  GLU A N   
127  C  CA  . GLU A 28  ? 0.19820 0.32900 0.19230 -0.01820 0.00040  -0.01310 32  GLU A CA  
128  C  C   . GLU A 28  ? 0.19890 0.31870 0.18550 -0.00950 0.01700  -0.01740 32  GLU A C   
129  O  O   . GLU A 28  ? 0.21130 0.32160 0.19980 -0.00350 0.01330  -0.01710 32  GLU A O   
130  C  CB  . GLU A 28  ? 0.21650 0.34240 0.20230 -0.02680 -0.00810 -0.02180 32  GLU A CB  
131  C  CG  . GLU A 28  ? 0.21750 0.34460 0.22950 -0.03560 -0.00530 -0.02480 32  GLU A CG  
132  C  CD  . GLU A 28  ? 0.22990 0.34890 0.27580 -0.05470 -0.00240 -0.02200 32  GLU A CD  
133  O  OE1 . GLU A 28  ? 0.24370 0.35920 0.31890 -0.05460 0.00470  -0.01460 32  GLU A OE1 
134  O  OE2 . GLU A 28  ? 0.24380 0.35250 0.27000 -0.06090 0.00690  -0.02230 32  GLU A OE2 
141  N  N   . PRO A 29  ? 0.20500 0.30870 0.18270 -0.00580 0.02320  -0.04690 33  PRO A N   
142  C  CA  . PRO A 29  ? 0.21700 0.30160 0.19190 -0.01290 0.02900  -0.03840 33  PRO A CA  
143  C  C   . PRO A 29  ? 0.20930 0.29150 0.19220 0.00450  0.01170  -0.02850 33  PRO A C   
144  O  O   . PRO A 29  ? 0.21000 0.29760 0.20380 0.01350  0.02790  -0.03780 33  PRO A O   
145  C  CB  . PRO A 29  ? 0.23900 0.30540 0.20820 -0.00410 0.03520  -0.04640 33  PRO A CB  
146  C  CG  . PRO A 29  ? 0.23300 0.31250 0.21330 -0.00070 0.03600  -0.05250 33  PRO A CG  
147  C  CD  . PRO A 29  ? 0.21270 0.31280 0.19710 0.00100  0.03340  -0.04850 33  PRO A CD  
155  N  N   . PHE A 30  ? 0.19060 0.27540 0.18940 0.00480  0.02050  -0.03070 34  PHE A N   
156  C  CA  . PHE A 30  ? 0.18420 0.26690 0.18550 0.00200  0.01390  -0.02410 34  PHE A CA  
157  C  C   . PHE A 30  ? 0.19140 0.26410 0.17690 0.00290  0.00310  -0.02510 34  PHE A C   
158  O  O   . PHE A 30  ? 0.20040 0.25720 0.20570 0.00010  0.00170  -0.03950 34  PHE A O   
159  C  CB  . PHE A 30  ? 0.17870 0.26470 0.18830 0.00580  0.01590  -0.02290 34  PHE A CB  
160  C  CG  . PHE A 30  ? 0.15690 0.26830 0.18380 -0.00300 0.02060  -0.02360 34  PHE A CG  
161  C  CD1 . PHE A 30  ? 0.17000 0.27080 0.18410 0.00190  0.02240  -0.02580 34  PHE A CD1 
162  C  CD2 . PHE A 30  ? 0.18540 0.26610 0.18900 -0.00670 0.01630  -0.02190 34  PHE A CD2 
163  C  CE1 . PHE A 30  ? 0.17530 0.26950 0.17270 -0.01600 0.02200  -0.00640 34  PHE A CE1 
164  C  CE2 . PHE A 30  ? 0.19020 0.26190 0.18810 -0.01110 0.01430  -0.00440 34  PHE A CE2 
165  C  CZ  . PHE A 30  ? 0.17720 0.25950 0.18220 -0.01660 0.02570  -0.00980 34  PHE A CZ  
175  N  N   . ALA A 31  ? 0.20730 0.27340 0.19440 -0.00210 -0.00040 -0.02790 35  ALA A N   
176  C  CA  . ALA A 31  ? 0.20810 0.28270 0.18860 -0.01050 -0.00290 -0.03390 35  ALA A CA  
177  C  C   . ALA A 31  ? 0.21320 0.27740 0.18530 -0.00540 0.01570  -0.04540 35  ALA A C   
178  O  O   . ALA A 31  ? 0.21740 0.25840 0.22040 -0.01970 0.01430  -0.04940 35  ALA A O   
179  C  CB  . ALA A 31  ? 0.23620 0.29480 0.20590 -0.02910 -0.00920 -0.02410 35  ALA A CB  
185  N  N   . LYS A 32  ? 0.23470 0.28430 0.19560 0.00250  0.02420  -0.05800 36  LYS A N   
186  C  CA  . LYS A 32  ? 0.25170 0.29010 0.21550 0.02270  0.03960  -0.06650 36  LYS A CA  
187  C  C   . LYS A 32  ? 0.22400 0.27310 0.23570 0.01650  0.02910  -0.06230 36  LYS A C   
188  O  O   . LYS A 32  ? 0.24060 0.26880 0.25490 0.01990  0.02740  -0.07900 36  LYS A O   
189  C  CB  . LYS A 32  ? 0.29640 0.31750 0.24120 0.02900  0.04990  -0.07190 36  LYS A CB  
190  C  CG  . LYS A 32  ? 0.35620 0.35120 0.29200 0.04110  0.07580  -0.07830 36  LYS A CG  
191  C  CD  . LYS A 32  ? 0.41550 0.37810 0.32940 0.04830  0.07910  -0.07870 36  LYS A CD  
192  C  CE  . LYS A 32  ? 0.46040 0.40680 0.37450 0.06560  0.06170  -0.05700 36  LYS A CE  
193  N  NZ  . LYS A 32  ? 0.48430 0.42260 0.39130 0.07090  0.05300  -0.04900 36  LYS A NZ  
207  N  N   . LEU A 33  ? 0.20110 0.26180 0.22000 0.00510  0.02890  -0.05410 37  LEU A N   
208  C  CA  . LEU A 33  ? 0.18510 0.24470 0.22380 -0.00440 0.00710  -0.05730 37  LEU A CA  
209  C  C   . LEU A 33  ? 0.17780 0.22630 0.22730 -0.00210 0.00790  -0.05160 37  LEU A C   
210  O  O   . LEU A 33  ? 0.17870 0.23010 0.23590 0.00070  0.02490  -0.05110 37  LEU A O   
211  C  CB  . LEU A 33  ? 0.19040 0.25440 0.24510 -0.00570 0.02180  -0.05250 37  LEU A CB  
212  C  CG  . LEU A 33  ? 0.19900 0.25420 0.27480 0.00410  0.00350  -0.06180 37  LEU A CG  
213  C  CD1 . LEU A 33  ? 0.22390 0.27040 0.33070 0.00880  -0.00780 -0.05800 37  LEU A CD1 
214  C  CD2 . LEU A 33  ? 0.20040 0.25320 0.28120 -0.00960 -0.00740 -0.06860 37  LEU A CD2 
226  N  N   . GLU A 34  ? 0.17870 0.22300 0.21400 0.00140  0.00170  -0.04360 38  GLU A N   
227  C  CA  . GLU A 34  ? 0.17670 0.21940 0.21930 0.00560  0.01310  -0.04190 38  GLU A CA  
228  C  C   . GLU A 34  ? 0.19090 0.21550 0.22780 0.01590  0.01310  -0.04610 38  GLU A C   
229  O  O   . GLU A 34  ? 0.20240 0.22800 0.24250 0.01220  0.01670  -0.03140 38  GLU A O   
230  C  CB  . GLU A 34  ? 0.17930 0.22310 0.21520 0.00620  0.01830  -0.04070 38  GLU A CB  
231  C  CG  . GLU A 34  ? 0.18220 0.21870 0.19110 -0.00270 -0.01410 -0.02590 38  GLU A CG  
232  C  CD  . GLU A 34  ? 0.17620 0.21060 0.18670 -0.00770 0.00460  -0.02680 38  GLU A CD  
233  O  OE1 . GLU A 34  ? 0.17040 0.20620 0.17420 -0.00330 -0.01040 -0.02110 38  GLU A OE1 
234  O  OE2 . GLU A 34  ? 0.18350 0.21330 0.18750 -0.00050 -0.00390 -0.04320 38  GLU A OE2 
241  N  N   . GLN A 35  ? 0.20080 0.21530 0.24390 0.00320  0.02300  -0.05210 39  GLN A N   
242  C  CA  . GLN A 35  ? 0.24310 0.23310 0.24630 0.00990  0.00110  -0.06250 39  GLN A CA  
243  C  C   . GLN A 35  ? 0.25750 0.24440 0.25290 0.01900  0.00240  -0.07010 39  GLN A C   
244  O  O   . GLN A 35  ? 0.27390 0.23690 0.27030 0.01020  -0.00020 -0.07130 39  GLN A O   
245  C  CB  . GLN A 35  ? 0.26200 0.25600 0.26300 0.00790  -0.00590 -0.06070 39  GLN A CB  
246  C  CG  . GLN A 35  ? 0.28090 0.27810 0.26870 0.01380  -0.02390 -0.06470 39  GLN A CG  
247  C  CD  . GLN A 35  ? 0.31070 0.30370 0.27140 0.02640  -0.03240 -0.07410 39  GLN A CD  
248  O  OE1 . GLN A 35  ? 0.32480 0.31610 0.28560 0.05050  -0.03170 -0.06920 39  GLN A OE1 
249  N  NE2 . GLN A 35  ? 0.31970 0.31940 0.26460 0.01670  -0.04560 -0.07840 39  GLN A NE2 
258  N  N   . ASP A 36  ? 0.24040 0.25550 0.25070 0.03040  0.01240  -0.08190 40  ASP A N   
259  C  CA  . ASP A 36  ? 0.24560 0.27900 0.25150 0.05550  0.03070  -0.08120 40  ASP A CA  
260  C  C   . ASP A 36  ? 0.24830 0.26720 0.25000 0.05010  0.01520  -0.06740 40  ASP A C   
261  O  O   . ASP A 36  ? 0.28650 0.28440 0.29670 0.05480  0.01150  -0.06100 40  ASP A O   
262  C  CB  . ASP A 36  ? 0.26900 0.32130 0.26050 0.07510  0.04850  -0.09860 40  ASP A CB  
263  C  CG  . ASP A 36  ? 0.32600 0.36570 0.31550 0.06330  0.03870  -0.09350 40  ASP A CG  
264  O  OD1 . ASP A 36  ? 0.34980 0.38240 0.33760 0.07440  0.03120  -0.10540 40  ASP A OD1 
265  O  OD2 . ASP A 36  ? 0.34310 0.38990 0.33460 0.06170  0.05680  -0.08240 40  ASP A OD2 
270  N  N   . PHE A 37  ? 0.22060 0.25000 0.23440 0.03930  0.01880  -0.05480 41  PHE A N   
271  C  CA  . PHE A 37  ? 0.21120 0.23050 0.22300 0.01160  0.00440  -0.03060 41  PHE A CA  
272  C  C   . PHE A 37  ? 0.23050 0.21670 0.24040 0.01010  0.00140  -0.02750 41  PHE A C   
273  O  O   . PHE A 37  ? 0.25460 0.23050 0.27640 0.01100  0.00500  -0.02200 41  PHE A O   
274  C  CB  . PHE A 37  ? 0.18830 0.22460 0.22510 0.01230  0.01680  -0.03140 41  PHE A CB  
275  C  CG  . PHE A 37  ? 0.17510 0.22690 0.24030 -0.01090 0.03530  -0.03790 41  PHE A CG  
276  C  CD1 . PHE A 37  ? 0.18870 0.23930 0.24150 -0.00320 0.02670  -0.03200 41  PHE A CD1 
277  C  CD2 . PHE A 37  ? 0.18330 0.22150 0.24810 -0.01740 0.03210  -0.05630 41  PHE A CD2 
278  C  CE1 . PHE A 37  ? 0.19290 0.23570 0.23280 -0.00960 0.02480  -0.02070 41  PHE A CE1 
279  C  CE2 . PHE A 37  ? 0.16540 0.23080 0.24990 -0.01920 0.04580  -0.05000 41  PHE A CE2 
280  C  CZ  . PHE A 37  ? 0.19490 0.23680 0.23010 -0.02490 0.03860  -0.03480 41  PHE A CZ  
290  N  N   . GLY A 38  ? 0.23330 0.21360 0.24520 0.01930  0.01960  -0.02440 42  GLY A N   
291  C  CA  . GLY A 38  ? 0.23510 0.21220 0.23450 0.00580  0.02510  -0.01510 42  GLY A CA  
292  C  C   . GLY A 38  ? 0.22890 0.20430 0.22440 -0.00680 0.02140  -0.01330 42  GLY A C   
293  O  O   . GLY A 38  ? 0.26050 0.22420 0.24890 -0.00220 0.03910  -0.00790 42  GLY A O   
297  N  N   . GLY A 39  ? 0.19630 0.18670 0.19140 -0.02200 0.03070  -0.01910 43  GLY A N   
298  C  CA  . GLY A 39  ? 0.20180 0.18400 0.17780 -0.01000 0.02700  -0.03170 43  GLY A CA  
299  C  C   . GLY A 39  ? 0.18380 0.19740 0.16130 -0.01270 0.01790  -0.02230 43  GLY A C   
300  O  O   . GLY A 39  ? 0.21270 0.21640 0.17650 0.00110  0.00190  -0.03440 43  GLY A O   
304  N  N   . SER A 40  ? 0.17470 0.18830 0.16320 -0.01520 0.01310  -0.02150 44  SER A N   
305  C  CA  . SER A 40  ? 0.16380 0.19110 0.17550 -0.01540 0.01860  -0.02600 44  SER A CA  
306  C  C   . SER A 40  ? 0.15660 0.18960 0.15910 -0.02980 0.02010  -0.01830 44  SER A C   
307  O  O   . SER A 40  ? 0.17030 0.18320 0.16170 -0.02550 0.00910  -0.01960 44  SER A O   
308  C  CB  . SER A 40  ? 0.15740 0.20970 0.21430 -0.02120 0.00650  -0.02600 44  SER A CB  
309  O  OG  . SER A 40  ? 0.17320 0.22410 0.24750 -0.03010 0.00790  -0.03050 44  SER A OG  
315  N  N   A ILE A 41  ? 0.14770 0.19640 0.14140 -0.01540 0.00420  -0.02600 45  ILE A N   
316  N  N   B ILE A 41  ? 0.15530 0.18970 0.14260 -0.02030 0.01930  -0.01570 45  ILE A N   
317  C  CA  A ILE A 41  ? 0.13760 0.19230 0.16290 -0.01330 0.00200  -0.02030 45  ILE A CA  
318  C  CA  B ILE A 41  ? 0.15370 0.18680 0.13420 -0.01530 0.01920  -0.00920 45  ILE A CA  
319  C  C   A ILE A 41  ? 0.13230 0.19210 0.14710 -0.00830 0.00180  -0.00810 45  ILE A C   
320  C  C   B ILE A 41  ? 0.14460 0.18470 0.13390 -0.00380 0.01260  -0.00520 45  ILE A C   
321  O  O   A ILE A 41  ? 0.17420 0.19990 0.16670 -0.00430 -0.03060 -0.01420 45  ILE A O   
322  O  O   B ILE A 41  ? 0.15690 0.18590 0.14290 0.00340  0.00340  -0.00780 45  ILE A O   
323  C  CB  A ILE A 41  ? 0.14020 0.20600 0.20680 0.00500  -0.00270 -0.02010 45  ILE A CB  
324  C  CB  B ILE A 41  ? 0.16740 0.19190 0.12910 -0.01220 0.02160  -0.00500 45  ILE A CB  
325  C  CG1 A ILE A 41  ? 0.15350 0.20670 0.23310 0.02380  0.00340  -0.02510 45  ILE A CG1 
326  C  CG1 B ILE A 41  ? 0.17920 0.20020 0.13400 -0.00680 0.03230  -0.01000 45  ILE A CG1 
327  C  CG2 A ILE A 41  ? 0.14410 0.21510 0.21620 -0.00140 0.01510  -0.03050 45  ILE A CG2 
328  C  CG2 B ILE A 41  ? 0.16590 0.18950 0.13690 -0.00750 0.02800  -0.00360 45  ILE A CG2 
329  C  CD1 A ILE A 41  ? 0.16410 0.21120 0.25490 0.02320  -0.00940 -0.03180 45  ILE A CD1 
330  C  CD1 B ILE A 41  ? 0.18140 0.20620 0.13340 -0.00810 0.02860  -0.01430 45  ILE A CD1 
353  N  N   . GLY A 42  ? 0.13960 0.18020 0.13420 0.00260  0.00390  -0.00260 46  GLY A N   
354  C  CA  . GLY A 42  ? 0.12940 0.17280 0.13900 -0.01140 0.00040  -0.00050 46  GLY A CA  
355  C  C   . GLY A 42  ? 0.13480 0.18930 0.14150 -0.00720 0.00620  -0.00180 46  GLY A C   
356  O  O   . GLY A 42  ? 0.13990 0.20050 0.14400 -0.01130 -0.00530 0.01340  46  GLY A O   
360  N  N   . VAL A 43  ? 0.13690 0.18400 0.13980 -0.01710 -0.00200 0.01370  47  VAL A N   
361  C  CA  . VAL A 43  ? 0.13980 0.19970 0.13540 -0.00790 -0.01150 0.01580  47  VAL A CA  
362  C  C   . VAL A 43  ? 0.13820 0.20390 0.14060 -0.00950 -0.00830 0.02300  47  VAL A C   
363  O  O   . VAL A 43  ? 0.13990 0.21000 0.13860 -0.00520 -0.00150 0.03050  47  VAL A O   
364  C  CB  . VAL A 43  ? 0.14820 0.21120 0.14330 -0.00290 0.01370  0.01130  47  VAL A CB  
365  C  CG1 . VAL A 43  ? 0.16060 0.22000 0.17110 -0.00890 0.03060  0.01440  47  VAL A CG1 
366  C  CG2 . VAL A 43  ? 0.17340 0.22070 0.18320 0.02150  0.02720  0.00650  47  VAL A CG2 
376  N  N   A TYR A 44  ? 0.14670 0.20810 0.13160 -0.01440 -0.00840 0.01830  48  TYR A N   
377  N  N   B TYR A 44  ? 0.13480 0.20000 0.13220 -0.01180 -0.00810 0.02550  48  TYR A N   
378  C  CA  A TYR A 44  ? 0.14780 0.21560 0.13800 -0.01200 -0.00420 0.01690  48  TYR A CA  
379  C  CA  B TYR A 44  ? 0.13330 0.20030 0.13910 -0.00540 -0.00000 0.02480  48  TYR A CA  
380  C  C   A TYR A 44  ? 0.14630 0.22220 0.15120 -0.01620 -0.00200 0.01830  48  TYR A C   
381  C  C   B TYR A 44  ? 0.13160 0.20890 0.15040 -0.00310 -0.01170 0.02100  48  TYR A C   
382  O  O   A TYR A 44  ? 0.15730 0.22290 0.15730 -0.03040 -0.01860 0.04300  48  TYR A O   
383  O  O   B TYR A 44  ? 0.14470 0.19910 0.16250 -0.00120 -0.03900 0.03100  48  TYR A O   
384  C  CB  A TYR A 44  ? 0.15100 0.22440 0.14720 -0.01170 -0.00470 0.01270  48  TYR A CB  
385  C  CB  B TYR A 44  ? 0.13470 0.19970 0.13730 -0.01070 0.01120  0.02250  48  TYR A CB  
386  C  CG  A TYR A 44  ? 0.15370 0.23600 0.15450 -0.00240 -0.00530 0.00800  48  TYR A CG  
387  C  CG  B TYR A 44  ? 0.13670 0.19990 0.14060 -0.01180 0.02160  0.03010  48  TYR A CG  
388  C  CD1 A TYR A 44  ? 0.15740 0.23990 0.15850 0.01580  -0.00340 -0.00030 48  TYR A CD1 
389  C  CD1 B TYR A 44  ? 0.13440 0.19810 0.13820 0.00790  0.02450  0.03000  48  TYR A CD1 
390  C  CD2 A TYR A 44  ? 0.16510 0.23760 0.15790 0.00440  -0.01630 0.00370  48  TYR A CD2 
391  C  CD2 B TYR A 44  ? 0.15720 0.19780 0.14940 -0.01120 0.01590  0.03340  48  TYR A CD2 
392  C  CE1 A TYR A 44  ? 0.15790 0.23620 0.15950 0.00780  -0.01220 0.00100  48  TYR A CE1 
393  C  CE1 B TYR A 44  ? 0.14470 0.19480 0.13580 -0.00100 0.02020  0.03190  48  TYR A CE1 
394  C  CE2 A TYR A 44  ? 0.16240 0.23620 0.16760 0.00740  -0.00650 -0.00410 48  TYR A CE2 
395  C  CE2 B TYR A 44  ? 0.16660 0.19190 0.13680 -0.00580 0.00620  0.03350  48  TYR A CE2 
396  C  CZ  A TYR A 44  ? 0.15700 0.23450 0.15220 0.01110  -0.00140 0.00070  48  TYR A CZ  
397  C  CZ  B TYR A 44  ? 0.16670 0.18420 0.12660 -0.00370 0.00940  0.03090  48  TYR A CZ  
398  O  OH  A TYR A 44  ? 0.16930 0.24480 0.16060 0.01070  -0.01370 0.00000  48  TYR A OH  
399  O  OH  B TYR A 44  ? 0.20030 0.17790 0.14360 -0.00610 -0.00400 -0.00360 48  TYR A OH  
418  N  N   . ALA A 45  ? 0.14020 0.22690 0.14800 -0.02140 0.01010  0.01390  49  ALA A N   
419  C  CA  . ALA A 45  ? 0.14690 0.23910 0.14660 -0.02900 0.02190  0.02300  49  ALA A CA  
420  C  C   . ALA A 45  ? 0.14840 0.23800 0.15580 -0.03660 0.01870  0.02550  49  ALA A C   
421  O  O   . ALA A 45  ? 0.18790 0.25180 0.15880 -0.03370 -0.00090 0.02060  49  ALA A O   
422  C  CB  . ALA A 45  ? 0.14070 0.24620 0.15420 -0.02930 0.01100  0.00820  49  ALA A CB  
429  N  N   . MET A 46  ? 0.15130 0.23970 0.18150 -0.02910 -0.01040 0.04190  50  MET A N   
430  C  CA  . MET A 46  ? 0.16850 0.25860 0.21960 -0.03580 -0.00710 0.05380  50  MET A CA  
431  C  C   . MET A 46  ? 0.17100 0.24780 0.20830 -0.02360 -0.00790 0.05550  50  MET A C   
432  O  O   . MET A 46  ? 0.15450 0.24120 0.20220 -0.02530 -0.00420 0.04830  50  MET A O   
433  C  CB  . MET A 46  ? 0.17790 0.29900 0.28330 -0.03540 0.02500  0.05770  50  MET A CB  
434  C  CG  . MET A 46  ? 0.25370 0.35230 0.33770 -0.00130 0.00300  0.05730  50  MET A CG  
435  S  SD  . MET A 46  ? 0.31520 0.40380 0.40340 0.00270  -0.00160 0.04380  50  MET A SD  
436  C  CE  . MET A 46  ? 0.31030 0.41580 0.41760 0.00280  0.01210  0.02760  50  MET A CE  
446  N  N   . ASP A 47  ? 0.18450 0.24970 0.20030 -0.03930 -0.01220 0.05810  51  ASP A N   
447  C  CA  . ASP A 47  ? 0.17330 0.26400 0.20230 -0.02420 -0.00500 0.05060  51  ASP A CA  
448  C  C   . ASP A 47  ? 0.15510 0.25630 0.21780 -0.01790 -0.00410 0.05690  51  ASP A C   
449  O  O   . ASP A 47  ? 0.17810 0.26350 0.23140 -0.01010 -0.01090 0.05960  51  ASP A O   
450  C  CB  . ASP A 47  ? 0.20630 0.29180 0.20940 -0.03330 0.01670  0.05050  51  ASP A CB  
451  C  CG  . ASP A 47  ? 0.24210 0.31230 0.24080 -0.02910 0.03290  0.05060  51  ASP A CG  
452  O  OD1 . ASP A 47  ? 0.22500 0.30410 0.26600 -0.04560 0.05980  0.04650  51  ASP A OD1 
453  O  OD2 . ASP A 47  ? 0.27640 0.33530 0.24980 -0.02150 0.05100  0.04300  51  ASP A OD2 
459  N  N   . THR A 48  ? 0.14560 0.24240 0.22890 -0.00970 -0.00760 0.04410  52  THR A N   
460  C  CA  . THR A 48  ? 0.16020 0.25350 0.26290 0.00650  -0.00200 0.04360  52  THR A CA  
461  C  C   . THR A 48  ? 0.19470 0.26300 0.29860 0.00460  -0.00010 0.06390  52  THR A C   
462  O  O   . THR A 48  ? 0.24810 0.26790 0.32350 0.02680  -0.00210 0.06790  52  THR A O   
463  C  CB  . THR A 48  ? 0.16020 0.26820 0.26480 -0.01220 0.02350  0.02220  52  THR A CB  
464  O  OG1 . THR A 48  ? 0.18150 0.25790 0.25690 -0.02590 0.01690  0.02340  52  THR A OG1 
465  C  CG2 . THR A 48  ? 0.14300 0.28170 0.25140 -0.01700 0.02210  0.01870  52  THR A CG2 
473  N  N   . GLY A 49  ? 0.19960 0.26590 0.30270 -0.02160 0.00320  0.10810  53  GLY A N   
474  C  CA  . GLY A 49  ? 0.22960 0.27410 0.32450 -0.02580 -0.01700 0.10670  53  GLY A CA  
475  C  C   . GLY A 49  ? 0.27790 0.29460 0.35060 -0.02170 -0.04700 0.10680  53  GLY A C   
476  O  O   . GLY A 49  ? 0.32390 0.31240 0.38430 -0.00510 -0.07450 0.09910  53  GLY A O   
480  N  N   . SER A 50  ? 0.29020 0.30520 0.34990 -0.03140 -0.07070 0.10790  54  SER A N   
481  C  CA  . SER A 50  ? 0.28750 0.31550 0.34890 -0.04120 -0.07170 0.11240  54  SER A CA  
482  C  C   . SER A 50  ? 0.29510 0.31680 0.36160 -0.02550 -0.08070 0.11880  54  SER A C   
483  O  O   . SER A 50  ? 0.31040 0.32730 0.37370 -0.02110 -0.10090 0.12550  54  SER A O   
484  C  CB  . SER A 50  ? 0.29380 0.33210 0.33530 -0.05110 -0.04990 0.10430  54  SER A CB  
485  O  OG  . SER A 50  ? 0.27860 0.34440 0.31250 -0.06200 -0.02930 0.08820  54  SER A OG  
491  N  N   . GLY A 51  ? 0.28570 0.30850 0.35300 -0.02920 -0.07700 0.10230  55  GLY A N   
492  C  CA  . GLY A 51  ? 0.28580 0.31070 0.34660 -0.01870 -0.05400 0.08870  55  GLY A CA  
493  C  C   . GLY A 51  ? 0.26390 0.30440 0.30720 -0.01430 -0.04740 0.08730  55  GLY A C   
494  O  O   . GLY A 51  ? 0.25250 0.30550 0.30010 -0.01120 -0.02860 0.07030  55  GLY A O   
498  N  N   . ALA A 52  ? 0.25370 0.29540 0.26070 -0.02800 -0.04070 0.08530  56  ALA A N   
499  C  CA  . ALA A 52  ? 0.24620 0.29770 0.24030 -0.03660 -0.03570 0.07020  56  ALA A CA  
500  C  C   . ALA A 52  ? 0.20090 0.29260 0.20620 -0.02760 -0.03480 0.05290  56  ALA A C   
501  O  O   . ALA A 52  ? 0.17580 0.28550 0.20320 -0.03150 -0.02260 0.04780  56  ALA A O   
502  C  CB  . ALA A 52  ? 0.26120 0.30720 0.25600 -0.05060 -0.03050 0.06110  56  ALA A CB  
508  N  N   . THR A 53  ? 0.18390 0.28680 0.18960 -0.02050 -0.01480 0.04080  57  THR A N   
509  C  CA  . THR A 53  ? 0.16270 0.29400 0.18510 -0.01790 0.00010  0.03530  57  THR A CA  
510  C  C   . THR A 53  ? 0.16340 0.29640 0.16480 -0.02120 -0.00620 0.02870  57  THR A C   
511  O  O   . THR A 53  ? 0.18660 0.30500 0.16940 -0.02200 -0.00590 0.03160  57  THR A O   
512  C  CB  . THR A 53  ? 0.16110 0.31350 0.22470 -0.00340 0.00330  0.00660  57  THR A CB  
513  O  OG1 . THR A 53  ? 0.20250 0.33610 0.23320 -0.02530 -0.00800 0.00990  57  THR A OG1 
514  C  CG2 . THR A 53  ? 0.15340 0.32060 0.24990 -0.00330 0.01450  0.00280  57  THR A CG2 
522  N  N   . VAL A 54  ? 0.15870 0.28770 0.16190 -0.02070 -0.00060 0.02180  58  VAL A N   
523  C  CA  . VAL A 54  ? 0.16390 0.26880 0.14110 -0.03210 0.01480  0.01270  58  VAL A CA  
524  C  C   . VAL A 54  ? 0.16860 0.25470 0.14150 -0.02880 0.00040  0.02150  58  VAL A C   
525  O  O   . VAL A 54  ? 0.17810 0.25640 0.14150 -0.03360 0.00210  0.01690  58  VAL A O   
526  C  CB  . VAL A 54  ? 0.16650 0.26990 0.16860 -0.03250 0.01600  0.00160  58  VAL A CB  
527  C  CG1 . VAL A 54  ? 0.18150 0.26210 0.18970 -0.03060 0.00470  -0.00010 58  VAL A CG1 
528  C  CG2 . VAL A 54  ? 0.18010 0.27870 0.17200 -0.02560 0.02590  -0.00690 58  VAL A CG2 
539  N  N   A SER A 55  ? 0.15280 0.24540 0.12800 -0.02300 0.00450  0.02630  59  SER A N   
540  N  N   B SER A 55  ? 0.16680 0.25160 0.13780 -0.02470 0.00240  0.02190  59  SER A N   
541  C  CA  A SER A 55  ? 0.13750 0.23970 0.14090 -0.01100 0.00840  0.02070  59  SER A CA  
542  C  CA  B SER A 55  ? 0.17010 0.25030 0.14220 -0.01900 0.00720  0.01980  59  SER A CA  
543  C  C   A SER A 55  ? 0.13060 0.23770 0.13860 -0.00610 0.00640  0.01660  59  SER A C   
544  C  C   B SER A 55  ? 0.15930 0.24190 0.14060 -0.01300 0.00570  0.01240  59  SER A C   
545  O  O   A SER A 55  ? 0.16400 0.25180 0.14550 -0.01600 -0.00470 0.01880  59  SER A O   
546  O  O   B SER A 55  ? 0.17060 0.24690 0.14270 -0.01730 -0.00080 0.01440  59  SER A O   
547  C  CB  A SER A 55  ? 0.16050 0.23600 0.14880 -0.00300 -0.00270 0.02160  59  SER A CB  
548  C  CB  B SER A 55  ? 0.19550 0.25770 0.14100 -0.01860 0.00550  0.02570  59  SER A CB  
549  O  OG  A SER A 55  ? 0.14710 0.23580 0.14610 0.00110  0.01120  0.01620  59  SER A OG  
550  O  OG  B SER A 55  ? 0.20890 0.26880 0.14990 -0.01940 0.00770  0.02040  59  SER A OG  
561  N  N   . TYR A 56  ? 0.15550 0.23340 0.13850 -0.00910 0.01000  0.00120  60  TYR A N   
562  C  CA  . TYR A 56  ? 0.14410 0.22370 0.13700 -0.00410 0.01690  -0.01220 60  TYR A CA  
563  C  C   . TYR A 56  ? 0.14160 0.21240 0.14640 0.00000  0.00650  -0.00430 60  TYR A C   
564  O  O   . TYR A 56  ? 0.12940 0.21850 0.14210 0.00120  -0.00890 -0.00110 60  TYR A O   
565  C  CB  . TYR A 56  ? 0.15320 0.22910 0.14810 0.00440  0.02070  -0.01040 60  TYR A CB  
566  C  CG  . TYR A 56  ? 0.14910 0.23080 0.14530 0.01180  0.00890  -0.02640 60  TYR A CG  
567  C  CD1 . TYR A 56  ? 0.18590 0.23860 0.14860 0.00160  -0.01090 -0.02260 60  TYR A CD1 
568  C  CD2 . TYR A 56  ? 0.15530 0.23100 0.15010 0.01070  -0.00890 -0.02590 60  TYR A CD2 
569  C  CE1 . TYR A 56  ? 0.19070 0.23850 0.15460 -0.00120 -0.00730 -0.01780 60  TYR A CE1 
570  C  CE2 . TYR A 56  ? 0.16250 0.22930 0.15600 0.00860  -0.00350 -0.03090 60  TYR A CE2 
571  C  CZ  . TYR A 56  ? 0.19510 0.23930 0.16990 -0.00730 -0.01130 -0.02900 60  TYR A CZ  
572  O  OH  . TYR A 56  ? 0.22260 0.25510 0.19360 -0.01730 -0.02980 -0.03050 60  TYR A OH  
583  N  N   . ARG A 57  ? 0.13850 0.20190 0.14290 -0.00920 -0.00130 -0.02060 61  ARG A N   
584  C  CA  . ARG A 57  ? 0.13000 0.20030 0.13980 -0.00060 -0.00550 -0.00150 61  ARG A CA  
585  C  C   . ARG A 57  ? 0.12630 0.20270 0.14300 -0.00330 -0.00180 0.00520  61  ARG A C   
586  O  O   . ARG A 57  ? 0.13830 0.20740 0.14560 0.00140  0.00480  0.01240  61  ARG A O   
587  C  CB  . ARG A 57  ? 0.13450 0.20210 0.15540 0.00730  -0.00350 -0.00420 61  ARG A CB  
588  C  CG  . ARG A 57  ? 0.13670 0.20280 0.17440 -0.00170 -0.01780 -0.01120 61  ARG A CG  
589  C  CD  . ARG A 57  ? 0.15280 0.19850 0.18190 -0.00460 -0.01000 -0.01490 61  ARG A CD  
590  N  NE  . ARG A 57  ? 0.15420 0.21560 0.19090 -0.01000 -0.01490 -0.02590 61  ARG A NE  
591  C  CZ  . ARG A 57  ? 0.16580 0.22840 0.22370 -0.00070 -0.00600 -0.04890 61  ARG A CZ  
592  N  NH1 . ARG A 57  ? 0.15480 0.24580 0.23630 0.01370  -0.01530 -0.04850 61  ARG A NH1 
593  N  NH2 . ARG A 57  ? 0.18060 0.23290 0.24890 -0.01010 0.00660  -0.06640 61  ARG A NH2 
607  N  N   . ALA A 58  ? 0.13950 0.20000 0.13510 0.00920  -0.00490 0.00750  62  ALA A N   
608  C  CA  . ALA A 58  ? 0.14500 0.20680 0.13950 0.00070  0.00320  0.00620  62  ALA A CA  
609  C  C   . ALA A 58  ? 0.14300 0.19840 0.14030 0.00880  -0.01730 0.00520  62  ALA A C   
610  O  O   . ALA A 58  ? 0.13930 0.19340 0.14100 -0.00850 -0.00460 0.00280  62  ALA A O   
611  C  CB  . ALA A 58  ? 0.14800 0.21470 0.15160 0.00580  0.00060  0.01420  62  ALA A CB  
617  N  N   . GLU A 59  ? 0.13380 0.20660 0.14260 0.02010  -0.01470 0.00120  63  GLU A N   
618  C  CA  . GLU A 59  ? 0.14600 0.19630 0.14450 0.02930  -0.00280 -0.00910 63  GLU A CA  
619  C  C   . GLU A 59  ? 0.13550 0.20460 0.15380 0.01040  0.01790  0.00250  63  GLU A C   
620  O  O   . GLU A 59  ? 0.15710 0.22750 0.20820 0.01050  0.03800  0.01080  63  GLU A O   
621  C  CB  . GLU A 59  ? 0.16090 0.21220 0.16490 0.03420  -0.00430 0.00060  63  GLU A CB  
622  C  CG  . GLU A 59  ? 0.17380 0.21710 0.16660 0.03530  -0.00890 0.01190  63  GLU A CG  
623  C  CD  . GLU A 59  ? 0.16440 0.22010 0.16360 0.01530  -0.01610 0.02530  63  GLU A CD  
624  O  OE1 . GLU A 59  ? 0.18220 0.23660 0.15140 0.01360  -0.01570 0.00720  63  GLU A OE1 
625  O  OE2 . GLU A 59  ? 0.18410 0.22950 0.16140 0.00160  -0.02830 0.02270  63  GLU A OE2 
632  N  N   . GLU A 60  ? 0.12880 0.20690 0.13430 0.00520  0.00070  -0.00290 64  GLU A N   
633  C  CA  . GLU A 60  ? 0.12200 0.20490 0.14780 -0.00270 -0.00490 -0.00460 64  GLU A CA  
634  C  C   . GLU A 60  ? 0.12460 0.20450 0.15450 -0.00770 -0.01480 0.00020  64  GLU A C   
635  O  O   . GLU A 60  ? 0.13370 0.21220 0.14580 -0.00840 0.00160  0.00360  64  GLU A O   
636  C  CB  . GLU A 60  ? 0.14470 0.20470 0.16190 0.01150  -0.00700 -0.00820 64  GLU A CB  
637  C  CG  . GLU A 60  ? 0.18270 0.20660 0.16200 0.01200  -0.01190 -0.01620 64  GLU A CG  
638  C  CD  . GLU A 60  ? 0.18890 0.19580 0.15300 0.00460  -0.01770 -0.01680 64  GLU A CD  
639  O  OE1 . GLU A 60  ? 0.29890 0.20950 0.15460 0.00940  0.00320  -0.00170 64  GLU A OE1 
640  O  OE2 . GLU A 60  ? 0.15140 0.20380 0.17120 0.01350  -0.02510 -0.02230 64  GLU A OE2 
647  N  N   . ARG A 61  ? 0.13130 0.20040 0.14490 -0.00910 -0.00840 0.00380  65  ARG A N   
648  C  CA  . ARG A 61  ? 0.12480 0.19750 0.14760 -0.01540 0.01240  -0.01070 65  ARG A CA  
649  C  C   . ARG A 61  ? 0.11870 0.18430 0.14020 -0.02620 0.00180  -0.01230 65  ARG A C   
650  O  O   . ARG A 61  ? 0.13290 0.18760 0.15630 -0.02920 -0.00760 -0.02200 65  ARG A O   
651  C  CB  . ARG A 61  ? 0.13210 0.19910 0.14860 -0.00920 0.00670  -0.01420 65  ARG A CB  
652  C  CG  . ARG A 61  ? 0.13580 0.19640 0.16300 -0.00460 0.01880  -0.01240 65  ARG A CG  
653  C  CD  . ARG A 61  ? 0.13690 0.19910 0.16830 -0.00150 0.00640  -0.01170 65  ARG A CD  
654  N  NE  . ARG A 61  ? 0.14230 0.20950 0.16460 0.00550  0.00250  -0.02960 65  ARG A NE  
655  C  CZ  . ARG A 61  ? 0.15050 0.19750 0.15760 0.00770  0.01560  -0.01330 65  ARG A CZ  
656  N  NH1 . ARG A 61  ? 0.13830 0.20550 0.14330 -0.00380 0.00030  0.00140  65  ARG A NH1 
657  N  NH2 . ARG A 61  ? 0.15740 0.20000 0.17850 0.01450  -0.00380 0.00830  65  ARG A NH2 
671  N  N   . PHE A 62  ? 0.11510 0.17140 0.13920 -0.00700 -0.00350 -0.01470 66  PHE A N   
672  C  CA  . PHE A 62  ? 0.12230 0.16200 0.14310 -0.00740 0.00750  -0.01200 66  PHE A CA  
673  C  C   . PHE A 62  ? 0.12250 0.14000 0.14620 -0.00980 0.00670  0.00090  66  PHE A C   
674  O  O   . PHE A 62  ? 0.14180 0.15470 0.15540 -0.00610 0.01070  -0.01000 66  PHE A O   
675  C  CB  . PHE A 62  ? 0.12820 0.15950 0.16200 -0.00490 0.00950  -0.00900 66  PHE A CB  
676  C  CG  . PHE A 62  ? 0.11590 0.17720 0.15330 -0.00160 0.00330  -0.00780 66  PHE A CG  
677  C  CD1 . PHE A 62  ? 0.12740 0.19470 0.15810 -0.00280 0.00610  0.00060  66  PHE A CD1 
678  C  CD2 . PHE A 62  ? 0.13000 0.19000 0.14460 -0.00500 0.01310  -0.00210 66  PHE A CD2 
679  C  CE1 . PHE A 62  ? 0.11830 0.19960 0.16500 -0.01090 0.00970  0.00570  66  PHE A CE1 
680  C  CE2 . PHE A 62  ? 0.14960 0.20380 0.15330 -0.01580 0.00460  0.00330  66  PHE A CE2 
681  C  CZ  . PHE A 62  ? 0.14050 0.20010 0.15890 -0.02040 0.00280  0.00610  66  PHE A CZ  
691  N  N   . PRO A 63  ? 0.13760 0.15160 0.14120 -0.01450 0.00180  -0.00920 67  PRO A N   
692  C  CA  . PRO A 63  ? 0.13590 0.15740 0.14570 -0.01590 0.00130  -0.01330 67  PRO A CA  
693  C  C   . PRO A 63  ? 0.12690 0.16170 0.13030 -0.00660 0.00440  0.00040  67  PRO A C   
694  O  O   . PRO A 63  ? 0.12000 0.19560 0.13770 -0.01280 0.00410  -0.01160 67  PRO A O   
695  C  CB  . PRO A 63  ? 0.14390 0.15100 0.16470 -0.02430 -0.00090 0.00170  67  PRO A CB  
696  C  CG  . PRO A 63  ? 0.14400 0.15510 0.16940 -0.03250 -0.00220 0.01270  67  PRO A CG  
697  C  CD  . PRO A 63  ? 0.14420 0.15310 0.14850 -0.02640 -0.00890 0.00700  67  PRO A CD  
705  N  N   . LEU A 64  ? 0.12840 0.16500 0.13280 -0.01400 0.01230  -0.02040 68  LEU A N   
706  C  CA  . LEU A 64  ? 0.13110 0.16530 0.14590 -0.02160 0.01060  -0.01000 68  LEU A CA  
707  C  C   . LEU A 64  ? 0.12090 0.17310 0.14240 -0.02250 0.00750  -0.00150 68  LEU A C   
708  O  O   . LEU A 64  ? 0.12420 0.17670 0.14320 -0.01680 0.00630  0.00130  68  LEU A O   
709  C  CB  . LEU A 64  ? 0.11810 0.17480 0.15850 -0.00950 0.00320  -0.01410 68  LEU A CB  
710  C  CG  . LEU A 64  ? 0.12740 0.18340 0.16550 0.00050  -0.01440 -0.00600 68  LEU A CG  
711  C  CD1 . LEU A 64  ? 0.14620 0.18690 0.18350 -0.00100 -0.00970 -0.00360 68  LEU A CD1 
712  C  CD2 . LEU A 64  ? 0.16560 0.20360 0.17240 -0.00510 -0.01140 0.01810  68  LEU A CD2 
724  N  N   . CYS A 65  ? 0.12690 0.17610 0.16300 -0.00980 0.01710  -0.00060 69  CYS A N   
725  C  CA  . CYS A 65  ? 0.12340 0.18400 0.14960 -0.00960 -0.00800 0.00190  69  CYS A CA  
726  C  C   . CYS A 65  ? 0.12720 0.18560 0.13860 -0.00710 0.00220  -0.00420 69  CYS A C   
727  O  O   . CYS A 65  ? 0.13750 0.19620 0.15300 0.00040  -0.00240 -0.01150 69  CYS A O   
728  C  CB  . CYS A 65  ? 0.13220 0.18860 0.17370 -0.00460 -0.00380 0.00180  69  CYS A CB  
729  S  SG  . CYS A 65  ? 0.15260 0.19150 0.16560 -0.00380 -0.01110 -0.00780 69  CYS A SG  
734  N  N   . SER A 66  ? 0.12280 0.18610 0.15070 -0.00350 -0.00360 -0.01400 70  SER A N   
735  C  CA  . SER A 66  ? 0.13070 0.18600 0.14550 0.00090  -0.00950 -0.00260 70  SER A CA  
736  C  C   . SER A 66  ? 0.12700 0.18900 0.14170 -0.00870 -0.00980 -0.01320 70  SER A C   
737  O  O   . SER A 66  ? 0.13550 0.19950 0.15370 -0.01000 -0.01420 -0.01290 70  SER A O   
738  C  CB  . SER A 66  ? 0.16090 0.19930 0.14300 0.00590  -0.01630 0.00260  70  SER A CB  
739  O  OG  . SER A 66  ? 0.17820 0.21910 0.15290 0.00730  -0.01080 0.01140  70  SER A OG  
744  N  N   . SER A 67  ? 0.13250 0.18530 0.13880 -0.02030 -0.00790 -0.01130 71  SER A N   
745  C  CA  . SER A 67  ? 0.13060 0.18610 0.14210 -0.02720 0.00690  -0.00450 71  SER A CA  
746  C  C   . SER A 67  ? 0.12560 0.18610 0.14110 -0.02170 -0.01110 0.00650  71  SER A C   
747  O  O   . SER A 67  ? 0.14250 0.19060 0.14430 -0.01940 0.00270  0.00580  71  SER A O   
748  C  CB  . SER A 67  ? 0.12380 0.18740 0.16640 -0.01730 -0.00860 -0.01230 71  SER A CB  
749  O  OG  . SER A 67  ? 0.13040 0.18250 0.15280 -0.02160 -0.00850 0.00080  71  SER A OG  
755  N  N   . PHE A 68  ? 0.12460 0.18690 0.14210 -0.02080 0.00860  -0.00920 72  PHE A N   
756  C  CA  . PHE A 68  ? 0.14810 0.19100 0.14300 -0.01970 -0.00160 -0.01600 72  PHE A CA  
757  C  C   . PHE A 68  ? 0.14100 0.18810 0.13780 -0.01930 -0.00490 -0.02450 72  PHE A C   
758  O  O   . PHE A 68  ? 0.14280 0.17890 0.15790 -0.00950 -0.00650 -0.02030 72  PHE A O   
759  C  CB  . PHE A 68  ? 0.13510 0.19840 0.16920 -0.01780 0.00610  0.00120  72  PHE A CB  
760  C  CG  . PHE A 68  ? 0.13850 0.19740 0.16510 0.00070  0.01470  -0.00040 72  PHE A CG  
761  C  CD1 . PHE A 68  ? 0.13820 0.19560 0.19590 -0.00200 0.02630  0.01150  72  PHE A CD1 
762  C  CD2 . PHE A 68  ? 0.13990 0.20710 0.16240 -0.01170 0.01780  0.00570  72  PHE A CD2 
763  C  CE1 . PHE A 68  ? 0.13760 0.20350 0.21760 -0.00110 0.02390  0.01450  72  PHE A CE1 
764  C  CE2 . PHE A 68  ? 0.15020 0.20930 0.15900 -0.01580 0.01080  -0.00180 72  PHE A CE2 
765  C  CZ  . PHE A 68  ? 0.15900 0.21280 0.17940 -0.01350 0.00560  0.01200  72  PHE A CZ  
775  N  N   . LYS A 69  ? 0.13400 0.19250 0.14740 -0.01230 -0.01060 -0.02600 73  LYS A N   
776  C  CA  . LYS A 69  ? 0.13500 0.19440 0.14660 -0.01440 -0.00930 -0.02480 73  LYS A CA  
777  C  C   . LYS A 69  ? 0.12760 0.20990 0.15730 -0.01290 -0.01820 -0.01130 73  LYS A C   
778  O  O   . LYS A 69  ? 0.14700 0.20580 0.15500 -0.02310 -0.01300 -0.01770 73  LYS A O   
779  C  CB  . LYS A 69  ? 0.14230 0.19330 0.15790 -0.01230 -0.01930 -0.01910 73  LYS A CB  
780  C  CG  . LYS A 69  ? 0.14340 0.19350 0.15940 -0.01290 -0.01180 -0.01770 73  LYS A CG  
781  C  CD  . LYS A 69  ? 0.15510 0.20590 0.15620 -0.01360 -0.01040 -0.00820 73  LYS A CD  
782  C  CE  . LYS A 69  ? 0.16150 0.21680 0.16840 -0.00730 -0.01490 0.00000  73  LYS A CE  
783  N  NZ  . LYS A 69  ? 0.16190 0.21760 0.17180 -0.00600 -0.01820 -0.00270 73  LYS A NZ  
797  N  N   . GLY A 70  ? 0.13270 0.21180 0.14860 -0.00750 -0.00840 0.00230  74  GLY A N   
798  C  CA  . GLY A 70  ? 0.13640 0.20770 0.15460 -0.01340 -0.00510 -0.00860 74  GLY A CA  
799  C  C   . GLY A 70  ? 0.13050 0.19700 0.14260 -0.01580 0.00200  -0.01600 74  GLY A C   
800  O  O   . GLY A 70  ? 0.14650 0.19870 0.16190 -0.02560 0.00290  -0.01050 74  GLY A O   
804  N  N   . PHE A 71  ? 0.14330 0.18920 0.16110 -0.01340 -0.01650 -0.02750 75  PHE A N   
805  C  CA  . PHE A 71  ? 0.15100 0.18700 0.15490 -0.00340 -0.01200 -0.01490 75  PHE A CA  
806  C  C   . PHE A 71  ? 0.14290 0.18660 0.15180 -0.00360 -0.01370 -0.02760 75  PHE A C   
807  O  O   . PHE A 71  ? 0.16590 0.18750 0.17340 -0.01090 -0.00380 -0.03490 75  PHE A O   
808  C  CB  . PHE A 71  ? 0.15230 0.19440 0.16310 0.00170  -0.01250 0.00030  75  PHE A CB  
809  C  CG  . PHE A 71  ? 0.13610 0.19520 0.15080 -0.00850 -0.00360 0.00080  75  PHE A CG  
810  C  CD1 . PHE A 71  ? 0.16450 0.20550 0.15990 -0.00690 0.00750  -0.00440 75  PHE A CD1 
811  C  CD2 . PHE A 71  ? 0.14350 0.19580 0.14760 -0.00930 -0.00070 0.00350  75  PHE A CD2 
812  C  CE1 . PHE A 71  ? 0.16230 0.21350 0.16880 -0.01260 -0.00520 -0.00770 75  PHE A CE1 
813  C  CE2 . PHE A 71  ? 0.15230 0.19600 0.16090 -0.00350 -0.00550 0.00000  75  PHE A CE2 
814  C  CZ  . PHE A 71  ? 0.15130 0.20280 0.15270 -0.01300 0.00330  -0.01230 75  PHE A CZ  
824  N  N   . LEU A 72  ? 0.14390 0.20040 0.15140 -0.01710 -0.01030 -0.01690 76  LEU A N   
825  C  CA  . LEU A 72  ? 0.15120 0.20310 0.14900 -0.01070 -0.01060 -0.02280 76  LEU A CA  
826  C  C   . LEU A 72  ? 0.15440 0.19910 0.15700 -0.00780 -0.00180 -0.02290 76  LEU A C   
827  O  O   . LEU A 72  ? 0.16720 0.20190 0.16520 -0.00750 0.00680  -0.02610 76  LEU A O   
828  C  CB  . LEU A 72  ? 0.16450 0.22190 0.15250 -0.01140 -0.00900 -0.01520 76  LEU A CB  
829  C  CG  . LEU A 72  ? 0.18420 0.24740 0.15240 -0.03620 -0.01720 -0.00310 76  LEU A CG  
830  C  CD1 . LEU A 72  ? 0.19800 0.28150 0.17450 -0.01490 0.01060  -0.00330 76  LEU A CD1 
831  C  CD2 . LEU A 72  ? 0.24280 0.25600 0.17420 -0.04220 -0.03790 -0.00300 76  LEU A CD2 
843  N  N   . ALA A 73  ? 0.14170 0.19940 0.16880 -0.02060 -0.00080 -0.02340 77  ALA A N   
844  C  CA  . ALA A 73  ? 0.15830 0.18870 0.17480 -0.02470 -0.00540 -0.01950 77  ALA A CA  
845  C  C   . ALA A 73  ? 0.16270 0.18420 0.17260 -0.02890 0.01040  -0.02860 77  ALA A C   
846  O  O   . ALA A 73  ? 0.18210 0.20130 0.18540 -0.03280 0.00110  -0.03560 77  ALA A O   
847  C  CB  . ALA A 73  ? 0.15890 0.20370 0.19660 -0.02030 -0.00980 -0.02410 77  ALA A CB  
853  N  N   . ALA A 74  ? 0.15920 0.19630 0.17540 -0.02090 -0.00470 -0.03240 78  ALA A N   
854  C  CA  . ALA A 74  ? 0.18110 0.19500 0.18310 -0.02270 -0.00090 -0.02050 78  ALA A CA  
855  C  C   . ALA A 74  ? 0.18700 0.17980 0.17050 -0.02330 -0.00780 -0.02770 78  ALA A C   
856  O  O   . ALA A 74  ? 0.19870 0.18430 0.19710 -0.02130 0.00070  -0.03300 78  ALA A O   
857  C  CB  . ALA A 74  ? 0.19290 0.20080 0.19040 -0.02720 -0.00900 -0.01230 78  ALA A CB  
863  N  N   . ALA A 75  ? 0.17660 0.18050 0.19000 -0.01660 0.01520  -0.01380 79  ALA A N   
864  C  CA  . ALA A 75  ? 0.17140 0.17580 0.21110 -0.01640 0.00290  -0.01790 79  ALA A CA  
865  C  C   . ALA A 75  ? 0.18940 0.18280 0.20270 -0.01370 -0.00020 -0.03280 79  ALA A C   
866  O  O   . ALA A 75  ? 0.20910 0.18790 0.21830 -0.01200 0.00710  -0.04680 79  ALA A O   
867  C  CB  . ALA A 75  ? 0.17410 0.18780 0.22420 -0.01170 0.00310  -0.02300 79  ALA A CB  
873  N  N   . VAL A 76  ? 0.18770 0.20390 0.20240 -0.01960 -0.00030 -0.02980 80  VAL A N   
874  C  CA  . VAL A 76  ? 0.20450 0.20620 0.19100 -0.02310 0.00420  -0.03680 80  VAL A CA  
875  C  C   . VAL A 76  ? 0.19690 0.20920 0.19400 -0.03500 -0.00150 -0.04620 80  VAL A C   
876  O  O   . VAL A 76  ? 0.22260 0.21190 0.20710 -0.02320 0.00870  -0.04880 80  VAL A O   
877  C  CB  . VAL A 76  ? 0.21900 0.21970 0.20890 -0.02150 -0.01480 -0.03250 80  VAL A CB  
878  C  CG1 . VAL A 76  ? 0.23660 0.22710 0.23810 -0.01460 -0.03180 -0.03320 80  VAL A CG1 
879  C  CG2 . VAL A 76  ? 0.23020 0.22330 0.21260 -0.02380 -0.00890 -0.03810 80  VAL A CG2 
889  N  N   . LEU A 77  ? 0.19840 0.21660 0.19130 -0.02760 0.00160  -0.03270 81  LEU A N   
890  C  CA  . LEU A 77  ? 0.21420 0.21860 0.20990 -0.03730 0.01180  -0.03870 81  LEU A CA  
891  C  C   . LEU A 77  ? 0.23020 0.21850 0.23150 -0.03720 0.00580  -0.03670 81  LEU A C   
892  O  O   . LEU A 77  ? 0.26110 0.21990 0.26530 -0.04200 -0.00080 -0.03480 81  LEU A O   
893  C  CB  . LEU A 77  ? 0.21400 0.23670 0.21520 -0.03140 0.01040  -0.02470 81  LEU A CB  
894  C  CG  . LEU A 77  ? 0.21480 0.24830 0.23220 -0.03780 0.01170  -0.03180 81  LEU A CG  
895  C  CD1 . LEU A 77  ? 0.23260 0.24590 0.21760 -0.03470 0.02920  -0.03680 81  LEU A CD1 
896  C  CD2 . LEU A 77  ? 0.21370 0.25630 0.25220 -0.04480 0.00070  -0.04360 81  LEU A CD2 
908  N  N   . ALA A 78  ? 0.22270 0.21520 0.24280 -0.01230 -0.00780 -0.04210 82  ALA A N   
909  C  CA  . ALA A 78  ? 0.25320 0.21270 0.25060 -0.00850 -0.00840 -0.04400 82  ALA A CA  
910  C  C   . ALA A 78  ? 0.28320 0.21260 0.25970 0.00450  0.00670  -0.06150 82  ALA A C   
911  O  O   . ALA A 78  ? 0.29310 0.20880 0.28820 0.00320  0.00400  -0.06350 82  ALA A O   
912  C  CB  . ALA A 78  ? 0.24540 0.21060 0.24620 -0.01840 -0.01790 -0.03610 82  ALA A CB  
918  N  N   A ARG A 79  ? 0.29680 0.22850 0.26050 0.00200  0.00800  -0.06500 83  ARG A N   
919  N  N   B ARG A 79  ? 0.29810 0.22780 0.26190 0.00100  0.00730  -0.06690 83  ARG A N   
920  C  CA  A ARG A 79  ? 0.32650 0.24610 0.26880 0.00160  0.01360  -0.06730 83  ARG A CA  
921  C  CA  B ARG A 79  ? 0.32620 0.24430 0.27060 -0.00070 0.01140  -0.07140 83  ARG A CA  
922  C  C   A ARG A 79  ? 0.35380 0.24560 0.26050 -0.00600 0.00860  -0.07630 83  ARG A C   
923  C  C   B ARG A 79  ? 0.35150 0.24550 0.26120 -0.00830 0.00660  -0.07890 83  ARG A C   
924  O  O   A ARG A 79  ? 0.38090 0.24230 0.27470 0.00190  0.01260  -0.07510 83  ARG A O   
925  O  O   B ARG A 79  ? 0.37410 0.24390 0.27050 -0.00200 0.01100  -0.08100 83  ARG A O   
926  C  CB  A ARG A 79  ? 0.34210 0.26980 0.28650 0.00830  0.02500  -0.06530 83  ARG A CB  
927  C  CB  B ARG A 79  ? 0.33970 0.26430 0.29030 0.00490  0.02050  -0.07250 83  ARG A CB  
928  C  CG  A ARG A 79  ? 0.36560 0.29180 0.30460 0.01050  0.01960  -0.06200 83  ARG A CG  
929  C  CG  B ARG A 79  ? 0.36350 0.28610 0.31780 0.00460  0.01140  -0.07080 83  ARG A CG  
930  C  CD  A ARG A 79  ? 0.40000 0.31910 0.34830 0.00010  0.00320  -0.05320 83  ARG A CD  
931  C  CD  B ARG A 79  ? 0.38370 0.30750 0.34360 0.00200  0.00670  -0.06360 83  ARG A CD  
932  N  NE  A ARG A 79  ? 0.42720 0.34260 0.37500 -0.01060 0.00040  -0.04170 83  ARG A NE  
933  N  NE  B ARG A 79  ? 0.39240 0.32260 0.35770 0.00110  -0.00130 -0.06090 83  ARG A NE  
934  C  CZ  A ARG A 79  ? 0.44790 0.36340 0.38600 -0.02000 0.00410  -0.03350 83  ARG A CZ  
935  C  CZ  B ARG A 79  ? 0.40440 0.33570 0.37540 -0.00380 -0.02300 -0.06700 83  ARG A CZ  
936  N  NH1 A ARG A 79  ? 0.46150 0.37350 0.40040 -0.02100 -0.00470 -0.02720 83  ARG A NH1 
937  N  NH1 B ARG A 79  ? 0.40190 0.34230 0.38150 -0.00250 -0.01390 -0.06480 83  ARG A NH1 
938  N  NH2 A ARG A 79  ? 0.45420 0.37060 0.38970 -0.02410 0.00880  -0.03480 83  ARG A NH2 
939  N  NH2 B ARG A 79  ? 0.41010 0.33740 0.37460 -0.00760 -0.04650 -0.07630 83  ARG A NH2 
966  N  N   . SER A 80  ? 0.35390 0.24790 0.25530 -0.02430 -0.01480 -0.07510 84  SER A N   
967  C  CA  . SER A 80  ? 0.36880 0.25700 0.27950 -0.06410 -0.02910 -0.06670 84  SER A CA  
968  C  C   . SER A 80  ? 0.39880 0.26080 0.29320 -0.08090 -0.03060 -0.05970 84  SER A C   
969  O  O   . SER A 80  ? 0.41410 0.26060 0.29690 -0.08400 -0.04070 -0.05780 84  SER A O   
970  C  CB  . SER A 80  ? 0.36080 0.27880 0.27280 -0.07830 -0.04530 -0.06520 84  SER A CB  
971  O  OG  . SER A 80  ? 0.36390 0.28790 0.27290 -0.09540 -0.04420 -0.05920 84  SER A OG  
977  N  N   . GLN A 81  ? 0.43110 0.27330 0.29420 -0.06680 -0.01380 -0.05690 85  GLN A N   
978  C  CA  . GLN A 81  ? 0.47470 0.29190 0.31620 -0.05480 -0.00290 -0.06580 85  GLN A CA  
979  C  C   . GLN A 81  ? 0.55720 0.31000 0.34610 -0.03820 -0.00460 -0.08170 85  GLN A C   
980  O  O   . GLN A 81  ? 0.57640 0.30860 0.37700 -0.04270 -0.01460 -0.08500 85  GLN A O   
981  C  CB  . GLN A 81  ? 0.43990 0.29450 0.30830 -0.05510 0.00140  -0.05720 85  GLN A CB  
982  C  CG  . GLN A 81  ? 0.41920 0.30470 0.30930 -0.04650 0.00910  -0.05560 85  GLN A CG  
983  C  CD  . GLN A 81  ? 0.41340 0.31360 0.31770 -0.03650 0.01630  -0.05880 85  GLN A CD  
984  O  OE1 . GLN A 81  ? 0.40390 0.30790 0.31740 -0.04150 0.02950  -0.06100 85  GLN A OE1 
985  N  NE2 . GLN A 81  ? 0.42280 0.33180 0.33600 -0.02370 0.00480  -0.05660 85  GLN A NE2 
994  N  N   . GLN A 82  ? 0.61760 0.33290 0.35220 -0.01470 0.00630  -0.09410 86  GLN A N   
995  C  CA  . GLN A 82  ? 0.67700 0.36540 0.37540 0.00130  0.00820  -0.09500 86  GLN A CA  
996  C  C   . GLN A 82  ? 0.71130 0.36230 0.36940 0.00960  -0.00790 -0.09630 86  GLN A C   
997  O  O   . GLN A 82  ? 0.71580 0.35800 0.35130 0.01850  -0.00080 -0.10640 86  GLN A O   
998  C  CB  . GLN A 82  ? 0.70600 0.40480 0.41820 0.00950  0.02430  -0.08470 86  GLN A CB  
999  C  CG  . GLN A 82  ? 0.73140 0.43690 0.46170 0.01200  0.03070  -0.07780 86  GLN A CG  
1000 C  CD  . GLN A 82  ? 0.75330 0.46370 0.49760 0.01260  0.04010  -0.07310 86  GLN A CD  
1001 O  OE1 . GLN A 82  ? 0.76130 0.47950 0.51980 0.00970  0.04000  -0.06330 86  GLN A OE1 
1002 N  NE2 . GLN A 82  ? 0.76310 0.47340 0.51170 0.01700  0.03970  -0.07250 86  GLN A NE2 
1011 N  N   . GLN A 83  ? 0.73440 0.36200 0.37370 0.00340  -0.03550 -0.08600 87  GLN A N   
1012 C  CA  . GLN A 83  ? 0.75020 0.36040 0.37540 -0.01180 -0.06250 -0.07890 87  GLN A CA  
1013 C  C   . GLN A 83  ? 0.75220 0.34710 0.36030 -0.03540 -0.08770 -0.08170 87  GLN A C   
1014 O  O   . GLN A 83  ? 0.75960 0.33630 0.33910 -0.03990 -0.09760 -0.09030 87  GLN A O   
1015 C  CB  . GLN A 83  ? 0.75980 0.37750 0.41110 -0.00440 -0.06070 -0.06100 87  GLN A CB  
1016 C  CG  . GLN A 83  ? 0.76840 0.39650 0.44490 0.00690  -0.05380 -0.04490 87  GLN A CG  
1017 C  CD  . GLN A 83  ? 0.77550 0.41840 0.47960 0.01290  -0.04850 -0.02990 87  GLN A CD  
1018 O  OE1 . GLN A 83  ? 0.78040 0.42360 0.48920 0.01930  -0.04080 -0.01910 87  GLN A OE1 
1019 N  NE2 . GLN A 83  ? 0.77770 0.42980 0.49760 0.01530  -0.04480 -0.02570 87  GLN A NE2 
1028 N  N   . ALA A 84  ? 0.74680 0.34980 0.38910 -0.04800 -0.09970 -0.06500 88  ALA A N   
1029 C  CA  . ALA A 84  ? 0.73200 0.34940 0.40210 -0.06340 -0.10100 -0.05970 88  ALA A CA  
1030 C  C   . ALA A 84  ? 0.71190 0.34530 0.40860 -0.07370 -0.10120 -0.06670 88  ALA A C   
1031 O  O   . ALA A 84  ? 0.71960 0.35110 0.41900 -0.07980 -0.10630 -0.06600 88  ALA A O   
1032 C  CB  . ALA A 84  ? 0.73750 0.35650 0.40890 -0.06700 -0.10490 -0.05530 88  ALA A CB  
1039 N  N   . GLY A 85  ? 0.68120 0.32910 0.38950 -0.07820 -0.10710 -0.07790 89  GLY A N   
1040 C  CA  . GLY A 85  ? 0.64030 0.30780 0.37660 -0.08070 -0.10800 -0.09320 89  GLY A CA  
1041 C  C   . GLY A 85  ? 0.59650 0.29280 0.36060 -0.08250 -0.09530 -0.08990 89  GLY A C   
1042 O  O   . GLY A 85  ? 0.60480 0.29240 0.37100 -0.07610 -0.09000 -0.10130 89  GLY A O   
1046 N  N   . LEU A 86  ? 0.54750 0.28780 0.33510 -0.07500 -0.07180 -0.07600 90  LEU A N   
1047 C  CA  . LEU A 86  ? 0.48980 0.27990 0.31270 -0.07150 -0.05270 -0.07960 90  LEU A CA  
1048 C  C   . LEU A 86  ? 0.45930 0.27520 0.28740 -0.08450 -0.05090 -0.07310 90  LEU A C   
1049 O  O   . LEU A 86  ? 0.45290 0.26800 0.27850 -0.09670 -0.04210 -0.07490 90  LEU A O   
1050 C  CB  . LEU A 86  ? 0.46330 0.27650 0.31490 -0.05100 -0.03910 -0.06690 90  LEU A CB  
1051 C  CG  . LEU A 86  ? 0.43390 0.27460 0.31070 -0.04050 -0.02710 -0.05890 90  LEU A CG  
1052 C  CD1 . LEU A 86  ? 0.41860 0.27980 0.30840 -0.02610 -0.02860 -0.06420 90  LEU A CD1 
1053 C  CD2 . LEU A 86  ? 0.42250 0.27860 0.30810 -0.04140 -0.01730 -0.04470 90  LEU A CD2 
1065 N  N   . LEU A 87  ? 0.43850 0.28470 0.29090 -0.09930 -0.05280 -0.06010 91  LEU A N   
1066 C  CA  . LEU A 87  ? 0.40760 0.30370 0.27270 -0.10850 -0.04990 -0.03720 91  LEU A CA  
1067 C  C   . LEU A 87  ? 0.37630 0.31290 0.27540 -0.12280 -0.04750 -0.02180 91  LEU A C   
1068 O  O   . LEU A 87  ? 0.32180 0.30950 0.24730 -0.12620 -0.05780 -0.01810 91  LEU A O   
1069 C  CB  . LEU A 87  ? 0.40250 0.31230 0.26710 -0.11800 -0.05310 -0.02160 91  LEU A CB  
1070 C  CG  . LEU A 87  ? 0.40140 0.32900 0.28840 -0.12620 -0.05220 -0.01190 91  LEU A CG  
1071 C  CD1 . LEU A 87  ? 0.41010 0.34280 0.30650 -0.12640 -0.05040 0.00270  91  LEU A CD1 
1072 C  CD2 . LEU A 87  ? 0.38560 0.32640 0.28260 -0.13690 -0.05500 -0.01750 91  LEU A CD2 
1084 N  N   . ASP A 88  ? 0.39860 0.32560 0.27830 -0.12560 -0.04400 -0.02840 92  ASP A N   
1085 C  CA  . ASP A 88  ? 0.40540 0.33330 0.29010 -0.13850 -0.04890 -0.04670 92  ASP A CA  
1086 C  C   . ASP A 88  ? 0.37870 0.32290 0.25740 -0.11380 -0.02210 -0.06170 92  ASP A C   
1087 O  O   . ASP A 88  ? 0.37610 0.33300 0.26100 -0.12000 -0.02100 -0.04340 92  ASP A O   
1088 C  CB  . ASP A 88  ? 0.46560 0.36030 0.34340 -0.13740 -0.06040 -0.05150 92  ASP A CB  
1089 C  CG  . ASP A 88  ? 0.53170 0.39250 0.39960 -0.11090 -0.02250 -0.04730 92  ASP A CG  
1090 O  OD1 . ASP A 88  ? 0.56770 0.41100 0.39840 -0.09430 -0.01610 -0.05100 92  ASP A OD1 
1091 O  OD2 . ASP A 88  ? 0.55190 0.41050 0.45290 -0.10800 -0.00100 -0.02630 92  ASP A OD2 
1096 N  N   . THR A 89  ? 0.36630 0.29990 0.25060 -0.09130 -0.00070 -0.06260 93  THR A N   
1097 C  CA  . THR A 89  ? 0.35230 0.29150 0.22570 -0.05900 -0.00370 -0.07390 93  THR A CA  
1098 C  C   . THR A 89  ? 0.29380 0.29470 0.20320 -0.04630 -0.00370 -0.05550 93  THR A C   
1099 O  O   . THR A 89  ? 0.27920 0.29180 0.20690 -0.03600 -0.01250 -0.04030 93  THR A O   
1100 C  CB  . THR A 89  ? 0.38660 0.28670 0.26360 -0.03390 -0.00300 -0.08210 93  THR A CB  
1101 O  OG1 . THR A 89  ? 0.42610 0.29570 0.31320 -0.01580 0.00140  -0.07430 93  THR A OG1 
1102 C  CG2 . THR A 89  ? 0.36970 0.27860 0.26320 -0.03540 0.00570  -0.08570 93  THR A CG2 
1110 N  N   A PRO A 90  ? 0.27380 0.29990 0.20100 -0.04540 0.00320  -0.05350 94  PRO A N   
1111 N  N   B PRO A 90  ? 0.28000 0.29600 0.18930 -0.05090 -0.00150 -0.05430 94  PRO A N   
1112 C  CA  A PRO A 90  ? 0.25250 0.30390 0.20050 -0.04580 0.00430  -0.04770 94  PRO A CA  
1113 C  CA  B PRO A 90  ? 0.24390 0.30080 0.18000 -0.05760 0.00540  -0.04510 94  PRO A CA  
1114 C  C   A PRO A 90  ? 0.23820 0.30450 0.20400 -0.04120 0.00720  -0.03690 94  PRO A C   
1115 C  C   B PRO A 90  ? 0.22750 0.30230 0.18950 -0.04600 0.02010  -0.03340 94  PRO A C   
1116 O  O   A PRO A 90  ? 0.24930 0.30800 0.22020 -0.03020 0.00300  -0.03450 94  PRO A O   
1117 O  O   B PRO A 90  ? 0.22580 0.29920 0.18330 -0.03630 0.02590  -0.04220 94  PRO A O   
1118 C  CB  A PRO A 90  ? 0.25440 0.30690 0.20830 -0.04200 0.00280  -0.05270 94  PRO A CB  
1119 C  CB  B PRO A 90  ? 0.25100 0.30380 0.19300 -0.05440 -0.00260 -0.04900 94  PRO A CB  
1120 C  CG  A PRO A 90  ? 0.25650 0.30630 0.20940 -0.04370 0.01080  -0.05020 94  PRO A CG  
1121 C  CG  B PRO A 90  ? 0.27660 0.30300 0.20890 -0.04710 -0.00510 -0.04580 94  PRO A CG  
1122 C  CD  A PRO A 90  ? 0.26810 0.30420 0.20310 -0.04910 0.01030  -0.05270 94  PRO A CD  
1123 C  CD  B PRO A 90  ? 0.28550 0.30180 0.20210 -0.05590 -0.00840 -0.05250 94  PRO A CD  
1138 N  N   . ILE A 91  ? 0.21490 0.30020 0.19600 -0.04570 0.01160  -0.03010 95  ILE A N   
1139 C  CA  . ILE A 91  ? 0.20920 0.29790 0.19750 -0.03280 0.00920  -0.03100 95  ILE A CA  
1140 C  C   . ILE A 91  ? 0.19790 0.31970 0.17880 -0.02630 0.02950  -0.01480 95  ILE A C   
1141 O  O   . ILE A 91  ? 0.18300 0.32130 0.19490 -0.01300 0.01620  0.02360  95  ILE A O   
1142 C  CB  . ILE A 91  ? 0.22080 0.29540 0.20870 -0.01350 -0.02020 -0.02190 95  ILE A CB  
1143 C  CG1 . ILE A 91  ? 0.23680 0.29990 0.20990 -0.00440 -0.01460 -0.03150 95  ILE A CG1 
1144 C  CG2 . ILE A 91  ? 0.22650 0.29000 0.21920 -0.00560 0.00060  -0.04180 95  ILE A CG2 
1145 C  CD1 . ILE A 91  ? 0.27060 0.31290 0.22110 0.01130  0.00670  -0.02360 95  ILE A CD1 
1158 N  N   A ARG A 92  ? 0.22130 0.32560 0.17620 -0.02550 0.04140  -0.01190 96  ARG A N   
1159 N  N   B ARG A 92  ? 0.21650 0.32500 0.17880 -0.02270 0.03500  -0.01520 96  ARG A N   
1160 C  CA  A ARG A 92  ? 0.23400 0.33350 0.17230 -0.02730 0.03040  -0.01070 96  ARG A CA  
1161 C  CA  B ARG A 92  ? 0.22500 0.33290 0.17690 -0.02280 0.01660  -0.01600 96  ARG A CA  
1162 C  C   A ARG A 92  ? 0.20400 0.32950 0.18110 -0.00770 0.03220  -0.01830 96  ARG A C   
1163 C  C   B ARG A 92  ? 0.19430 0.33030 0.18460 -0.00700 0.01930  -0.01490 96  ARG A C   
1164 O  O   A ARG A 92  ? 0.20390 0.33100 0.20750 0.00240  0.05260  -0.01900 96  ARG A O   
1165 O  O   B ARG A 92  ? 0.18140 0.33180 0.20450 0.00300  0.03170  -0.00870 96  ARG A O   
1166 C  CB  A ARG A 92  ? 0.26780 0.34480 0.17470 -0.04210 0.03930  -0.00240 96  ARG A CB  
1167 C  CB  B ARG A 92  ? 0.24660 0.34210 0.18640 -0.03210 0.01930  -0.01750 96  ARG A CB  
1168 C  CG  A ARG A 92  ? 0.28920 0.35440 0.17680 -0.05080 0.03500  0.00810  96  ARG A CG  
1169 C  CG  B ARG A 92  ? 0.26960 0.34960 0.21070 -0.04430 0.01230  -0.01320 96  ARG A CG  
1170 C  CD  A ARG A 92  ? 0.31870 0.36560 0.18720 -0.05420 0.02040  0.02380  96  ARG A CD  
1171 C  CD  B ARG A 92  ? 0.28750 0.36040 0.23190 -0.04970 0.02940  -0.00550 96  ARG A CD  
1172 N  NE  A ARG A 92  ? 0.32600 0.37290 0.18360 -0.06680 0.01170  0.03050  96  ARG A NE  
1173 N  NE  B ARG A 92  ? 0.30450 0.36830 0.23860 -0.05290 0.03710  0.00030  96  ARG A NE  
1174 C  CZ  A ARG A 92  ? 0.31760 0.37910 0.17910 -0.07990 0.01120  0.03550  96  ARG A CZ  
1175 C  CZ  B ARG A 92  ? 0.29830 0.37110 0.22590 -0.05360 0.06030  0.00760  96  ARG A CZ  
1176 N  NH1 A ARG A 92  ? 0.31740 0.38420 0.17680 -0.08300 0.01030  0.04070  96  ARG A NH1 
1177 N  NH1 B ARG A 92  ? 0.30510 0.37270 0.22260 -0.04740 0.07080  0.01460  96  ARG A NH1 
1178 N  NH2 A ARG A 92  ? 0.31550 0.37510 0.16400 -0.08460 0.00970  0.04590  96  ARG A NH2 
1179 N  NH2 B ARG A 92  ? 0.30480 0.37560 0.24320 -0.05490 0.07340  0.01280  96  ARG A NH2 
1206 N  N   . TYR A 93  ? 0.18070 0.32140 0.17130 -0.00820 0.01850  -0.02180 97  TYR A N   
1207 C  CA  . TYR A 93  ? 0.18310 0.31280 0.17830 -0.01260 0.00410  -0.01010 97  TYR A CA  
1208 C  C   . TYR A 93  ? 0.18300 0.33230 0.16910 -0.01760 -0.00310 -0.00410 97  TYR A C   
1209 O  O   . TYR A 93  ? 0.19510 0.33670 0.19220 -0.00960 0.00130  -0.00120 97  TYR A O   
1210 C  CB  . TYR A 93  ? 0.18030 0.29460 0.16490 -0.00390 0.00720  0.00800  97  TYR A CB  
1211 C  CG  . TYR A 93  ? 0.16400 0.28320 0.15300 0.00170  -0.01760 -0.00830 97  TYR A CG  
1212 C  CD1 . TYR A 93  ? 0.17910 0.28120 0.14520 -0.01360 -0.01100 -0.02600 97  TYR A CD1 
1213 C  CD2 . TYR A 93  ? 0.16260 0.27800 0.14920 0.00430  -0.00770 -0.00840 97  TYR A CD2 
1214 C  CE1 . TYR A 93  ? 0.15440 0.28010 0.15770 -0.01390 -0.00340 -0.02950 97  TYR A CE1 
1215 C  CE2 . TYR A 93  ? 0.15170 0.27910 0.15560 0.00460  -0.01480 -0.01470 97  TYR A CE2 
1216 C  CZ  . TYR A 93  ? 0.14140 0.28020 0.15090 -0.01290 -0.01220 -0.02140 97  TYR A CZ  
1217 O  OH  . TYR A 93  ? 0.16250 0.28840 0.16310 -0.00210 -0.00680 -0.02660 97  TYR A OH  
1228 N  N   . GLY A 94  ? 0.19960 0.33840 0.19400 -0.02360 -0.00600 0.02440  98  GLY A N   
1229 C  CA  . GLY A 94  ? 0.22260 0.34000 0.20670 -0.02520 0.00110  0.03240  98  GLY A CA  
1230 C  C   . GLY A 94  ? 0.20180 0.33630 0.20220 -0.03370 -0.01070 0.02370  98  GLY A C   
1231 O  O   . GLY A 94  ? 0.18990 0.33300 0.20990 -0.04010 -0.00590 0.02150  98  GLY A O   
1235 N  N   . LYS A 95  ? 0.21180 0.34000 0.19620 -0.03800 -0.01200 0.02150  99  LYS A N   
1236 C  CA  . LYS A 95  ? 0.24140 0.34400 0.19270 -0.03200 -0.01190 0.03640  99  LYS A CA  
1237 C  C   . LYS A 95  ? 0.26390 0.35870 0.21570 -0.04800 -0.01540 0.04570  99  LYS A C   
1238 O  O   . LYS A 95  ? 0.29000 0.35110 0.21080 -0.04610 -0.01400 0.03250  99  LYS A O   
1239 C  CB  . LYS A 95  ? 0.30330 0.35780 0.23180 -0.00160 -0.03130 0.03990  99  LYS A CB  
1240 C  CG  . LYS A 95  ? 0.36240 0.37650 0.29380 0.01390  -0.03940 0.03000  99  LYS A CG  
1241 C  CD  . LYS A 95  ? 0.41300 0.39420 0.34140 0.02110  -0.02770 0.02930  99  LYS A CD  
1242 C  CE  . LYS A 95  ? 0.45830 0.41300 0.38650 0.02280  -0.02280 0.03330  99  LYS A CE  
1243 N  NZ  . LYS A 95  ? 0.48640 0.42820 0.42050 0.02630  -0.02340 0.03130  99  LYS A NZ  
1257 N  N   . ASN A 96  ? 0.23960 0.38370 0.22710 -0.08560 -0.01980 0.05170  100 ASN A N   
1258 C  CA  . ASN A 96  ? 0.25120 0.41050 0.26710 -0.09440 -0.02850 0.05640  100 ASN A CA  
1259 C  C   . ASN A 96  ? 0.24380 0.40010 0.27070 -0.10610 -0.05020 0.06220  100 ASN A C   
1260 O  O   . ASN A 96  ? 0.27710 0.40280 0.30620 -0.11310 -0.07290 0.05630  100 ASN A O   
1261 C  CB  . ASN A 96  ? 0.25990 0.44820 0.32100 -0.07580 -0.01410 0.04720  100 ASN A CB  
1262 C  CG  . ASN A 96  ? 0.27100 0.47770 0.34810 -0.05370 0.00830  0.04280  100 ASN A CG  
1263 O  OD1 . ASN A 96  ? 0.31190 0.48560 0.36150 -0.04200 0.02290  0.04840  100 ASN A OD1 
1264 N  ND2 . ASN A 96  ? 0.28160 0.49550 0.37500 -0.04800 -0.00430 0.02880  100 ASN A ND2 
1271 N  N   . ALA A 97  ? 0.22530 0.38690 0.24960 -0.08560 -0.04760 0.06500  101 ALA A N   
1272 C  CA  . ALA A 97  ? 0.22270 0.37470 0.25520 -0.07260 -0.05680 0.07070  101 ALA A CA  
1273 C  C   . ALA A 97  ? 0.20160 0.36330 0.23500 -0.06460 -0.05820 0.06550  101 ALA A C   
1274 O  O   . ALA A 97  ? 0.19880 0.38030 0.25110 -0.05220 -0.02640 0.08280  101 ALA A O   
1275 C  CB  . ALA A 97  ? 0.25730 0.36930 0.27660 -0.06820 -0.05880 0.08120  101 ALA A CB  
1281 N  N   A LEU A 98  ? 0.21010 0.34070 0.21820 -0.07150 -0.06200 0.05760  102 LEU A N   
1282 N  N   B LEU A 98  ? 0.22280 0.35310 0.23540 -0.07060 -0.06180 0.04860  102 LEU A N   
1283 C  CA  A LEU A 98  ? 0.21430 0.32630 0.20420 -0.06740 -0.05340 0.05970  102 LEU A CA  
1284 C  CA  B LEU A 98  ? 0.24020 0.34520 0.23940 -0.07940 -0.04700 0.03580  102 LEU A CA  
1285 C  C   A LEU A 98  ? 0.22590 0.32480 0.20510 -0.05360 -0.04510 0.05070  102 LEU A C   
1286 C  C   B LEU A 98  ? 0.26590 0.34820 0.25740 -0.07680 -0.03210 0.02630  102 LEU A C   
1287 O  O   A LEU A 98  ? 0.23440 0.32680 0.21900 -0.05640 -0.04220 0.03890  102 LEU A O   
1288 O  O   B LEU A 98  ? 0.28730 0.35540 0.27880 -0.09710 -0.00830 0.01380  102 LEU A O   
1289 C  CB  A LEU A 98  ? 0.22740 0.31230 0.20230 -0.05480 -0.04410 0.06500  102 LEU A CB  
1290 C  CB  B LEU A 98  ? 0.23860 0.33420 0.23340 -0.07810 -0.04480 0.03080  102 LEU A CB  
1291 C  CG  A LEU A 98  ? 0.23070 0.30060 0.21890 -0.04290 -0.03800 0.06590  102 LEU A CG  
1292 C  CG  B LEU A 98  ? 0.21770 0.32670 0.23040 -0.07950 -0.06350 0.02870  102 LEU A CG  
1293 C  CD1 A LEU A 98  ? 0.23730 0.29740 0.23150 -0.04640 -0.03560 0.08020  102 LEU A CD1 
1294 C  CD1 B LEU A 98  ? 0.21440 0.32820 0.23640 -0.07440 -0.08180 0.02690  102 LEU A CD1 
1295 C  CD2 A LEU A 98  ? 0.21320 0.29830 0.22540 -0.04270 -0.02040 0.06450  102 LEU A CD2 
1296 C  CD2 B LEU A 98  ? 0.21750 0.32660 0.22530 -0.07540 -0.05800 0.02860  102 LEU A CD2 
1319 N  N   A VAL A 99  ? 0.23520 0.31820 0.19050 -0.03060 -0.05170 0.02540  103 VAL A N   
1320 N  N   B VAL A 99  ? 0.27120 0.34080 0.25290 -0.04440 -0.04250 0.01800  103 VAL A N   
1321 C  CA  A VAL A 99  ? 0.22710 0.30670 0.20770 -0.02630 -0.04750 -0.00200 103 VAL A CA  
1322 C  CA  B VAL A 99  ? 0.25580 0.32870 0.23030 -0.02030 -0.07920 0.01080  103 VAL A CA  
1323 C  C   A VAL A 99  ? 0.20740 0.29880 0.21050 -0.01650 -0.06310 0.00710  103 VAL A C   
1324 C  C   B VAL A 99  ? 0.23930 0.31390 0.22080 -0.00960 -0.06790 0.01600  103 VAL A C   
1325 O  O   A VAL A 99  ? 0.19760 0.29530 0.20950 -0.00940 -0.06690 0.00760  103 VAL A O   
1326 O  O   B VAL A 99  ? 0.24630 0.31530 0.21830 -0.00140 -0.05780 0.02220  103 VAL A O   
1327 C  CB  A VAL A 99  ? 0.24160 0.29510 0.20290 -0.02190 -0.01950 0.00670  103 VAL A CB  
1328 C  CB  B VAL A 99  ? 0.26450 0.32820 0.22230 -0.01210 -0.11250 0.01080  103 VAL A CB  
1329 C  CG1 A VAL A 99  ? 0.25480 0.29180 0.21810 -0.02450 -0.02150 0.01350  103 VAL A CG1 
1330 C  CG1 B VAL A 99  ? 0.26820 0.32790 0.22210 -0.01620 -0.12520 0.01990  103 VAL A CG1 
1331 C  CG2 A VAL A 99  ? 0.21200 0.28140 0.15440 -0.02210 0.02770  0.03140  103 VAL A CG2 
1332 C  CG2 B VAL A 99  ? 0.25620 0.32310 0.20780 -0.01310 -0.12460 0.01160  103 VAL A CG2 
1351 N  N   . PRO A 100 ? 0.23250 0.29980 0.22460 -0.00030 -0.05390 0.00900  104 PRO A N   
1352 C  CA  . PRO A 100 ? 0.23830 0.28540 0.24630 0.00890  -0.04920 0.01190  104 PRO A CA  
1353 C  C   . PRO A 100 ? 0.20660 0.28060 0.22050 0.00820  -0.05100 -0.01060 104 PRO A C   
1354 O  O   . PRO A 100 ? 0.21040 0.28000 0.21390 0.00870  -0.03520 0.00610  104 PRO A O   
1355 C  CB  . PRO A 100 ? 0.25550 0.28100 0.26620 0.00230  -0.04610 0.01560  104 PRO A CB  
1356 C  CG  . PRO A 100 ? 0.26160 0.29220 0.27810 0.00680  -0.04100 0.01270  104 PRO A CG  
1357 C  CD  . PRO A 100 ? 0.24480 0.30000 0.24630 -0.00230 -0.04200 0.00780  104 PRO A CD  
1365 N  N   . TRP A 101 ? 0.20420 0.27420 0.23020 0.01550  -0.05710 -0.03550 105 TRP A N   
1366 C  CA  . TRP A 101 ? 0.19890 0.28940 0.21590 0.01910  -0.04760 -0.05460 105 TRP A CA  
1367 C  C   . TRP A 101 ? 0.17520 0.27680 0.21550 0.01650  -0.03800 -0.03630 105 TRP A C   
1368 O  O   . TRP A 101 ? 0.18590 0.28090 0.21980 0.00490  -0.04780 -0.02030 105 TRP A O   
1369 C  CB  . TRP A 101 ? 0.22520 0.32660 0.23890 0.02100  -0.02120 -0.06510 105 TRP A CB  
1370 C  CG  . TRP A 101 ? 0.25230 0.36730 0.28960 0.03270  -0.01880 -0.06160 105 TRP A CG  
1371 C  CD1 . TRP A 101 ? 0.24630 0.38100 0.28830 0.02670  -0.02960 -0.06810 105 TRP A CD1 
1372 C  CD2 . TRP A 101 ? 0.32070 0.39780 0.39480 0.04420  0.02620  -0.03880 105 TRP A CD2 
1373 N  NE1 . TRP A 101 ? 0.29020 0.39620 0.36500 0.02660  0.00550  -0.04620 105 TRP A NE1 
1374 C  CE2 . TRP A 101 ? 0.31970 0.40550 0.41580 0.04050  0.04370  -0.03670 105 TRP A CE2 
1375 C  CE3 . TRP A 101 ? 0.35270 0.41340 0.44220 0.05590  0.05500  -0.03540 105 TRP A CE3 
1376 C  CZ2 . TRP A 101 ? 0.35620 0.41960 0.46420 0.04860  0.06360  -0.02840 105 TRP A CZ2 
1377 C  CZ3 . TRP A 101 ? 0.37480 0.42600 0.47390 0.05160  0.06230  -0.02480 105 TRP A CZ3 
1378 C  CH2 . TRP A 101 ? 0.37080 0.42580 0.48280 0.04900  0.06280  -0.01910 105 TRP A CH2 
1389 N  N   . SER A 102 ? 0.17820 0.26920 0.20930 0.01630  -0.05000 -0.03580 106 SER A N   
1390 C  CA  . SER A 102 ? 0.17730 0.26590 0.20560 0.00880  -0.03350 -0.04070 106 SER A CA  
1391 C  C   . SER A 102 ? 0.17670 0.28390 0.19330 0.01390  -0.04910 -0.04370 106 SER A C   
1392 O  O   . SER A 102 ? 0.18250 0.28090 0.18880 -0.00280 -0.04440 -0.02550 106 SER A O   
1393 C  CB  . SER A 102 ? 0.18370 0.26230 0.20580 0.00720  -0.02840 -0.03050 106 SER A CB  
1394 O  OG  . SER A 102 ? 0.18770 0.26120 0.21020 -0.00430 -0.02410 -0.03560 106 SER A OG  
1401 N  N   . PRO A 103 ? 0.17320 0.30970 0.20730 0.01260  -0.03210 -0.05120 107 PRO A N   
1402 C  CA  . PRO A 103 ? 0.18030 0.30710 0.21630 0.01190  -0.02980 -0.06050 107 PRO A CA  
1403 C  C   . PRO A 103 ? 0.16570 0.30050 0.19970 0.00600  -0.04040 -0.03470 107 PRO A C   
1404 O  O   . PRO A 103 ? 0.19220 0.31460 0.22920 0.01050  -0.05990 -0.02550 107 PRO A O   
1405 C  CB  . PRO A 103 ? 0.20650 0.32530 0.23930 0.01440  -0.01920 -0.05670 107 PRO A CB  
1406 C  CG  . PRO A 103 ? 0.20550 0.33020 0.23490 0.01820  -0.02170 -0.03120 107 PRO A CG  
1407 C  CD  . PRO A 103 ? 0.19240 0.32220 0.19940 0.01690  -0.02950 -0.05120 107 PRO A CD  
1415 N  N   . ILE A 104 ? 0.14450 0.29310 0.18260 0.01240  -0.02510 -0.02800 108 ILE A N   
1416 C  CA  . ILE A 104 ? 0.14670 0.29570 0.17650 -0.00130 -0.01840 -0.01350 108 ILE A CA  
1417 C  C   . ILE A 104 ? 0.14690 0.28590 0.16720 -0.00110 -0.01970 -0.02360 108 ILE A C   
1418 O  O   . ILE A 104 ? 0.15100 0.29210 0.16320 -0.01860 -0.03290 -0.00530 108 ILE A O   
1419 C  CB  . ILE A 104 ? 0.16210 0.31260 0.16090 -0.01150 -0.02830 0.00520  108 ILE A CB  
1420 C  CG1 . ILE A 104 ? 0.17750 0.33900 0.14240 -0.00020 -0.02300 0.00540  108 ILE A CG1 
1421 C  CG2 . ILE A 104 ? 0.16300 0.31300 0.20880 -0.02000 -0.04040 0.02910  108 ILE A CG2 
1422 C  CD1 . ILE A 104 ? 0.17380 0.35500 0.15450 0.00850  -0.01280 0.01220  108 ILE A CD1 
1434 N  N   A SER A 105 ? 0.15340 0.28450 0.16410 0.00540  -0.03500 -0.02750 109 SER A N   
1435 N  N   B SER A 105 ? 0.16360 0.28240 0.15570 0.00350  -0.01900 -0.02490 109 SER A N   
1436 C  CA  A SER A 105 ? 0.15830 0.28660 0.17210 0.00910  -0.02370 -0.02790 109 SER A CA  
1437 C  CA  B SER A 105 ? 0.17800 0.28030 0.14460 0.00890  -0.01320 -0.02440 109 SER A CA  
1438 C  C   A SER A 105 ? 0.14550 0.28060 0.16430 0.00280  -0.01320 -0.01110 109 SER A C   
1439 C  C   B SER A 105 ? 0.16880 0.27830 0.14220 0.00810  -0.01690 -0.01180 109 SER A C   
1440 O  O   A SER A 105 ? 0.13210 0.27920 0.15750 -0.01050 -0.00490 -0.01070 109 SER A O   
1441 O  O   B SER A 105 ? 0.16890 0.27880 0.12040 0.01650  -0.01540 -0.00720 109 SER A O   
1442 C  CB  A SER A 105 ? 0.15450 0.28870 0.17900 0.00350  -0.01180 -0.03190 109 SER A CB  
1443 C  CB  B SER A 105 ? 0.19810 0.27880 0.13290 0.01280  0.00680  -0.02960 109 SER A CB  
1444 O  OG  A SER A 105 ? 0.14420 0.29660 0.15940 -0.01140 -0.00190 -0.02080 109 SER A OG  
1445 O  OG  B SER A 105 ? 0.21540 0.27950 0.11770 0.01240  0.01750  -0.03170 109 SER A OG  
1456 N  N   . GLU A 106 ? 0.16520 0.27590 0.16150 -0.00600 -0.02440 -0.00860 110 GLU A N   
1457 C  CA  . GLU A 106 ? 0.17680 0.28110 0.18220 -0.00630 -0.02360 0.00520  110 GLU A CA  
1458 C  C   . GLU A 106 ? 0.16080 0.27870 0.16610 -0.01520 -0.03260 0.02120  110 GLU A C   
1459 O  O   . GLU A 106 ? 0.17290 0.29440 0.19840 -0.02990 -0.04180 0.02780  110 GLU A O   
1460 C  CB  . GLU A 106 ? 0.20780 0.28980 0.22580 -0.00740 -0.03430 -0.00380 110 GLU A CB  
1461 C  CG  . GLU A 106 ? 0.21240 0.29640 0.26970 -0.01130 -0.03550 -0.03610 110 GLU A CG  
1462 C  CD  . GLU A 106 ? 0.25500 0.31910 0.32820 -0.01460 -0.01340 -0.06320 110 GLU A CD  
1463 O  OE1 . GLU A 106 ? 0.26850 0.31850 0.34180 -0.02180 -0.02360 -0.05490 110 GLU A OE1 
1464 O  OE2 . GLU A 106 ? 0.30050 0.34190 0.36550 -0.01460 0.02290  -0.08660 110 GLU A OE2 
1472 N  N   A LYS A 107 ? 0.14220 0.27210 0.16860 -0.01140 -0.02560 0.01810  111 LYS A N   
1473 N  N   B LYS A 107 ? 0.15400 0.26960 0.16700 -0.01420 -0.01480 0.02160  111 LYS A N   
1474 C  CA  A LYS A 107 ? 0.13600 0.26670 0.17560 -0.00480 -0.02890 0.01560  111 LYS A CA  
1475 C  CA  B LYS A 107 ? 0.16200 0.26200 0.17440 -0.00910 -0.01070 0.02290  111 LYS A CA  
1476 C  C   A LYS A 107 ? 0.13010 0.26150 0.17690 -0.00920 -0.02750 0.01250  111 LYS A C   
1477 C  C   B LYS A 107 ? 0.14800 0.25390 0.17270 -0.01350 -0.02320 0.02360  111 LYS A C   
1478 O  O   A LYS A 107 ? 0.12710 0.26600 0.17580 -0.00980 -0.02500 0.00860  111 LYS A O   
1479 O  O   B LYS A 107 ? 0.15410 0.25260 0.16870 -0.01370 -0.02660 0.02620  111 LYS A O   
1480 C  CB  A LYS A 107 ? 0.12980 0.27010 0.18280 0.00270  -0.03530 -0.00360 111 LYS A CB  
1481 C  CB  B LYS A 107 ? 0.17770 0.26620 0.18160 -0.00320 -0.00210 0.00620  111 LYS A CB  
1482 C  CG  A LYS A 107 ? 0.13290 0.28090 0.19030 0.01640  -0.02420 -0.01670 111 LYS A CG  
1483 C  CG  B LYS A 107 ? 0.19790 0.27760 0.19170 0.00440  0.01400  -0.00160 111 LYS A CG  
1484 C  CD  A LYS A 107 ? 0.14640 0.29640 0.20830 0.01350  -0.02060 -0.04270 111 LYS A CD  
1485 C  CD  B LYS A 107 ? 0.21190 0.29240 0.21840 -0.00150 0.00890  -0.01680 111 LYS A CD  
1486 C  CE  A LYS A 107 ? 0.15310 0.30610 0.22310 0.01200  -0.02540 -0.05300 111 LYS A CE  
1487 C  CE  B LYS A 107 ? 0.22860 0.30300 0.24070 -0.00070 0.01320  -0.03230 111 LYS A CE  
1488 N  NZ  A LYS A 107 ? 0.16260 0.31310 0.23200 0.00080  -0.04440 -0.05970 111 LYS A NZ  
1489 N  NZ  B LYS A 107 ? 0.24460 0.30170 0.25800 -0.00710 0.02040  -0.04340 111 LYS A NZ  
1516 N  N   . TYR A 108 ? 0.13970 0.25260 0.17240 -0.00900 -0.02890 0.00820  112 TYR A N   
1517 C  CA  . TYR A 108 ? 0.14180 0.24870 0.17280 -0.01190 -0.02220 0.00440  112 TYR A CA  
1518 C  C   . TYR A 108 ? 0.14260 0.24460 0.17590 -0.02750 -0.02280 0.01480  112 TYR A C   
1519 O  O   . TYR A 108 ? 0.17030 0.24890 0.15900 -0.01910 -0.01370 -0.00810 112 TYR A O   
1520 C  CB  . TYR A 108 ? 0.14660 0.24590 0.17930 -0.00170 -0.01770 -0.00490 112 TYR A CB  
1521 C  CG  . TYR A 108 ? 0.14780 0.22420 0.17000 -0.01080 -0.01490 -0.01360 112 TYR A CG  
1522 C  CD1 . TYR A 108 ? 0.14280 0.22580 0.17930 -0.02050 -0.02550 -0.01350 112 TYR A CD1 
1523 C  CD2 . TYR A 108 ? 0.16130 0.22140 0.15420 -0.00690 -0.01680 -0.01230 112 TYR A CD2 
1524 C  CE1 . TYR A 108 ? 0.14260 0.22460 0.17880 -0.01360 -0.01120 -0.01930 112 TYR A CE1 
1525 C  CE2 . TYR A 108 ? 0.16200 0.21170 0.17620 -0.01770 -0.02880 -0.01220 112 TYR A CE2 
1526 C  CZ  . TYR A 108 ? 0.14160 0.21490 0.16800 -0.01980 -0.01320 -0.01510 112 TYR A CZ  
1527 O  OH  . TYR A 108 ? 0.15470 0.23520 0.16740 -0.02550 0.00090  -0.02670 112 TYR A OH  
1538 N  N   . LEU A 109 ? 0.16210 0.25180 0.19090 -0.02270 -0.00880 0.01570  113 LEU A N   
1539 C  CA  . LEU A 109 ? 0.16280 0.26120 0.20850 -0.02960 -0.01690 0.01320  113 LEU A CA  
1540 C  C   . LEU A 109 ? 0.15650 0.26280 0.20320 -0.01920 -0.03000 0.01670  113 LEU A C   
1541 O  O   . LEU A 109 ? 0.16350 0.27430 0.18520 -0.00920 -0.01250 0.01170  113 LEU A O   
1542 C  CB  . LEU A 109 ? 0.16410 0.26620 0.21640 -0.04080 -0.01600 0.01370  113 LEU A CB  
1543 C  CG  . LEU A 109 ? 0.18150 0.27020 0.22170 -0.05030 -0.00470 0.02420  113 LEU A CG  
1544 C  CD1 . LEU A 109 ? 0.18190 0.28780 0.22170 -0.03050 0.00720  0.03900  113 LEU A CD1 
1545 C  CD2 . LEU A 109 ? 0.20920 0.27390 0.22480 -0.04460 -0.00320 0.02420  113 LEU A CD2 
1557 N  N   . THR A 110 ? 0.16580 0.26120 0.20690 -0.03640 -0.02000 0.00780  114 THR A N   
1558 C  CA  . THR A 110 ? 0.16600 0.27010 0.18810 -0.03690 -0.02200 -0.00330 114 THR A CA  
1559 C  C   . THR A 110 ? 0.18950 0.27450 0.16280 -0.03480 0.00070  -0.00130 114 THR A C   
1560 O  O   . THR A 110 ? 0.23260 0.29820 0.15700 -0.03640 -0.01050 0.00580  114 THR A O   
1561 C  CB  . THR A 110 ? 0.16180 0.28320 0.20130 -0.02480 -0.02290 0.02600  114 THR A CB  
1562 O  OG1 . THR A 110 ? 0.16040 0.28830 0.20620 -0.02090 -0.03280 0.02920  114 THR A OG1 
1563 C  CG2 . THR A 110 ? 0.19190 0.29340 0.21460 -0.02180 -0.03330 0.04640  114 THR A CG2 
1571 N  N   . THR A 111 ? 0.17530 0.26950 0.15880 -0.02590 -0.00420 0.01140  115 THR A N   
1572 C  CA  . THR A 111 ? 0.17810 0.25080 0.16560 -0.01720 -0.00090 -0.00230 115 THR A CA  
1573 C  C   . THR A 111 ? 0.17810 0.24500 0.16930 -0.03070 0.02100  -0.01920 115 THR A C   
1574 O  O   . THR A 111 ? 0.19410 0.24650 0.18330 -0.02670 0.01500  -0.02070 115 THR A O   
1575 C  CB  . THR A 111 ? 0.17750 0.24750 0.16680 -0.02600 -0.00240 0.00090  115 THR A CB  
1576 O  OG1 . THR A 111 ? 0.18540 0.25430 0.15460 -0.01780 -0.00960 -0.01520 115 THR A OG1 
1577 C  CG2 . THR A 111 ? 0.17400 0.24330 0.18160 -0.03370 -0.00830 0.00500  115 THR A CG2 
1585 N  N   . GLY A 112 ? 0.17320 0.25000 0.16070 -0.02250 0.00240  -0.00800 116 GLY A N   
1586 C  CA  . GLY A 112 ? 0.16360 0.25040 0.17960 -0.02000 -0.00040 0.00600  116 GLY A CA  
1587 C  C   . GLY A 112 ? 0.16280 0.25940 0.16440 -0.03020 -0.00660 -0.01400 116 GLY A C   
1588 O  O   . GLY A 112 ? 0.17870 0.25780 0.14830 -0.03550 -0.00020 -0.01480 116 GLY A O   
1592 N  N   A MET A 113 ? 0.17360 0.26780 0.16710 -0.02910 0.00670  -0.01820 117 MET A N   
1593 N  N   B MET A 113 ? 0.15000 0.26860 0.15980 -0.02820 0.00440  -0.01590 117 MET A N   
1594 C  CA  A MET A 113 ? 0.18530 0.26880 0.16760 -0.02510 0.00450  -0.02490 117 MET A CA  
1595 C  CA  B MET A 113 ? 0.14450 0.26550 0.15040 -0.02040 -0.01320 -0.02230 117 MET A CA  
1596 C  C   A MET A 113 ? 0.17550 0.26770 0.16400 -0.02570 -0.00100 -0.01400 117 MET A C   
1597 C  C   B MET A 113 ? 0.16080 0.26620 0.14870 -0.02260 -0.00720 -0.01600 117 MET A C   
1598 O  O   A MET A 113 ? 0.18000 0.27310 0.18390 -0.02460 0.00540  -0.01060 117 MET A O   
1599 O  O   B MET A 113 ? 0.17320 0.27630 0.16720 -0.02130 0.00660  -0.02530 117 MET A O   
1600 C  CB  A MET A 113 ? 0.21720 0.26830 0.17830 -0.02000 0.01550  -0.03220 117 MET A CB  
1601 C  CB  B MET A 113 ? 0.15520 0.25930 0.15980 -0.00580 -0.00710 -0.01010 117 MET A CB  
1602 C  CG  A MET A 113 ? 0.23600 0.26590 0.18150 -0.01420 0.02160  -0.04520 117 MET A CG  
1603 C  CG  B MET A 113 ? 0.15090 0.25050 0.15390 0.00820  -0.01910 -0.00660 117 MET A CG  
1604 S  SD  A MET A 113 ? 0.26210 0.26480 0.20030 -0.00490 0.02910  -0.04630 117 MET A SD  
1605 S  SD  B MET A 113 ? 0.18450 0.24960 0.17150 -0.00320 -0.01440 -0.00710 117 MET A SD  
1606 C  CE  A MET A 113 ? 0.28940 0.27140 0.24240 -0.00400 0.04150  -0.04020 117 MET A CE  
1607 C  CE  B MET A 113 ? 0.20090 0.24780 0.18610 0.00350  -0.07300 -0.00350 117 MET A CE  
1626 N  N   . THR A 114 ? 0.16340 0.26960 0.16100 -0.02660 -0.01080 -0.01290 118 THR A N   
1627 C  CA  . THR A 114 ? 0.16680 0.26380 0.16120 -0.04560 -0.01860 -0.03020 118 THR A CA  
1628 C  C   . THR A 114 ? 0.16920 0.26070 0.15900 -0.02750 -0.01940 -0.02690 118 THR A C   
1629 O  O   . THR A 114 ? 0.17150 0.25620 0.15690 -0.02630 -0.01100 -0.03690 118 THR A O   
1630 C  CB  . THR A 114 ? 0.21490 0.28160 0.18150 -0.06290 -0.03120 -0.02070 118 THR A CB  
1631 O  OG1 . THR A 114 ? 0.20450 0.30120 0.18450 -0.06370 -0.03550 0.00080  118 THR A OG1 
1632 C  CG2 . THR A 114 ? 0.24150 0.28550 0.18640 -0.06730 -0.03140 -0.02190 118 THR A CG2 
1641 N  N   . VAL A 115 ? 0.17040 0.25270 0.17720 -0.02170 -0.03390 -0.01400 119 VAL A N   
1642 C  CA  . VAL A 115 ? 0.18600 0.24820 0.18620 -0.02340 -0.03460 -0.00990 119 VAL A CA  
1643 C  C   . VAL A 115 ? 0.16250 0.24720 0.19250 -0.03130 -0.03360 -0.00150 119 VAL A C   
1644 O  O   . VAL A 115 ? 0.17340 0.25880 0.18930 -0.02480 -0.03400 -0.01620 119 VAL A O   
1645 C  CB  . VAL A 115 ? 0.20220 0.24270 0.20200 -0.01860 -0.03670 -0.01600 119 VAL A CB  
1646 C  CG1 . VAL A 115 ? 0.20730 0.23880 0.20600 -0.00730 -0.04730 -0.01090 119 VAL A CG1 
1647 C  CG2 . VAL A 115 ? 0.20520 0.24080 0.22260 -0.00930 -0.02670 -0.03420 119 VAL A CG2 
1657 N  N   . ALA A 116 ? 0.18080 0.26220 0.19190 -0.04390 -0.03170 -0.00570 120 ALA A N   
1658 C  CA  . ALA A 116 ? 0.18960 0.26980 0.17720 -0.04300 -0.02370 0.01090  120 ALA A CA  
1659 C  C   . ALA A 116 ? 0.17600 0.28140 0.17280 -0.04140 -0.02550 0.01350  120 ALA A C   
1660 O  O   . ALA A 116 ? 0.19440 0.29190 0.16250 -0.03220 -0.03250 0.01070  120 ALA A O   
1661 C  CB  . ALA A 116 ? 0.21680 0.26370 0.19400 -0.04470 -0.01910 0.00810  120 ALA A CB  
1667 N  N   . GLU A 117 ? 0.16380 0.28630 0.18210 -0.04800 -0.03760 0.00540  121 GLU A N   
1668 C  CA  . GLU A 117 ? 0.14500 0.30350 0.16950 -0.03320 -0.03390 0.00250  121 GLU A CA  
1669 C  C   . GLU A 117 ? 0.13580 0.28860 0.14970 -0.02230 -0.02410 -0.00560 121 GLU A C   
1670 O  O   . GLU A 117 ? 0.15850 0.28590 0.14850 -0.00700 -0.02200 -0.00540 121 GLU A O   
1671 C  CB  . GLU A 117 ? 0.14810 0.32060 0.16420 -0.04110 -0.03210 0.01850  121 GLU A CB  
1672 C  CG  . GLU A 117 ? 0.15660 0.33930 0.14790 -0.04510 -0.02630 0.02570  121 GLU A CG  
1673 C  CD  . GLU A 117 ? 0.16040 0.36310 0.16350 -0.05240 -0.01240 0.01950  121 GLU A CD  
1674 O  OE1 . GLU A 117 ? 0.15780 0.35710 0.16630 -0.04280 -0.01320 -0.00240 121 GLU A OE1 
1675 O  OE2 . GLU A 117 ? 0.15350 0.40980 0.17710 -0.03870 -0.01830 0.01790  121 GLU A OE2 
1682 N  N   . LEU A 118 ? 0.13530 0.26820 0.15890 -0.02630 -0.02790 -0.01030 122 LEU A N   
1683 C  CA  . LEU A 118 ? 0.15620 0.25440 0.15010 -0.02950 -0.01390 -0.01140 122 LEU A CA  
1684 C  C   . LEU A 118 ? 0.15930 0.24930 0.14650 -0.02250 -0.01860 -0.00420 122 LEU A C   
1685 O  O   . LEU A 118 ? 0.16500 0.25530 0.14110 -0.01670 -0.01390 -0.00350 122 LEU A O   
1686 C  CB  . LEU A 118 ? 0.16270 0.26590 0.15210 -0.04000 -0.01030 -0.00980 122 LEU A CB  
1687 C  CG  . LEU A 118 ? 0.19160 0.27660 0.16540 -0.04360 -0.02120 -0.00690 122 LEU A CG  
1688 C  CD1 . LEU A 118 ? 0.23170 0.28610 0.17830 -0.04260 0.01290  -0.01110 122 LEU A CD1 
1689 C  CD2 . LEU A 118 ? 0.23440 0.28190 0.17440 -0.04940 -0.03510 -0.01450 122 LEU A CD2 
1701 N  N   . SER A 119 ? 0.16410 0.24580 0.16380 -0.02170 -0.03400 -0.00140 123 SER A N   
1702 C  CA  . SER A 119 ? 0.17980 0.24350 0.15270 -0.02150 -0.02600 -0.00670 123 SER A CA  
1703 C  C   . SER A 119 ? 0.18080 0.25580 0.13910 -0.01920 -0.02590 -0.01690 123 SER A C   
1704 O  O   . SER A 119 ? 0.16620 0.26630 0.14400 -0.01590 -0.02780 -0.01550 123 SER A O   
1705 C  CB  . SER A 119 ? 0.18500 0.24420 0.15760 -0.02630 -0.03020 -0.00800 123 SER A CB  
1706 O  OG  . SER A 119 ? 0.18420 0.25210 0.17820 -0.01900 -0.03320 -0.01520 123 SER A OG  
1712 N  N   . ALA A 120 ? 0.17540 0.27170 0.14590 -0.02070 -0.01930 -0.01060 124 ALA A N   
1713 C  CA  . ALA A 120 ? 0.16050 0.29300 0.17310 -0.01930 -0.01450 0.00300  124 ALA A CA  
1714 C  C   . ALA A 120 ? 0.14860 0.29250 0.16010 -0.02620 -0.00850 -0.00100 124 ALA A C   
1715 O  O   . ALA A 120 ? 0.17380 0.30600 0.15600 -0.03010 -0.00780 -0.01050 124 ALA A O   
1716 C  CB  . ALA A 120 ? 0.15720 0.30180 0.20010 -0.02410 -0.01610 0.01210  124 ALA A CB  
1722 N  N   . ALA A 121 ? 0.14300 0.28790 0.15040 -0.01540 -0.01240 -0.00650 125 ALA A N   
1723 C  CA  . ALA A 121 ? 0.14920 0.28470 0.14900 -0.01790 -0.00780 -0.02230 125 ALA A CA  
1724 C  C   . ALA A 121 ? 0.16100 0.27710 0.13510 -0.01810 0.00270  -0.01950 125 ALA A C   
1725 O  O   . ALA A 121 ? 0.15130 0.29230 0.14320 -0.02150 -0.00690 -0.02840 125 ALA A O   
1726 C  CB  . ALA A 121 ? 0.15630 0.28220 0.15560 -0.00200 -0.03330 -0.01210 125 ALA A CB  
1732 N  N   . ALA A 122 ? 0.16180 0.27100 0.14040 -0.01080 -0.01390 -0.01890 126 ALA A N   
1733 C  CA  . ALA A 122 ? 0.13400 0.26130 0.15090 -0.01290 -0.00810 -0.00410 126 ALA A CA  
1734 C  C   . ALA A 122 ? 0.13540 0.25950 0.14900 -0.02430 -0.00720 -0.00970 126 ALA A C   
1735 O  O   . ALA A 122 ? 0.14900 0.25740 0.16660 -0.02040 -0.01450 -0.00410 126 ALA A O   
1736 C  CB  . ALA A 122 ? 0.15310 0.25350 0.13860 -0.02660 0.00150  -0.02150 126 ALA A CB  
1742 N  N   . VAL A 123 ? 0.13470 0.25520 0.14280 -0.02370 -0.00650 -0.01580 127 VAL A N   
1743 C  CA  . VAL A 123 ? 0.14660 0.25900 0.14450 -0.01380 -0.01100 -0.00960 127 VAL A CA  
1744 C  C   . VAL A 123 ? 0.13260 0.28080 0.15240 -0.00580 -0.00520 -0.00590 127 VAL A C   
1745 O  O   . VAL A 123 ? 0.14910 0.28540 0.16360 0.00710  -0.00480 -0.01670 127 VAL A O   
1746 C  CB  . VAL A 123 ? 0.15190 0.24720 0.14220 -0.01300 -0.00170 0.00370  127 VAL A CB  
1747 C  CG1 . VAL A 123 ? 0.16780 0.24490 0.16210 -0.01370 -0.01020 0.02080  127 VAL A CG1 
1748 C  CG2 . VAL A 123 ? 0.16510 0.24910 0.15590 -0.01000 -0.01770 0.00130  127 VAL A CG2 
1758 N  N   . GLN A 124 ? 0.12420 0.29630 0.15820 0.00080  -0.00740 -0.01110 128 GLN A N   
1759 C  CA  . GLN A 124 ? 0.13770 0.30460 0.16380 -0.00620 -0.00530 -0.01810 128 GLN A CA  
1760 C  C   . GLN A 124 ? 0.13520 0.30830 0.15830 -0.01230 -0.00280 -0.00930 128 GLN A C   
1761 O  O   . GLN A 124 ? 0.12580 0.31700 0.16300 -0.01190 -0.01790 -0.01410 128 GLN A O   
1762 C  CB  . GLN A 124 ? 0.15730 0.31450 0.18340 -0.00860 -0.01530 -0.01510 128 GLN A CB  
1763 C  CG  . GLN A 124 ? 0.16320 0.32660 0.19640 -0.01730 -0.01820 -0.01270 128 GLN A CG  
1764 C  CD  . GLN A 124 ? 0.18460 0.34240 0.20380 -0.02760 -0.02510 -0.00210 128 GLN A CD  
1765 O  OE1 . GLN A 124 ? 0.21880 0.36510 0.24700 -0.04060 -0.04500 0.00770  128 GLN A OE1 
1766 N  NE2 . GLN A 124 ? 0.17970 0.33220 0.22220 -0.02640 -0.01360 -0.01660 128 GLN A NE2 
1775 N  N   . TYR A 125 ? 0.14680 0.30610 0.15230 -0.01290 -0.00180 0.00140  129 TYR A N   
1776 C  CA  . TYR A 125 ? 0.16110 0.31340 0.16210 -0.00320 -0.00710 -0.00050 129 TYR A CA  
1777 C  C   . TYR A 125 ? 0.16580 0.29090 0.15060 0.00970  -0.01120 -0.00660 129 TYR A C   
1778 O  O   . TYR A 125 ? 0.17770 0.29350 0.18140 0.01900  -0.02340 0.00350  129 TYR A O   
1779 C  CB  . TYR A 125 ? 0.15400 0.34480 0.14890 0.00040  -0.01450 -0.02610 129 TYR A CB  
1780 C  CG  . TYR A 125 ? 0.15490 0.37460 0.15900 -0.00420 -0.01240 -0.01110 129 TYR A CG  
1781 C  CD1 . TYR A 125 ? 0.16440 0.39080 0.17320 -0.01600 -0.03140 -0.00340 129 TYR A CD1 
1782 C  CD2 . TYR A 125 ? 0.15860 0.39210 0.17990 -0.00270 -0.02930 -0.00920 129 TYR A CD2 
1783 C  CE1 . TYR A 125 ? 0.17650 0.41100 0.19200 -0.02510 -0.03350 0.01320  129 TYR A CE1 
1784 C  CE2 . TYR A 125 ? 0.16620 0.41210 0.19270 -0.01170 -0.01310 0.00650  129 TYR A CE2 
1785 C  CZ  . TYR A 125 ? 0.15390 0.42890 0.21190 -0.03060 -0.03680 0.01050  129 TYR A CZ  
1786 O  OH  . TYR A 125 ? 0.17580 0.46530 0.25830 -0.03610 -0.03990 0.01470  129 TYR A OH  
1796 N  N   A SER A 126 ? 0.16020 0.27680 0.14800 0.00240  -0.00520 -0.00740 130 SER A N   
1797 N  N   B SER A 126 ? 0.14290 0.27450 0.15650 0.00950  0.00030  -0.01420 130 SER A N   
1798 C  CA  A SER A 126 ? 0.16960 0.26310 0.14800 -0.00580 -0.01120 -0.00750 130 SER A CA  
1799 C  CA  B SER A 126 ? 0.15550 0.25940 0.16840 0.00330  -0.01690 -0.01730 130 SER A CA  
1800 C  C   A SER A 126 ? 0.16950 0.25090 0.14620 -0.01240 -0.00360 -0.01150 130 SER A C   
1801 C  C   B SER A 126 ? 0.15860 0.24280 0.15360 -0.00450 -0.01570 -0.01180 130 SER A C   
1802 O  O   A SER A 126 ? 0.17150 0.24600 0.14180 -0.01440 -0.00480 -0.00980 130 SER A O   
1803 O  O   B SER A 126 ? 0.15410 0.22870 0.15490 -0.00240 -0.04870 -0.00380 130 SER A O   
1804 C  CB  A SER A 126 ? 0.18040 0.26170 0.14470 -0.00920 -0.01360 0.00090  130 SER A CB  
1805 C  CB  B SER A 126 ? 0.16550 0.26030 0.18290 -0.00190 -0.01580 -0.01940 130 SER A CB  
1806 O  OG  A SER A 126 ? 0.17230 0.25560 0.12960 -0.01710 -0.01430 0.01200  130 SER A OG  
1807 O  OG  B SER A 126 ? 0.13980 0.25140 0.17070 -0.01600 -0.00700 -0.02060 130 SER A OG  
1818 N  N   . ASP A 127 ? 0.16840 0.24560 0.15800 -0.01820 -0.00210 -0.01730 131 ASP A N   
1819 C  CA  . ASP A 127 ? 0.14820 0.24930 0.15240 -0.02140 -0.01080 0.00220  131 ASP A CA  
1820 C  C   . ASP A 127 ? 0.14570 0.24000 0.14570 -0.01160 -0.01420 0.00380  131 ASP A C   
1821 O  O   . ASP A 127 ? 0.15810 0.24150 0.16300 -0.00000 -0.01920 -0.00780 131 ASP A O   
1822 C  CB  . ASP A 127 ? 0.15550 0.26190 0.15230 -0.00990 -0.01550 -0.00360 131 ASP A CB  
1823 C  CG  . ASP A 127 ? 0.16010 0.26910 0.15820 -0.00960 -0.02320 -0.01290 131 ASP A CG  
1824 O  OD1 . ASP A 127 ? 0.16720 0.26450 0.14700 -0.00610 -0.01750 -0.01230 131 ASP A OD1 
1825 O  OD2 . ASP A 127 ? 0.15950 0.28120 0.15880 0.00250  -0.03050 -0.01690 131 ASP A OD2 
1830 N  N   . ASN A 128 ? 0.14840 0.24130 0.15030 -0.00480 -0.00380 -0.00510 132 ASN A N   
1831 C  CA  . ASN A 128 ? 0.14390 0.24460 0.17230 0.00050  -0.00900 -0.01010 132 ASN A CA  
1832 C  C   . ASN A 128 ? 0.15290 0.23820 0.16850 -0.00220 -0.01150 0.00290  132 ASN A C   
1833 O  O   . ASN A 128 ? 0.15730 0.24350 0.17660 -0.00250 -0.00330 -0.01030 132 ASN A O   
1834 C  CB  . ASN A 128 ? 0.15990 0.24770 0.16530 -0.00990 -0.01650 -0.00440 132 ASN A CB  
1835 C  CG  . ASN A 128 ? 0.17160 0.24600 0.15270 -0.01200 -0.01810 -0.00070 132 ASN A CG  
1836 O  OD1 . ASN A 128 ? 0.16690 0.24920 0.17340 -0.00910 -0.01720 0.00050  132 ASN A OD1 
1837 N  ND2 . ASN A 128 ? 0.21820 0.24930 0.16570 -0.01480 -0.03050 -0.00790 132 ASN A ND2 
1844 N  N   . ALA A 129 ? 0.15840 0.23640 0.15970 -0.00520 0.00020  0.00760  133 ALA A N   
1845 C  CA  . ALA A 129 ? 0.16270 0.24240 0.16200 -0.01120 0.00380  -0.00040 133 ALA A CA  
1846 C  C   . ALA A 129 ? 0.15240 0.24360 0.14940 -0.01520 -0.00460 -0.02300 133 ALA A C   
1847 O  O   . ALA A 129 ? 0.16730 0.24710 0.14640 -0.01220 -0.01390 -0.02730 133 ALA A O   
1848 C  CB  . ALA A 129 ? 0.17480 0.24210 0.16150 -0.00010 -0.01110 0.01120  133 ALA A CB  
1854 N  N   . ALA A 130 ? 0.15990 0.23900 0.14900 -0.01120 -0.01880 -0.00470 134 ALA A N   
1855 C  CA  . ALA A 130 ? 0.15420 0.23400 0.15670 -0.00450 -0.00480 -0.01750 134 ALA A CA  
1856 C  C   . ALA A 130 ? 0.15410 0.23690 0.14770 -0.00090 0.00620  -0.01290 134 ALA A C   
1857 O  O   . ALA A 130 ? 0.16580 0.25080 0.15540 -0.00250 -0.01080 -0.02010 134 ALA A O   
1858 C  CB  . ALA A 130 ? 0.14940 0.23000 0.17330 -0.01100 -0.00840 -0.00560 134 ALA A CB  
1864 N  N   . ALA A 131 ? 0.15640 0.24060 0.15650 -0.00720 -0.00600 -0.01710 135 ALA A N   
1865 C  CA  . ALA A 131 ? 0.15630 0.23860 0.15260 -0.00340 -0.01620 -0.02750 135 ALA A CA  
1866 C  C   . ALA A 131 ? 0.15640 0.24080 0.15460 -0.00570 -0.01350 -0.02760 135 ALA A C   
1867 O  O   . ALA A 131 ? 0.16910 0.24010 0.16020 -0.00290 -0.01860 -0.03040 135 ALA A O   
1868 C  CB  . ALA A 131 ? 0.15690 0.24950 0.15020 -0.00850 -0.00970 -0.01260 135 ALA A CB  
1874 N  N   . ASN A 132 ? 0.15220 0.24540 0.14820 0.00890  -0.00120 -0.01350 136 ASN A N   
1875 C  CA  . ASN A 132 ? 0.14720 0.25250 0.16010 -0.00130 -0.00870 -0.02570 136 ASN A CA  
1876 C  C   . ASN A 132 ? 0.15900 0.26450 0.14990 -0.00450 -0.01140 -0.02630 136 ASN A C   
1877 O  O   . ASN A 132 ? 0.17280 0.27730 0.15590 0.01020  -0.00880 -0.03870 136 ASN A O   
1878 C  CB  . ASN A 132 ? 0.14760 0.24980 0.17260 -0.00680 -0.01100 -0.00660 136 ASN A CB  
1879 C  CG  . ASN A 132 ? 0.17460 0.24320 0.18670 -0.01480 -0.02800 0.00660  136 ASN A CG  
1880 O  OD1 . ASN A 132 ? 0.17220 0.24160 0.20180 -0.01490 -0.04670 -0.01050 136 ASN A OD1 
1881 N  ND2 . ASN A 132 ? 0.24750 0.26120 0.19260 -0.01620 -0.02500 0.00470  136 ASN A ND2 
1888 N  N   . LEU A 133 ? 0.16790 0.26240 0.14230 -0.00610 -0.01330 -0.02930 137 LEU A N   
1889 C  CA  . LEU A 133 ? 0.16450 0.26170 0.14900 -0.00010 -0.01110 -0.03950 137 LEU A CA  
1890 C  C   . LEU A 133 ? 0.16620 0.25330 0.16550 0.00850  -0.01150 -0.04580 137 LEU A C   
1891 O  O   . LEU A 133 ? 0.21270 0.26140 0.17110 0.01810  -0.01110 -0.04620 137 LEU A O   
1892 C  CB  . LEU A 133 ? 0.16810 0.27040 0.16780 -0.00640 -0.00960 -0.02880 137 LEU A CB  
1893 C  CG  . LEU A 133 ? 0.18870 0.28480 0.15720 -0.00340 -0.02760 -0.02290 137 LEU A CG  
1894 C  CD1 . LEU A 133 ? 0.18810 0.29700 0.18030 -0.01010 -0.03710 -0.01670 137 LEU A CD1 
1895 C  CD2 . LEU A 133 ? 0.20450 0.29420 0.15730 -0.00190 -0.01620 -0.01330 137 LEU A CD2 
1907 N  N   . LEU A 134 ? 0.15620 0.24640 0.17200 0.01130  -0.01360 -0.04290 138 LEU A N   
1908 C  CA  . LEU A 134 ? 0.16630 0.24140 0.20000 -0.00270 -0.01360 -0.04190 138 LEU A CA  
1909 C  C   . LEU A 134 ? 0.16600 0.24190 0.18720 0.00060  -0.00810 -0.03290 138 LEU A C   
1910 O  O   . LEU A 134 ? 0.16990 0.24740 0.20680 0.00550  -0.01080 -0.02410 138 LEU A O   
1911 C  CB  . LEU A 134 ? 0.16570 0.23500 0.20090 -0.00940 -0.00510 -0.02850 138 LEU A CB  
1912 C  CG  . LEU A 134 ? 0.16870 0.24130 0.19950 -0.01940 -0.02050 -0.01010 138 LEU A CG  
1913 C  CD1 . LEU A 134 ? 0.18580 0.23910 0.20570 -0.00890 -0.02170 0.01230  138 LEU A CD1 
1914 C  CD2 . LEU A 134 ? 0.18190 0.25180 0.21600 -0.02790 -0.05570 -0.00420 138 LEU A CD2 
1926 N  N   . LEU A 135 ? 0.16140 0.23590 0.17640 -0.00380 -0.01630 -0.03520 139 LEU A N   
1927 C  CA  . LEU A 135 ? 0.16710 0.25180 0.18290 -0.00820 -0.03300 -0.03870 139 LEU A CA  
1928 C  C   . LEU A 135 ? 0.16530 0.28100 0.19190 0.00620  -0.01440 -0.03180 139 LEU A C   
1929 O  O   . LEU A 135 ? 0.17340 0.29000 0.21990 0.01970  -0.01230 -0.02140 139 LEU A O   
1930 C  CB  . LEU A 135 ? 0.17830 0.25980 0.20580 -0.00960 -0.02890 -0.02570 139 LEU A CB  
1931 C  CG  . LEU A 135 ? 0.21100 0.26850 0.21600 -0.01120 -0.01530 -0.02650 139 LEU A CG  
1932 C  CD1 . LEU A 135 ? 0.25780 0.26440 0.21060 -0.00750 -0.01000 -0.03200 139 LEU A CD1 
1933 C  CD2 . LEU A 135 ? 0.19890 0.27260 0.18890 -0.03010 -0.05040 -0.00400 139 LEU A CD2 
1945 N  N   . LYS A 136 ? 0.18740 0.30990 0.18960 0.02270  0.01060  -0.03570 140 LYS A N   
1946 C  CA  . LYS A 136 ? 0.24060 0.35080 0.19470 0.04810  0.01550  -0.04370 140 LYS A CA  
1947 C  C   . LYS A 136 ? 0.24910 0.35320 0.21060 0.06210  0.01080  -0.06490 140 LYS A C   
1948 O  O   . LYS A 136 ? 0.26140 0.35250 0.24330 0.08420  0.01620  -0.05320 140 LYS A O   
1949 C  CB  . LYS A 136 ? 0.29440 0.38730 0.21250 0.06190  0.03630  -0.04570 140 LYS A CB  
1950 C  CG  . LYS A 136 ? 0.36910 0.41490 0.26360 0.06590  0.04250  -0.03530 140 LYS A CG  
1951 C  CD  . LYS A 136 ? 0.44010 0.43680 0.30570 0.05230  0.03750  -0.03760 140 LYS A CD  
1952 C  CE  . LYS A 136 ? 0.49160 0.45040 0.37320 0.03460  0.02790  -0.03840 140 LYS A CE  
1953 N  NZ  . LYS A 136 ? 0.52210 0.46120 0.41900 0.02280  0.01890  -0.03600 140 LYS A NZ  
1967 N  N   . GLU A 137 ? 0.24330 0.34660 0.23580 0.04750  -0.03010 -0.09280 141 GLU A N   
1968 C  CA  . GLU A 137 ? 0.28550 0.34920 0.28900 0.05310  -0.02280 -0.09640 141 GLU A CA  
1969 C  C   . GLU A 137 ? 0.27710 0.32730 0.25980 0.03190  -0.02250 -0.08670 141 GLU A C   
1970 O  O   . GLU A 137 ? 0.28390 0.32930 0.27400 0.03960  -0.02100 -0.09090 141 GLU A O   
1971 C  CB  . GLU A 137 ? 0.34080 0.38230 0.35130 0.05330  -0.05180 -0.09660 141 GLU A CB  
1972 C  CG  . GLU A 137 ? 0.42290 0.41790 0.40730 0.05670  -0.06160 -0.08970 141 GLU A CG  
1973 C  CD  . GLU A 137 ? 0.48660 0.44620 0.45490 0.06300  -0.07460 -0.08070 141 GLU A CD  
1974 O  OE1 . GLU A 137 ? 0.50770 0.45220 0.46940 0.05800  -0.07650 -0.07990 141 GLU A OE1 
1975 O  OE2 . GLU A 137 ? 0.51960 0.46560 0.47990 0.06410  -0.06850 -0.07630 141 GLU A OE2 
1982 N  N   . LEU A 138 ? 0.25500 0.30480 0.22970 0.00820  -0.00710 -0.06520 142 LEU A N   
1983 C  CA  . LEU A 138 ? 0.25940 0.30050 0.22780 0.00680  0.02090  -0.04880 142 LEU A CA  
1984 C  C   . LEU A 138 ? 0.24490 0.29340 0.22530 0.00400  0.00070  -0.04910 142 LEU A C   
1985 O  O   . LEU A 138 ? 0.27160 0.30150 0.25250 0.01740  -0.01280 -0.03720 142 LEU A O   
1986 C  CB  . LEU A 138 ? 0.31470 0.30390 0.25140 0.02480  0.02600  -0.03900 142 LEU A CB  
1987 C  CG  . LEU A 138 ? 0.35080 0.31670 0.30360 0.04430  0.03620  -0.03860 142 LEU A CG  
1988 C  CD1 . LEU A 138 ? 0.37910 0.32710 0.31510 0.04710  0.05780  -0.02200 142 LEU A CD1 
1989 C  CD2 . LEU A 138 ? 0.35420 0.31820 0.32690 0.04200  0.03220  -0.04380 142 LEU A CD2 
2001 N  N   . GLY A 139 ? 0.21580 0.27650 0.22110 0.00420  0.02090  -0.05360 143 GLY A N   
2002 C  CA  . GLY A 139 ? 0.19330 0.28180 0.24830 0.01240  0.01820  -0.04550 143 GLY A CA  
2003 C  C   . GLY A 139 ? 0.16450 0.28260 0.26600 0.00950  -0.01180 -0.04160 143 GLY A C   
2004 O  O   . GLY A 139 ? 0.19610 0.29850 0.36200 0.01130  -0.00560 -0.03570 143 GLY A O   
2008 N  N   . GLY A 140 ? 0.16540 0.27080 0.19270 0.01290  -0.00920 -0.03250 144 GLY A N   
2009 C  CA  . GLY A 140 ? 0.16850 0.26240 0.17720 0.01070  -0.00020 -0.02230 144 GLY A CA  
2010 C  C   . GLY A 140 ? 0.17410 0.24950 0.16730 0.01100  0.00190  -0.01670 144 GLY A C   
2011 O  O   . GLY A 140 ? 0.16810 0.24310 0.18360 0.00770  0.00370  -0.02560 144 GLY A O   
2015 N  N   . PRO A 141 ? 0.19310 0.23490 0.15100 0.00650  -0.00740 -0.02210 145 PRO A N   
2016 C  CA  . PRO A 141 ? 0.19130 0.23560 0.15890 0.00580  -0.00420 -0.02470 145 PRO A CA  
2017 C  C   . PRO A 141 ? 0.17390 0.23350 0.16860 0.00240  0.00230  -0.02840 145 PRO A C   
2018 O  O   . PRO A 141 ? 0.17570 0.22940 0.15770 -0.00740 0.01460  -0.01640 145 PRO A O   
2019 C  CB  . PRO A 141 ? 0.22110 0.23370 0.15780 0.01370  0.00420  -0.00530 145 PRO A CB  
2020 C  CG  . PRO A 141 ? 0.22960 0.23670 0.17730 0.01220  -0.00680 -0.01470 145 PRO A CG  
2021 C  CD  . PRO A 141 ? 0.21440 0.23100 0.16680 0.00480  -0.00360 -0.01960 145 PRO A CD  
2029 N  N   . ALA A 142 ? 0.14720 0.23560 0.16460 0.00580  0.01410  -0.01770 146 ALA A N   
2030 C  CA  . ALA A 142 ? 0.15580 0.23270 0.17160 0.00270  0.00270  -0.02340 146 ALA A CA  
2031 C  C   . ALA A 142 ? 0.15440 0.23090 0.16680 0.00520  0.00730  -0.02380 146 ALA A C   
2032 O  O   . ALA A 142 ? 0.17510 0.21880 0.16740 0.00690  0.00670  -0.01280 146 ALA A O   
2033 C  CB  . ALA A 142 ? 0.16780 0.22750 0.19000 0.00810  0.01410  -0.01530 146 ALA A CB  
2039 N  N   . GLY A 143 ? 0.16180 0.23620 0.15660 0.01130  0.00170  -0.02940 147 GLY A N   
2040 C  CA  . GLY A 143 ? 0.17860 0.23860 0.18260 0.00770  0.00220  -0.03580 147 GLY A CA  
2041 C  C   . GLY A 143 ? 0.16660 0.22220 0.17430 0.00430  -0.00100 -0.03380 147 GLY A C   
2042 O  O   . GLY A 143 ? 0.17930 0.21680 0.19430 0.00020  -0.00410 -0.03900 147 GLY A O   
2046 N  N   . LEU A 144 ? 0.15050 0.21960 0.16110 0.00760  -0.00490 -0.01620 148 LEU A N   
2047 C  CA  . LEU A 144 ? 0.15940 0.20950 0.17570 -0.00530 0.00590  -0.01090 148 LEU A CA  
2048 C  C   . LEU A 144 ? 0.15880 0.20060 0.16640 0.00350  0.00530  -0.01520 148 LEU A C   
2049 O  O   . LEU A 144 ? 0.15690 0.20660 0.16240 0.00860  -0.00020 -0.01520 148 LEU A O   
2050 C  CB  . LEU A 144 ? 0.14270 0.21330 0.17580 -0.00370 -0.00290 -0.01480 148 LEU A CB  
2051 C  CG  . LEU A 144 ? 0.14170 0.20550 0.19410 -0.00670 0.00490  -0.02020 148 LEU A CG  
2052 C  CD1 . LEU A 144 ? 0.16060 0.20900 0.20970 -0.00940 0.03100  -0.00830 148 LEU A CD1 
2053 C  CD2 . LEU A 144 ? 0.16100 0.19990 0.18720 -0.00600 0.01080  -0.03150 148 LEU A CD2 
2065 N  N   . THR A 145 ? 0.14980 0.19190 0.16220 0.00510  0.00430  -0.01850 149 THR A N   
2066 C  CA  . THR A 145 ? 0.14700 0.18260 0.15150 0.00350  0.00750  -0.02050 149 THR A CA  
2067 C  C   . THR A 145 ? 0.13870 0.18500 0.16990 -0.00130 0.01230  -0.01720 149 THR A C   
2068 O  O   . THR A 145 ? 0.15950 0.19340 0.17370 0.00420  0.01450  0.00060  149 THR A O   
2069 C  CB  . THR A 145 ? 0.15210 0.18510 0.16140 0.00270  0.00390  -0.02070 149 THR A CB  
2070 O  OG1 . THR A 145 ? 0.16300 0.18400 0.15090 0.00530  0.00860  -0.02080 149 THR A OG1 
2071 C  CG2 . THR A 145 ? 0.14020 0.20070 0.17090 -0.01010 0.00630  -0.02070 149 THR A CG2 
2079 N  N   . ALA A 146 ? 0.16330 0.18340 0.17130 0.00070  0.00960  -0.02990 150 ALA A N   
2080 C  CA  . ALA A 146 ? 0.17820 0.19180 0.20180 0.01480  0.02150  -0.02840 150 ALA A CA  
2081 C  C   . ALA A 146 ? 0.16650 0.18400 0.19170 0.02030  0.01110  -0.02040 150 ALA A C   
2082 O  O   . ALA A 146 ? 0.17840 0.18180 0.19850 0.01500  -0.00170 -0.01760 150 ALA A O   
2083 C  CB  . ALA A 146 ? 0.19090 0.19790 0.21980 0.01920  0.02840  -0.04350 150 ALA A CB  
2089 N  N   . PHE A 147 ? 0.16130 0.18940 0.20090 0.00340  0.01570  -0.02870 151 PHE A N   
2090 C  CA  . PHE A 147 ? 0.17490 0.19650 0.19790 0.00010  0.00970  -0.02650 151 PHE A CA  
2091 C  C   . PHE A 147 ? 0.15920 0.18990 0.21250 -0.00330 0.00980  -0.01880 151 PHE A C   
2092 O  O   . PHE A 147 ? 0.16450 0.18580 0.21900 -0.01100 0.01530  -0.01050 151 PHE A O   
2093 C  CB  . PHE A 147 ? 0.18610 0.20890 0.19640 -0.00960 0.00870  -0.03290 151 PHE A CB  
2094 C  CG  . PHE A 147 ? 0.17690 0.20780 0.19630 -0.02140 -0.00370 -0.03030 151 PHE A CG  
2095 C  CD1 . PHE A 147 ? 0.17760 0.21390 0.22280 -0.03690 0.00830  -0.02870 151 PHE A CD1 
2096 C  CD2 . PHE A 147 ? 0.16870 0.22220 0.20000 -0.02700 -0.01030 -0.02620 151 PHE A CD2 
2097 C  CE1 . PHE A 147 ? 0.19240 0.22370 0.23410 -0.03800 0.00580  -0.03000 151 PHE A CE1 
2098 C  CE2 . PHE A 147 ? 0.17360 0.22700 0.22580 -0.02420 0.01180  -0.01820 151 PHE A CE2 
2099 C  CZ  . PHE A 147 ? 0.18350 0.23130 0.23280 -0.02930 0.01140  -0.02200 151 PHE A CZ  
2109 N  N   . MET A 148 ? 0.14950 0.18650 0.19030 0.00160  -0.00160 -0.02560 152 MET A N   
2110 C  CA  . MET A 148 ? 0.14960 0.17290 0.18190 -0.00420 0.00210  -0.00990 152 MET A CA  
2111 C  C   . MET A 148 ? 0.14190 0.17180 0.19780 0.00010  0.00870  -0.01260 152 MET A C   
2112 O  O   . MET A 148 ? 0.15350 0.17410 0.19520 0.00060  0.01600  -0.00650 152 MET A O   
2113 C  CB  . MET A 148 ? 0.14120 0.17460 0.17450 0.00400  0.00840  0.00070  152 MET A CB  
2114 C  CG  . MET A 148 ? 0.15630 0.18510 0.17660 0.00360  0.00540  0.00770  152 MET A CG  
2115 S  SD  . MET A 148 ? 0.14780 0.19220 0.19510 -0.00540 -0.00190 -0.00040 152 MET A SD  
2116 C  CE  . MET A 148 ? 0.15790 0.22360 0.17740 -0.02480 0.00850  -0.00960 152 MET A CE  
2126 N  N   . ARG A 149 ? 0.14990 0.17810 0.19790 0.00750  0.00780  -0.00300 153 ARG A N   
2127 C  CA  . ARG A 149 ? 0.14150 0.18890 0.19730 0.01060  0.01590  0.00430  153 ARG A CA  
2128 C  C   . ARG A 149 ? 0.15400 0.18880 0.22670 0.00650  0.01730  0.01180  153 ARG A C   
2129 O  O   . ARG A 149 ? 0.18050 0.19350 0.23420 0.00770  0.01410  0.01150  153 ARG A O   
2130 C  CB  . ARG A 149 ? 0.15790 0.20390 0.18790 0.01020  -0.00050 -0.00390 153 ARG A CB  
2131 C  CG  . ARG A 149 ? 0.14630 0.20560 0.19350 0.00710  0.02150  -0.00720 153 ARG A CG  
2132 C  CD  . ARG A 149 ? 0.16470 0.19000 0.18110 0.01280  0.01340  0.00170  153 ARG A CD  
2133 N  NE  . ARG A 149 ? 0.13680 0.18710 0.17640 0.01690  0.01640  -0.00420 153 ARG A NE  
2134 C  CZ  . ARG A 149 ? 0.13710 0.18250 0.16340 0.00270  0.00850  -0.00670 153 ARG A CZ  
2135 N  NH1 . ARG A 149 ? 0.14790 0.17030 0.19210 0.01120  0.02280  0.00770  153 ARG A NH1 
2136 N  NH2 . ARG A 149 ? 0.14090 0.19220 0.17240 -0.00830 0.01670  0.01230  153 ARG A NH2 
2150 N  N   . SER A 150 ? 0.16720 0.18620 0.23210 -0.00110 0.01930  0.00340  154 SER A N   
2151 C  CA  . SER A 150 ? 0.18980 0.18700 0.25500 0.00320  0.01420  -0.00650 154 SER A CA  
2152 C  C   . SER A 150 ? 0.20110 0.17410 0.25830 0.00880  0.02840  -0.00390 154 SER A C   
2153 O  O   . SER A 150 ? 0.24000 0.18340 0.28880 0.01280  0.04250  -0.01010 154 SER A O   
2154 C  CB  . SER A 150 ? 0.21210 0.19480 0.26920 0.00020  0.01880  -0.01860 154 SER A CB  
2155 O  OG  . SER A 150 ? 0.20800 0.20850 0.25070 -0.00200 0.00220  -0.02760 154 SER A OG  
2161 N  N   . ILE A 151 ? 0.19550 0.18200 0.24460 -0.00020 0.03930  -0.00660 155 ILE A N   
2162 C  CA  . ILE A 151 ? 0.18840 0.17810 0.24870 -0.00190 0.03550  0.00950  155 ILE A CA  
2163 C  C   . ILE A 151 ? 0.18940 0.18450 0.22840 0.00030  0.03610  0.01310  155 ILE A C   
2164 O  O   . ILE A 151 ? 0.20200 0.21430 0.24890 0.00240  0.03320  0.01240  155 ILE A O   
2165 C  CB  . ILE A 151 ? 0.19120 0.18400 0.26740 -0.00570 0.01370  -0.00050 155 ILE A CB  
2166 C  CG1 . ILE A 151 ? 0.17890 0.18090 0.24790 -0.00150 0.02570  0.00540  155 ILE A CG1 
2167 C  CG2 . ILE A 151 ? 0.20600 0.18910 0.29020 -0.01550 0.00170  0.00410  155 ILE A CG2 
2168 C  CD1 . ILE A 151 ? 0.17560 0.17680 0.25340 -0.01090 0.02020  -0.02120 155 ILE A CD1 
2180 N  N   . GLY A 152 ? 0.19930 0.16850 0.21800 0.00130  0.02800  0.00650  156 GLY A N   
2181 C  CA  . GLY A 152 ? 0.20130 0.16520 0.22680 0.00160  0.02590  0.02060  156 GLY A CA  
2182 C  C   . GLY A 152 ? 0.18400 0.15890 0.21130 0.00950  0.02820  0.02270  156 GLY A C   
2183 O  O   . GLY A 152 ? 0.24740 0.19440 0.22600 0.01330  0.00700  0.01670  156 GLY A O   
2187 N  N   . ASP A 153 ? 0.16100 0.14910 0.19380 0.00150  0.02020  0.02590  157 ASP A N   
2188 C  CA  . ASP A 153 ? 0.14850 0.15800 0.18250 0.00930  0.02560  0.01800  157 ASP A CA  
2189 C  C   . ASP A 153 ? 0.14900 0.17520 0.17880 -0.00090 0.02280  0.00340  157 ASP A C   
2190 O  O   . ASP A 153 ? 0.15740 0.18870 0.17440 0.00000  0.02260  0.01970  157 ASP A O   
2191 C  CB  . ASP A 153 ? 0.16070 0.17900 0.17580 -0.00110 0.01300  0.01700  157 ASP A CB  
2192 C  CG  . ASP A 153 ? 0.13200 0.18130 0.16360 0.00360  0.00780  0.01350  157 ASP A CG  
2193 O  OD1 . ASP A 153 ? 0.14420 0.18160 0.16690 -0.00680 0.01350  0.00750  157 ASP A OD1 
2194 O  OD2 . ASP A 153 ? 0.13620 0.17650 0.18550 -0.00570 0.01670  -0.00010 157 ASP A OD2 
2199 N  N   . THR A 154 ? 0.15140 0.18920 0.18870 -0.00480 0.01120  0.00910  158 THR A N   
2200 C  CA  . THR A 154 ? 0.14780 0.20260 0.17870 -0.00110 -0.00310 0.01310  158 THR A CA  
2201 C  C   . THR A 154 ? 0.15210 0.19400 0.16360 0.00560  0.02320  0.01280  158 THR A C   
2202 O  O   . THR A 154 ? 0.15140 0.19660 0.19850 0.00760  0.03390  0.01040  158 THR A O   
2203 C  CB  . THR A 154 ? 0.17590 0.22400 0.22250 0.01600  0.00620  0.03860  158 THR A CB  
2204 O  OG1 . THR A 154 ? 0.20410 0.24930 0.22750 0.02510  -0.00710 0.04960  158 THR A OG1 
2205 C  CG2 . THR A 154 ? 0.19840 0.22890 0.26160 0.02260  0.01420  0.03910  158 THR A CG2 
2213 N  N   . THR A 155 ? 0.13950 0.19130 0.16360 0.00300  0.01880  0.00030  159 THR A N   
2214 C  CA  . THR A 155 ? 0.12830 0.18640 0.16340 0.00570  0.01620  0.00650  159 THR A CA  
2215 C  C   . THR A 155 ? 0.11850 0.16990 0.15910 0.00060  0.01820  0.00520  159 THR A C   
2216 O  O   . THR A 155 ? 0.13690 0.18560 0.14830 0.00050  0.01400  -0.00800 159 THR A O   
2217 C  CB  . THR A 155 ? 0.14420 0.19970 0.14980 0.00610  0.00600  0.01880  159 THR A CB  
2218 O  OG1 . THR A 155 ? 0.17770 0.21910 0.15890 0.02570  0.01040  0.02360  159 THR A OG1 
2219 C  CG2 . THR A 155 ? 0.15720 0.20390 0.13570 0.01930  0.00490  0.01160  159 THR A CG2 
2227 N  N   . PHE A 156 ? 0.13200 0.15970 0.17100 -0.00590 0.01810  0.01350  160 PHE A N   
2228 C  CA  . PHE A 156 ? 0.13830 0.16270 0.14790 0.00420  0.00650  0.01220  160 PHE A CA  
2229 C  C   . PHE A 156 ? 0.14220 0.16200 0.15000 0.00210  0.00740  -0.00060 160 PHE A C   
2230 O  O   . PHE A 156 ? 0.14290 0.17030 0.15520 0.00830  0.01210  -0.00710 160 PHE A O   
2231 C  CB  . PHE A 156 ? 0.14970 0.17340 0.14910 -0.00150 0.00380  -0.01260 160 PHE A CB  
2232 C  CG  . PHE A 156 ? 0.13870 0.17570 0.15520 -0.00910 0.00330  -0.01190 160 PHE A CG  
2233 C  CD1 . PHE A 156 ? 0.15200 0.18200 0.15250 -0.01740 0.00420  -0.00260 160 PHE A CD1 
2234 C  CD2 . PHE A 156 ? 0.15100 0.17800 0.15330 -0.00950 0.01050  -0.01000 160 PHE A CD2 
2235 C  CE1 . PHE A 156 ? 0.14860 0.19490 0.15690 -0.02120 0.00920  -0.00130 160 PHE A CE1 
2236 C  CE2 . PHE A 156 ? 0.14730 0.19100 0.16810 -0.01040 -0.00710 0.00490  160 PHE A CE2 
2237 C  CZ  . PHE A 156 ? 0.14870 0.18980 0.16130 -0.02220 -0.00550 -0.00090 160 PHE A CZ  
2247 N  N   . ARG A 157 ? 0.13960 0.16970 0.14270 -0.00760 0.01440  0.00180  161 ARG A N   
2248 C  CA  . ARG A 157 ? 0.13680 0.17580 0.14400 0.00850  0.01420  0.00950  161 ARG A CA  
2249 C  C   . ARG A 157 ? 0.14330 0.17500 0.14440 0.00340  0.01090  -0.00200 161 ARG A C   
2250 O  O   . ARG A 157 ? 0.16170 0.18440 0.13620 0.01570  0.01120  -0.00170 161 ARG A O   
2251 C  CB  . ARG A 157 ? 0.14200 0.18760 0.16600 0.00110  0.00790  0.01580  161 ARG A CB  
2252 C  CG  . ARG A 157 ? 0.15120 0.19610 0.14000 -0.00440 0.00850  -0.00690 161 ARG A CG  
2253 C  CD  . ARG A 157 ? 0.15040 0.20360 0.15940 -0.00020 -0.00940 -0.00160 161 ARG A CD  
2254 N  NE  . ARG A 157 ? 0.13980 0.20740 0.16200 0.00090  -0.00150 -0.01050 161 ARG A NE  
2255 C  CZ  . ARG A 157 ? 0.14940 0.22990 0.16640 0.00820  0.00900  -0.00180 161 ARG A CZ  
2256 N  NH1 . ARG A 157 ? 0.14150 0.24550 0.16910 -0.00800 -0.01640 -0.00830 161 ARG A NH1 
2257 N  NH2 . ARG A 157 ? 0.14960 0.24350 0.18430 0.00430  0.00760  0.00940  161 ARG A NH2 
2271 N  N   . LEU A 158 ? 0.15310 0.18240 0.14940 -0.01570 0.00150  -0.00790 162 LEU A N   
2272 C  CA  . LEU A 158 ? 0.14550 0.17520 0.14210 -0.00810 0.00670  -0.00030 162 LEU A CA  
2273 C  C   . LEU A 158 ? 0.13780 0.17630 0.13670 0.00610  -0.00980 -0.00040 162 LEU A C   
2274 O  O   . LEU A 158 ? 0.15980 0.18970 0.15670 0.00920  0.01170  -0.00010 162 LEU A O   
2275 C  CB  . LEU A 158 ? 0.14870 0.16580 0.15820 -0.01570 0.01030  -0.00780 162 LEU A CB  
2276 C  CG  . LEU A 158 ? 0.14390 0.18080 0.16690 -0.01290 -0.00190 -0.00970 162 LEU A CG  
2277 C  CD1 . LEU A 158 ? 0.14690 0.17860 0.18340 -0.00110 -0.00340 0.00280  162 LEU A CD1 
2278 C  CD2 . LEU A 158 ? 0.15790 0.19890 0.19510 -0.01700 0.00440  -0.00570 162 LEU A CD2 
2290 N  N   . ASP A 159 ? 0.12160 0.17580 0.15320 0.00320  0.00110  -0.00510 163 ASP A N   
2291 C  CA  . ASP A 159 ? 0.11930 0.19380 0.14960 -0.01210 0.00180  -0.00120 163 ASP A CA  
2292 C  C   . ASP A 159 ? 0.13330 0.21610 0.14810 -0.00100 -0.00320 -0.00800 163 ASP A C   
2293 O  O   . ASP A 159 ? 0.15780 0.23570 0.15160 0.01080  0.02560  -0.01150 163 ASP A O   
2294 C  CB  . ASP A 159 ? 0.11400 0.20300 0.15210 -0.00900 0.02530  -0.00460 163 ASP A CB  
2295 C  CG  . ASP A 159 ? 0.11670 0.20990 0.14430 -0.00430 0.02000  -0.02260 163 ASP A CG  
2296 O  OD1 . ASP A 159 ? 0.12920 0.20080 0.13650 -0.00450 0.00740  -0.00760 163 ASP A OD1 
2297 O  OD2 . ASP A 159 ? 0.13770 0.25630 0.14700 0.01530  0.01090  -0.00740 163 ASP A OD2 
2302 N  N   . ARG A 160 ? 0.14270 0.21700 0.13680 -0.00090 -0.00280 -0.00700 164 ARG A N   
2303 C  CA  . ARG A 160 ? 0.14450 0.22330 0.14030 -0.00360 -0.00150 -0.00380 164 ARG A CA  
2304 C  C   . ARG A 160 ? 0.14050 0.22780 0.14040 -0.00600 -0.00910 -0.00130 164 ARG A C   
2305 O  O   . ARG A 160 ? 0.14680 0.23300 0.15680 -0.00170 -0.00650 0.00180  164 ARG A O   
2306 C  CB  . ARG A 160 ? 0.14800 0.22600 0.13640 -0.01580 0.00720  -0.01060 164 ARG A CB  
2307 C  CG  . ARG A 160 ? 0.14870 0.21950 0.14850 -0.01460 0.01130  -0.00280 164 ARG A CG  
2308 C  CD  . ARG A 160 ? 0.16270 0.21590 0.15540 -0.01410 0.00890  0.01060  164 ARG A CD  
2309 N  NE  . ARG A 160 ? 0.15180 0.21620 0.13440 -0.00800 0.01840  0.00940  164 ARG A NE  
2310 C  CZ  . ARG A 160 ? 0.15100 0.20020 0.15260 -0.01210 0.00970  0.00180  164 ARG A CZ  
2311 N  NH1 . ARG A 160 ? 0.15660 0.20170 0.16410 -0.01730 0.02390  -0.00230 164 ARG A NH1 
2312 N  NH2 . ARG A 160 ? 0.16280 0.18840 0.15160 -0.01110 0.01280  -0.00830 164 ARG A NH2 
2326 N  N   . TRP A 161 ? 0.16080 0.22670 0.15440 0.00540  -0.02580 0.00190  165 TRP A N   
2327 C  CA  . TRP A 161 ? 0.17310 0.23900 0.15220 0.00080  -0.02580 0.00280  165 TRP A CA  
2328 C  C   . TRP A 161 ? 0.16840 0.23540 0.16150 -0.00420 -0.02110 -0.00090 165 TRP A C   
2329 O  O   . TRP A 161 ? 0.17160 0.23500 0.16210 -0.00200 -0.01220 -0.00510 165 TRP A O   
2330 C  CB  . TRP A 161 ? 0.17160 0.26040 0.16020 0.00650  -0.03350 -0.00940 165 TRP A CB  
2331 C  CG  . TRP A 161 ? 0.18480 0.27460 0.17350 0.01330  -0.01330 -0.01500 165 TRP A CG  
2332 C  CD1 . TRP A 161 ? 0.18790 0.28040 0.18820 0.01550  -0.02320 -0.03390 165 TRP A CD1 
2333 C  CD2 . TRP A 161 ? 0.18680 0.27440 0.15380 0.01300  0.00640  -0.00930 165 TRP A CD2 
2334 N  NE1 . TRP A 161 ? 0.20320 0.28970 0.19880 0.01760  -0.01070 -0.02840 165 TRP A NE1 
2335 C  CE2 . TRP A 161 ? 0.19110 0.27750 0.17140 0.01170  -0.00280 -0.01460 165 TRP A CE2 
2336 C  CE3 . TRP A 161 ? 0.19630 0.28100 0.15850 0.01100  0.00200  -0.01140 165 TRP A CE3 
2337 C  CZ2 . TRP A 161 ? 0.20590 0.27790 0.18630 0.01860  0.00940  -0.01000 165 TRP A CZ2 
2338 C  CZ3 . TRP A 161 ? 0.20600 0.28080 0.19130 0.00320  0.00340  -0.00240 165 TRP A CZ3 
2339 C  CH2 . TRP A 161 ? 0.21540 0.28020 0.19590 0.00810  0.02060  -0.00880 165 TRP A CH2 
2350 N  N   . GLU A 162 ? 0.16540 0.23400 0.18340 -0.00880 -0.03070 -0.00780 166 GLU A N   
2351 C  CA  . GLU A 162 ? 0.16410 0.23300 0.18870 0.00040  -0.02810 -0.01870 166 GLU A CA  
2352 C  C   . GLU A 162 ? 0.19600 0.23510 0.18760 0.00790  -0.02980 -0.01050 166 GLU A C   
2353 O  O   . GLU A 162 ? 0.24570 0.24570 0.19060 0.01070  -0.02650 -0.02510 166 GLU A O   
2354 C  CB  . GLU A 162 ? 0.17830 0.24190 0.21830 0.00120  -0.03640 -0.01660 166 GLU A CB  
2355 C  CG  . GLU A 162 ? 0.17570 0.25530 0.24500 -0.00040 -0.01590 0.00620  166 GLU A CG  
2356 C  CD  . GLU A 162 ? 0.15670 0.26620 0.23540 -0.02700 -0.02750 0.03940  166 GLU A CD  
2357 O  OE1 . GLU A 162 ? 0.15820 0.26390 0.19610 -0.02510 -0.01440 0.03140  166 GLU A OE1 
2358 O  OE2 . GLU A 162 ? 0.16100 0.29020 0.24280 -0.04040 -0.02780 0.07160  166 GLU A OE2 
2365 N  N   A LEU A 163 ? 0.19630 0.23190 0.17890 0.00890  -0.01880 -0.00650 167 LEU A N   
2366 N  N   B LEU A 163 ? 0.19280 0.23400 0.17200 0.00860  -0.00940 0.00540  167 LEU A N   
2367 C  CA  A LEU A 163 ? 0.18150 0.22530 0.17510 0.01210  -0.02600 -0.00750 167 LEU A CA  
2368 C  CA  B LEU A 163 ? 0.17140 0.22890 0.16610 0.01140  -0.00970 0.01570  167 LEU A CA  
2369 C  C   A LEU A 163 ? 0.16860 0.22340 0.16340 -0.00450 -0.00920 0.00840  167 LEU A C   
2370 C  C   B LEU A 163 ? 0.16180 0.22380 0.15690 -0.00610 -0.00080 0.02110  167 LEU A C   
2371 O  O   A LEU A 163 ? 0.16820 0.22280 0.15930 0.00010  -0.00810 0.00810  167 LEU A O   
2372 O  O   B LEU A 163 ? 0.16110 0.22210 0.15260 -0.00200 -0.00270 0.01830  167 LEU A O   
2373 C  CB  A LEU A 163 ? 0.20400 0.23480 0.19010 0.02080  -0.05350 -0.02620 167 LEU A CB  
2374 C  CB  B LEU A 163 ? 0.19440 0.24740 0.18300 0.01650  -0.02640 0.01270  167 LEU A CB  
2375 C  CG  A LEU A 163 ? 0.21070 0.23990 0.19970 0.02040  -0.07800 -0.04540 167 LEU A CG  
2376 C  CG  B LEU A 163 ? 0.20200 0.26240 0.19390 0.01310  -0.03390 0.01060  167 LEU A CG  
2377 C  CD1 A LEU A 163 ? 0.20710 0.23850 0.20690 0.01690  -0.07890 -0.04570 167 LEU A CD1 
2378 C  CD1 B LEU A 163 ? 0.21670 0.27520 0.21790 0.00200  -0.01360 0.01170  167 LEU A CD1 
2379 C  CD2 A LEU A 163 ? 0.21190 0.24560 0.21110 0.02770  -0.07370 -0.04460 167 LEU A CD2 
2380 C  CD2 B LEU A 163 ? 0.18870 0.26120 0.19100 0.00680  -0.02400 0.01030  167 LEU A CD2 
2403 N  N   . GLU A 164 ? 0.16230 0.22530 0.15790 -0.01810 0.00080  0.01060  168 GLU A N   
2404 C  CA  . GLU A 164 ? 0.15750 0.24090 0.15850 -0.01080 0.00550  0.03070  168 GLU A CA  
2405 C  C   . GLU A 164 ? 0.14340 0.22260 0.16320 -0.00600 0.00510  0.02030  168 GLU A C   
2406 O  O   . GLU A 164 ? 0.16640 0.22770 0.16690 -0.01490 -0.00400 0.01020  168 GLU A O   
2407 C  CB  . GLU A 164 ? 0.17830 0.29570 0.16070 -0.00620 0.01030  0.03040  168 GLU A CB  
2408 C  CG  . GLU A 164 ? 0.23300 0.34340 0.19610 0.00320  0.01170  0.04680  168 GLU A CG  
2409 C  CD  . GLU A 164 ? 0.29520 0.37970 0.20730 0.00630  0.03330  0.05980  168 GLU A CD  
2410 O  OE1 . GLU A 164 ? 0.30400 0.39520 0.17990 0.00620  0.02340  0.02600  168 GLU A OE1 
2411 O  OE2 . GLU A 164 ? 0.35490 0.39660 0.25330 0.00220  0.02680  0.09520  168 GLU A OE2 
2418 N  N   . LEU A 165 ? 0.15340 0.21490 0.15230 -0.00620 -0.00270 0.02510  169 LEU A N   
2419 C  CA  . LEU A 165 ? 0.14950 0.21390 0.14950 -0.01990 -0.01560 0.01540  169 LEU A CA  
2420 C  C   . LEU A 165 ? 0.15050 0.22370 0.15680 -0.00950 -0.02620 0.00770  169 LEU A C   
2421 O  O   . LEU A 165 ? 0.18610 0.22590 0.15130 -0.00600 -0.02530 0.00810  169 LEU A O   
2422 C  CB  . LEU A 165 ? 0.13510 0.20930 0.14940 -0.01600 -0.01430 0.01030  169 LEU A CB  
2423 C  CG  . LEU A 165 ? 0.14080 0.20590 0.16260 -0.02170 0.00330  0.00110  169 LEU A CG  
2424 C  CD1 . LEU A 165 ? 0.14030 0.22170 0.19360 -0.02380 0.01970  0.00040  169 LEU A CD1 
2425 C  CD2 . LEU A 165 ? 0.16330 0.21590 0.16880 -0.02410 0.01390  -0.00210 169 LEU A CD2 
2437 N  N   . ASN A 166 ? 0.13720 0.22390 0.14330 -0.00890 -0.00570 0.00970  170 ASN A N   
2438 C  CA  . ASN A 166 ? 0.13350 0.22960 0.15340 -0.00910 -0.00170 0.00490  170 ASN A CA  
2439 C  C   . ASN A 166 ? 0.13640 0.21230 0.15130 -0.01880 0.00580  -0.00690 170 ASN A C   
2440 O  O   . ASN A 166 ? 0.14660 0.22600 0.16760 -0.00880 0.01300  -0.01190 170 ASN A O   
2441 C  CB  . ASN A 166 ? 0.14520 0.25750 0.16810 -0.00980 -0.00280 -0.00100 170 ASN A CB  
2442 C  CG  . ASN A 166 ? 0.14650 0.28320 0.16000 -0.03430 -0.01560 0.02440  170 ASN A CG  
2443 O  OD1 . ASN A 166 ? 0.17190 0.29750 0.16550 -0.03710 -0.01590 0.02710  170 ASN A OD1 
2444 N  ND2 . ASN A 166 ? 0.17610 0.29830 0.18140 -0.03710 -0.01770 0.01460  170 ASN A ND2 
2451 N  N   . SER A 167 ? 0.13730 0.19890 0.16920 -0.01270 0.00390  0.00680  171 SER A N   
2452 C  CA  . SER A 167 ? 0.14920 0.18200 0.16850 -0.02030 0.00460  0.01440  171 SER A CA  
2453 C  C   . SER A 167 ? 0.14450 0.16190 0.17240 -0.00970 0.00010  0.00570  171 SER A C   
2454 O  O   . SER A 167 ? 0.15570 0.17050 0.18100 -0.00950 0.00460  0.01260  171 SER A O   
2455 C  CB  . SER A 167 ? 0.14490 0.19120 0.17080 -0.01940 0.01250  0.00890  171 SER A CB  
2456 O  OG  . SER A 167 ? 0.14280 0.19480 0.17670 -0.00440 0.01330  0.00320  171 SER A OG  
2462 N  N   . ALA A 168 ? 0.14360 0.15880 0.16240 -0.00580 -0.00370 0.01320  172 ALA A N   
2463 C  CA  . ALA A 168 ? 0.13910 0.15330 0.16580 -0.01180 0.00860  0.00410  172 ALA A CA  
2464 C  C   . ALA A 168 ? 0.14970 0.14530 0.16840 -0.00980 0.00820  0.00460  172 ALA A C   
2465 O  O   . ALA A 168 ? 0.14770 0.16010 0.19060 -0.01620 0.01370  -0.00490 172 ALA A O   
2466 C  CB  . ALA A 168 ? 0.15220 0.16040 0.18100 -0.02910 -0.00240 -0.00390 172 ALA A CB  
2472 N  N   . ILE A 169 ? 0.13830 0.15680 0.18240 -0.01340 0.00400  0.00050  173 ILE A N   
2473 C  CA  . ILE A 169 ? 0.14950 0.14590 0.16950 -0.01110 0.01430  -0.00300 173 ILE A CA  
2474 C  C   . ILE A 169 ? 0.13910 0.13280 0.18250 -0.01010 -0.00430 0.00010  173 ILE A C   
2475 O  O   . ILE A 169 ? 0.15000 0.14510 0.17840 -0.00340 -0.00970 -0.00680 173 ILE A O   
2476 C  CB  . ILE A 169 ? 0.15010 0.16230 0.17270 -0.01390 -0.00310 -0.00500 173 ILE A CB  
2477 C  CG1 . ILE A 169 ? 0.17820 0.19760 0.18250 -0.01330 -0.01210 -0.00460 173 ILE A CG1 
2478 C  CG2 . ILE A 169 ? 0.14370 0.18490 0.18790 -0.03010 0.00650  -0.02410 173 ILE A CG2 
2479 C  CD1 . ILE A 169 ? 0.20330 0.22600 0.19650 -0.00540 0.00310  -0.00860 173 ILE A CD1 
2491 N  N   . PRO A 170 ? 0.15260 0.14670 0.17330 -0.00430 -0.00430 -0.00170 174 PRO A N   
2492 C  CA  . PRO A 170 ? 0.16780 0.14830 0.17150 0.00870  -0.01520 0.00110  174 PRO A CA  
2493 C  C   . PRO A 170 ? 0.16440 0.14930 0.17190 -0.01020 -0.02010 -0.00740 174 PRO A C   
2494 O  O   . PRO A 170 ? 0.14980 0.16500 0.18820 -0.01080 -0.00650 -0.01160 174 PRO A O   
2495 C  CB  . PRO A 170 ? 0.16950 0.16260 0.19840 0.00340  -0.00790 -0.01130 174 PRO A CB  
2496 C  CG  . PRO A 170 ? 0.17490 0.16340 0.19510 0.00870  -0.00930 -0.01080 174 PRO A CG  
2497 C  CD  . PRO A 170 ? 0.16040 0.15670 0.19190 0.00700  0.00120  -0.02590 174 PRO A CD  
2505 N  N   . GLY A 171 ? 0.16480 0.14920 0.17760 0.00680  -0.02070 0.00250  175 GLY A N   
2506 C  CA  . GLY A 171 ? 0.17640 0.15760 0.18640 0.01320  -0.03020 -0.00380 175 GLY A CA  
2507 C  C   . GLY A 171 ? 0.17210 0.18470 0.18460 0.01150  -0.00830 -0.02240 175 GLY A C   
2508 O  O   . GLY A 171 ? 0.19180 0.20880 0.21410 0.03660  -0.03140 -0.03530 175 GLY A O   
2512 N  N   . ASP A 172 ? 0.15200 0.17710 0.16260 -0.00980 -0.01580 -0.01420 176 ASP A N   
2513 C  CA  . ASP A 172 ? 0.14610 0.17410 0.17620 -0.00060 -0.00160 -0.01920 176 ASP A CA  
2514 C  C   . ASP A 172 ? 0.14710 0.17000 0.18470 0.00220  -0.01010 -0.00880 176 ASP A C   
2515 O  O   . ASP A 172 ? 0.14730 0.18010 0.20040 0.00340  0.00780  -0.01480 176 ASP A O   
2516 C  CB  . ASP A 172 ? 0.14740 0.18430 0.16790 -0.00830 0.00870  -0.01810 176 ASP A CB  
2517 C  CG  . ASP A 172 ? 0.13050 0.19990 0.19210 -0.00660 0.01990  -0.01480 176 ASP A CG  
2518 O  OD1 . ASP A 172 ? 0.15140 0.20250 0.19100 -0.01900 0.02840  -0.03170 176 ASP A OD1 
2519 O  OD2 . ASP A 172 ? 0.17890 0.23240 0.18280 0.01670  0.00140  -0.02280 176 ASP A OD2 
2524 N  N   . ALA A 173 ? 0.12850 0.16470 0.18210 0.00000  -0.00910 -0.00280 177 ALA A N   
2525 C  CA  . ALA A 173 ? 0.15910 0.16150 0.18460 -0.00140 -0.00190 -0.00930 177 ALA A CA  
2526 C  C   . ALA A 173 ? 0.13650 0.16330 0.17310 -0.00270 0.01270  -0.01880 177 ALA A C   
2527 O  O   . ALA A 173 ? 0.14360 0.16590 0.15030 -0.00780 0.00640  -0.01120 177 ALA A O   
2528 C  CB  . ALA A 173 ? 0.17620 0.16770 0.19230 0.00920  -0.01780 -0.01360 177 ALA A CB  
2534 N  N   . ARG A 174 ? 0.12700 0.16790 0.17210 -0.02240 0.01480  -0.01510 178 ARG A N   
2535 C  CA  . ARG A 174 ? 0.12640 0.17220 0.16870 -0.01450 0.01990  -0.02010 178 ARG A CA  
2536 C  C   . ARG A 174 ? 0.12570 0.16950 0.13640 -0.00600 0.01030  -0.00850 178 ARG A C   
2537 O  O   . ARG A 174 ? 0.13830 0.16440 0.15090 -0.00570 0.02180  0.00320  178 ARG A O   
2538 C  CB  . ARG A 174 ? 0.13220 0.18000 0.16830 -0.01350 0.02530  0.00040  178 ARG A CB  
2539 C  CG  . ARG A 174 ? 0.13910 0.18450 0.18200 -0.02260 0.03250  0.00440  178 ARG A CG  
2540 C  CD  . ARG A 174 ? 0.15270 0.19450 0.17700 -0.01850 0.04200  -0.00340 178 ARG A CD  
2541 N  NE  . ARG A 174 ? 0.16730 0.20340 0.17160 -0.03200 0.03060  -0.00550 178 ARG A NE  
2542 C  CZ  . ARG A 174 ? 0.16700 0.21640 0.16950 -0.03410 0.03090  0.00330  178 ARG A CZ  
2543 N  NH1 . ARG A 174 ? 0.19230 0.24980 0.16350 -0.00530 0.03770  -0.00030 178 ARG A NH1 
2544 N  NH2 . ARG A 174 ? 0.18320 0.21170 0.18130 -0.02890 0.00540  0.00090  178 ARG A NH2 
2558 N  N   . ASP A 175 ? 0.12120 0.16700 0.13530 -0.00360 0.01050  -0.00510 179 ASP A N   
2559 C  CA  . ASP A 175 ? 0.12120 0.17750 0.13980 -0.01390 0.00760  0.00250  179 ASP A CA  
2560 C  C   . ASP A 175 ? 0.11740 0.16940 0.14620 0.00110  0.01210  0.00790  179 ASP A C   
2561 O  O   . ASP A 175 ? 0.13150 0.18030 0.13540 -0.00260 -0.00190 -0.00240 179 ASP A O   
2562 C  CB  . ASP A 175 ? 0.12710 0.18910 0.13480 -0.00740 0.01720  -0.00200 179 ASP A CB  
2563 C  CG  . ASP A 175 ? 0.12560 0.18710 0.14230 -0.00770 0.00990  0.00510  179 ASP A CG  
2564 O  OD1 . ASP A 175 ? 0.13740 0.18530 0.14280 -0.00140 0.01640  0.00460  179 ASP A OD1 
2565 O  OD2 . ASP A 175 ? 0.15350 0.19100 0.14320 -0.01540 0.00690  0.00110  179 ASP A OD2 
2570 N  N   . THR A 176 ? 0.12460 0.17370 0.13390 0.00240  0.01250  0.00640  180 THR A N   
2571 C  CA  . THR A 176 ? 0.12750 0.17490 0.13400 -0.00880 0.01080  0.00110  180 THR A CA  
2572 C  C   . THR A 176 ? 0.13140 0.17140 0.13240 -0.00120 -0.00450 -0.01620 180 THR A C   
2573 O  O   . THR A 176 ? 0.13610 0.17410 0.13130 -0.00930 0.00120  0.00050  180 THR A O   
2574 C  CB  . THR A 176 ? 0.12680 0.18500 0.14620 -0.00140 -0.00560 -0.00370 180 THR A CB  
2575 O  OG1 . THR A 176 ? 0.14230 0.19400 0.14900 -0.01630 -0.00530 0.00030  180 THR A OG1 
2576 C  CG2 . THR A 176 ? 0.14190 0.19450 0.14060 -0.00910 -0.01450 -0.00270 180 THR A CG2 
2584 N  N   . SER A 177 ? 0.13220 0.16870 0.13420 -0.00840 0.00430  0.00270  181 SER A N   
2585 C  CA  . SER A 177 ? 0.14540 0.15780 0.13730 -0.01030 0.00650  -0.00550 181 SER A CA  
2586 C  C   . SER A 177 ? 0.13810 0.15500 0.13990 -0.00630 -0.00080 0.00470  181 SER A C   
2587 O  O   . SER A 177 ? 0.19040 0.15220 0.13400 -0.00410 -0.00140 -0.00540 181 SER A O   
2588 C  CB  . SER A 177 ? 0.15400 0.14950 0.13960 -0.01880 0.00490  -0.00190 181 SER A CB  
2589 O  OG  . SER A 177 ? 0.15760 0.16100 0.14740 -0.01870 0.00190  0.00800  181 SER A OG  
2595 N  N   . SER A 178 ? 0.13500 0.16310 0.14200 -0.00580 0.01870  0.00240  182 SER A N   
2596 C  CA  . SER A 178 ? 0.12620 0.16690 0.13660 -0.00780 0.01040  -0.00100 182 SER A CA  
2597 C  C   . SER A 178 ? 0.13530 0.16080 0.12890 0.00410  0.00120  0.00230  182 SER A C   
2598 O  O   . SER A 178 ? 0.12320 0.17400 0.14010 -0.00330 0.00210  -0.00730 182 SER A O   
2599 C  CB  . SER A 178 ? 0.13360 0.17060 0.14500 -0.00970 0.01420  -0.00450 182 SER A CB  
2600 O  OG  . SER A 178 ? 0.14160 0.17200 0.14620 -0.00400 0.00500  0.00730  182 SER A OG  
2606 N  N   . PRO A 179 ? 0.12270 0.16170 0.13500 -0.00400 0.00260  0.00180  183 PRO A N   
2607 C  CA  . PRO A 179 ? 0.12630 0.16520 0.13840 -0.00110 -0.00210 -0.00900 183 PRO A CA  
2608 C  C   . PRO A 179 ? 0.13240 0.16880 0.12540 -0.01250 0.00970  -0.01290 183 PRO A C   
2609 O  O   . PRO A 179 ? 0.13610 0.18340 0.14750 -0.00990 0.00190  -0.00300 183 PRO A O   
2610 C  CB  . PRO A 179 ? 0.12910 0.17340 0.15520 0.00220  0.00520  -0.00580 183 PRO A CB  
2611 C  CG  . PRO A 179 ? 0.13540 0.17130 0.15570 -0.00120 0.00070  0.00490  183 PRO A CG  
2612 C  CD  . PRO A 179 ? 0.12510 0.16100 0.15740 -0.00370 -0.00510 -0.00190 183 PRO A CD  
2620 N  N   . ARG A 180 ? 0.13560 0.18040 0.13630 -0.00450 0.00240  0.00720  184 ARG A N   
2621 C  CA  . ARG A 180 ? 0.13710 0.17540 0.14950 -0.00670 0.00530  0.00750  184 ARG A CA  
2622 C  C   . ARG A 180 ? 0.12780 0.16490 0.15390 -0.00550 0.01140  0.00650  184 ARG A C   
2623 O  O   . ARG A 180 ? 0.14260 0.17630 0.15710 -0.01260 0.01010  0.00320  184 ARG A O   
2624 C  CB  . ARG A 180 ? 0.14970 0.19030 0.14600 0.01210  0.00540  0.00860  184 ARG A CB  
2625 C  CG  . ARG A 180 ? 0.14900 0.20490 0.15930 0.00560  0.00440  0.01330  184 ARG A CG  
2626 C  CD  . ARG A 180 ? 0.18460 0.21340 0.16320 0.00480  -0.01700 0.01980  184 ARG A CD  
2627 N  NE  . ARG A 180 ? 0.23790 0.22450 0.17240 0.01630  -0.03440 0.02270  184 ARG A NE  
2628 C  CZ  . ARG A 180 ? 0.30060 0.23550 0.19840 0.01540  -0.05550 0.02880  184 ARG A CZ  
2629 N  NH1 . ARG A 180 ? 0.30980 0.25050 0.21060 0.01250  -0.06130 0.03190  184 ARG A NH1 
2630 N  NH2 . ARG A 180 ? 0.34110 0.23980 0.21870 0.00630  -0.07150 0.03380  184 ARG A NH2 
2644 N  N   . ALA A 181 ? 0.12740 0.17030 0.14650 -0.00010 0.00000  0.00900  185 ALA A N   
2645 C  CA  . ALA A 181 ? 0.13030 0.16980 0.15430 -0.00700 -0.00200 0.00160  185 ALA A CA  
2646 C  C   . ALA A 181 ? 0.12960 0.16390 0.15470 -0.01540 0.01920  -0.00580 185 ALA A C   
2647 O  O   . ALA A 181 ? 0.14010 0.17160 0.16100 -0.01100 0.01240  0.00650  185 ALA A O   
2648 C  CB  . ALA A 181 ? 0.12830 0.17970 0.15020 0.00480  0.00620  0.00140  185 ALA A CB  
2654 N  N   . VAL A 182 ? 0.11710 0.15900 0.15520 -0.00510 0.01350  -0.00520 186 VAL A N   
2655 C  CA  . VAL A 182 ? 0.12370 0.15660 0.15520 -0.01720 0.00830  0.00220  186 VAL A CA  
2656 C  C   . VAL A 182 ? 0.12870 0.16130 0.15180 -0.01350 0.00370  -0.00780 186 VAL A C   
2657 O  O   . VAL A 182 ? 0.13750 0.16920 0.16130 -0.01940 -0.00110 -0.01470 186 VAL A O   
2658 C  CB  . VAL A 182 ? 0.13400 0.16970 0.15310 -0.00530 0.00550  0.00610  186 VAL A CB  
2659 C  CG1 . VAL A 182 ? 0.13250 0.17500 0.15410 -0.00930 -0.00350 0.00840  186 VAL A CG1 
2660 C  CG2 . VAL A 182 ? 0.13890 0.17640 0.13790 -0.00430 0.00100  0.01420  186 VAL A CG2 
2670 N  N   . THR A 183 ? 0.12800 0.17590 0.15010 -0.00650 0.01130  0.00380  187 THR A N   
2671 C  CA  . THR A 183 ? 0.13290 0.18210 0.16920 -0.01340 0.00600  0.00200  187 THR A CA  
2672 C  C   . THR A 183 ? 0.14130 0.17950 0.17220 -0.01970 0.01400  0.01040  187 THR A C   
2673 O  O   . THR A 183 ? 0.13640 0.18640 0.17880 -0.02710 0.01410  0.02150  187 THR A O   
2674 C  CB  . THR A 183 ? 0.13270 0.19710 0.17550 -0.01040 0.01100  0.00910  187 THR A CB  
2675 O  OG1 . THR A 183 ? 0.20220 0.22120 0.16290 0.01900  0.01380  0.00360  187 THR A OG1 
2676 C  CG2 . THR A 183 ? 0.16430 0.21710 0.18040 -0.03910 0.02160  0.00270  187 THR A CG2 
2684 N  N   . GLU A 184 ? 0.13400 0.18120 0.16510 -0.00400 0.00030  0.01510  188 GLU A N   
2685 C  CA  . GLU A 184 ? 0.14610 0.17940 0.17930 -0.00100 0.01040  0.00920  188 GLU A CA  
2686 C  C   . GLU A 184 ? 0.13790 0.15470 0.18180 -0.01030 0.01280  0.01340  188 GLU A C   
2687 O  O   . GLU A 184 ? 0.16830 0.15820 0.18590 -0.01980 0.01950  0.01420  188 GLU A O   
2688 C  CB  . GLU A 184 ? 0.16040 0.19220 0.17660 0.01270  0.00060  0.00300  188 GLU A CB  
2689 C  CG  . GLU A 184 ? 0.17120 0.21330 0.17340 -0.01140 0.00220  0.00690  188 GLU A CG  
2690 C  CD  . GLU A 184 ? 0.19810 0.23900 0.18160 -0.00520 -0.00360 -0.00180 188 GLU A CD  
2691 O  OE1 . GLU A 184 ? 0.17210 0.25970 0.20440 -0.00150 0.00130  -0.01890 188 GLU A OE1 
2692 O  OE2 . GLU A 184 ? 0.21700 0.24510 0.19650 0.00690  -0.03260 0.00660  188 GLU A OE2 
2699 N  N   . SER A 185 ? 0.14180 0.15830 0.18470 -0.01360 0.00900  0.00430  189 SER A N   
2700 C  CA  . SER A 185 ? 0.13810 0.16890 0.17630 -0.01120 0.00170  -0.01340 189 SER A CA  
2701 C  C   . SER A 185 ? 0.14930 0.15910 0.18220 -0.01060 0.00760  -0.00190 189 SER A C   
2702 O  O   . SER A 185 ? 0.16500 0.16490 0.17580 -0.01290 0.01860  0.00210  189 SER A O   
2703 C  CB  . SER A 185 ? 0.13270 0.18360 0.17490 -0.02520 0.01210  -0.00020 189 SER A CB  
2704 O  OG  . SER A 185 ? 0.14730 0.17010 0.17260 -0.01140 0.00790  0.00970  189 SER A OG  
2710 N  N   . LEU A 186 ? 0.14480 0.16030 0.18600 -0.00650 0.01840  -0.00300 190 LEU A N   
2711 C  CA  . LEU A 186 ? 0.12880 0.16840 0.17580 -0.02190 0.00820  0.00170  190 LEU A CA  
2712 C  C   . LEU A 186 ? 0.14110 0.17870 0.19220 -0.02360 0.00450  0.00530  190 LEU A C   
2713 O  O   . LEU A 186 ? 0.15540 0.18610 0.20100 -0.03790 0.00280  0.00140  190 LEU A O   
2714 C  CB  . LEU A 186 ? 0.12680 0.17300 0.17660 -0.02010 0.01780  0.00330  190 LEU A CB  
2715 C  CG  . LEU A 186 ? 0.14340 0.19090 0.19800 -0.00480 0.01070  0.00510  190 LEU A CG  
2716 C  CD1 . LEU A 186 ? 0.15720 0.20380 0.21650 -0.01090 -0.02600 0.00440  190 LEU A CD1 
2717 C  CD2 . LEU A 186 ? 0.16040 0.19700 0.20250 0.01620  0.01660  0.00740  190 LEU A CD2 
2729 N  N   A GLN A 187 ? 0.14570 0.18660 0.19550 -0.01650 0.00760  0.01060  191 GLN A N   
2730 N  N   B GLN A 187 ? 0.14980 0.18260 0.20120 -0.01820 0.00430  0.01230  191 GLN A N   
2731 N  N   C GLN A 187 ? 0.13930 0.18560 0.20290 -0.01970 0.00510  0.01300  191 GLN A N   
2732 C  CA  A GLN A 187 ? 0.16690 0.19330 0.19230 -0.01480 0.01120  0.01540  191 GLN A CA  
2733 C  CA  B GLN A 187 ? 0.17470 0.18600 0.20310 -0.01810 0.00620  0.01890  191 GLN A CA  
2734 C  CA  C GLN A 187 ? 0.15690 0.19140 0.20690 -0.02170 0.00770  0.02070  191 GLN A CA  
2735 C  C   A GLN A 187 ? 0.16860 0.18460 0.20070 -0.01430 0.01950  0.01220  191 GLN A C   
2736 C  C   B GLN A 187 ? 0.17150 0.17970 0.20630 -0.01780 0.01870  0.01430  191 GLN A C   
2737 C  C   C GLN A 187 ? 0.16210 0.18120 0.21040 -0.02200 0.02180  0.01570  191 GLN A C   
2738 O  O   A GLN A 187 ? 0.17480 0.18520 0.20530 -0.01990 0.01660  0.01310  191 GLN A O   
2739 O  O   B GLN A 187 ? 0.17580 0.17820 0.21210 -0.02640 0.01890  0.01640  191 GLN A O   
2740 O  O   C GLN A 187 ? 0.16510 0.17700 0.21920 -0.03630 0.02330  0.02000  191 GLN A O   
2741 C  CB  A GLN A 187 ? 0.17600 0.20570 0.18980 -0.00790 0.02680  0.02080  191 GLN A CB  
2742 C  CB  B GLN A 187 ? 0.19420 0.19190 0.21120 -0.01410 0.01530  0.02580  191 GLN A CB  
2743 C  CB  C GLN A 187 ? 0.15550 0.20310 0.21680 -0.01770 0.02030  0.03060  191 GLN A CB  
2744 C  CG  A GLN A 187 ? 0.19970 0.21850 0.19280 -0.00630 0.03160  0.01660  191 GLN A CG  
2745 C  CG  B GLN A 187 ? 0.22240 0.19810 0.21900 -0.01590 0.01170  0.02020  191 GLN A CG  
2746 C  CG  C GLN A 187 ? 0.17210 0.21560 0.23030 -0.01880 0.02160  0.02970  191 GLN A CG  
2747 C  CD  A GLN A 187 ? 0.21770 0.22840 0.19430 -0.00530 0.03440  0.01360  191 GLN A CD  
2748 C  CD  B GLN A 187 ? 0.24420 0.20350 0.22480 -0.01380 0.00420  0.01510  191 GLN A CD  
2749 C  CD  C GLN A 187 ? 0.17780 0.22560 0.24680 -0.01830 0.01180  0.02980  191 GLN A CD  
2750 O  OE1 A GLN A 187 ? 0.23200 0.24010 0.20610 -0.00500 0.01990  0.01250  191 GLN A OE1 
2751 O  OE1 B GLN A 187 ? 0.25600 0.20360 0.22540 -0.01610 0.00360  0.00960  191 GLN A OE1 
2752 O  OE1 C GLN A 187 ? 0.17060 0.23400 0.25770 -0.00680 -0.00040 0.01910  191 GLN A OE1 
2753 N  NE2 A GLN A 187 ? 0.22330 0.22870 0.19600 -0.00580 0.05280  0.01260  191 GLN A NE2 
2754 N  NE2 B GLN A 187 ? 0.26010 0.20640 0.22960 -0.00190 0.01690  0.01410  191 GLN A NE2 
2755 N  NE2 C GLN A 187 ? 0.20190 0.23070 0.26000 -0.02520 0.00430  0.03830  191 GLN A NE2 
2779 N  N   . LYS A 188 ? 0.17170 0.18010 0.20690 -0.01110 0.02260  0.00950  192 LYS A N   
2780 C  CA  . LYS A 188 ? 0.18630 0.17720 0.21170 -0.01580 0.03420  -0.00230 192 LYS A CA  
2781 C  C   . LYS A 188 ? 0.18010 0.15920 0.22300 -0.02740 0.03330  -0.00020 192 LYS A C   
2782 O  O   . LYS A 188 ? 0.19370 0.16380 0.23840 -0.02860 0.02970  0.00460  192 LYS A O   
2783 C  CB  . LYS A 188 ? 0.17910 0.19630 0.22420 -0.00430 0.04690  -0.00230 192 LYS A CB  
2784 C  CG  . LYS A 188 ? 0.17610 0.20260 0.21440 -0.00790 0.03130  0.01150  192 LYS A CG  
2785 C  CD  . LYS A 188 ? 0.18670 0.21910 0.22270 -0.01930 0.00920  0.01330  192 LYS A CD  
2786 C  CE  . LYS A 188 ? 0.18660 0.22870 0.22190 -0.00910 0.02640  0.01270  192 LYS A CE  
2787 N  NZ  . LYS A 188 ? 0.18070 0.22540 0.24950 0.00210  -0.00220 0.02540  192 LYS A NZ  
2801 N  N   . LEU A 189 ? 0.17300 0.16120 0.20650 -0.02300 0.02900  -0.01230 193 LEU A N   
2802 C  CA  . LEU A 189 ? 0.17390 0.18120 0.21100 -0.01830 0.02290  -0.00950 193 LEU A CA  
2803 C  C   . LEU A 189 ? 0.16860 0.20780 0.21730 -0.03760 0.02960  -0.01680 193 LEU A C   
2804 O  O   . LEU A 189 ? 0.17580 0.23470 0.25150 -0.04700 0.01800  -0.04750 193 LEU A O   
2805 C  CB  . LEU A 189 ? 0.17100 0.18660 0.20920 -0.03180 0.01200  -0.00010 193 LEU A CB  
2806 C  CG  . LEU A 189 ? 0.17450 0.18720 0.18800 -0.01840 0.02450  0.00190  193 LEU A CG  
2807 C  CD1 . LEU A 189 ? 0.16880 0.19240 0.17670 -0.02080 0.01720  -0.00080 193 LEU A CD1 
2808 C  CD2 . LEU A 189 ? 0.17730 0.18400 0.19020 -0.00450 0.02970  0.00500  193 LEU A CD2 
2820 N  N   . THR A 190 ? 0.16550 0.21060 0.20560 -0.04740 0.02910  -0.01630 194 THR A N   
2821 C  CA  . THR A 190 ? 0.16440 0.21140 0.19920 -0.05960 0.02340  -0.00080 194 THR A CA  
2822 C  C   . THR A 190 ? 0.18320 0.21590 0.22450 -0.07430 0.00770  0.00990  194 THR A C   
2823 O  O   . THR A 190 ? 0.19670 0.24270 0.25120 -0.07390 0.01270  0.03100  194 THR A O   
2824 C  CB  . THR A 190 ? 0.16750 0.20750 0.20470 -0.04390 0.01020  -0.01640 194 THR A CB  
2825 O  OG1 . THR A 190 ? 0.16680 0.20430 0.20880 -0.03720 0.01670  -0.00720 194 THR A OG1 
2826 C  CG2 . THR A 190 ? 0.16290 0.20690 0.21430 -0.03720 0.02140  -0.01840 194 THR A CG2 
2834 N  N   . LEU A 191 ? 0.18340 0.20500 0.22990 -0.05180 0.02370  0.02030  195 LEU A N   
2835 C  CA  . LEU A 191 ? 0.19270 0.20400 0.23320 -0.04050 0.02570  0.02710  195 LEU A CA  
2836 C  C   . LEU A 191 ? 0.20650 0.19360 0.24950 -0.04200 0.04230  0.03890  195 LEU A C   
2837 O  O   . LEU A 191 ? 0.23290 0.20460 0.29460 -0.04960 0.04900  0.04770  195 LEU A O   
2838 C  CB  . LEU A 191 ? 0.18380 0.20610 0.24330 -0.03090 0.02940  0.01470  195 LEU A CB  
2839 C  CG  . LEU A 191 ? 0.19690 0.21410 0.25340 -0.02560 0.03330  0.01580  195 LEU A CG  
2840 C  CD1 . LEU A 191 ? 0.21670 0.21380 0.24810 -0.02360 0.05680  0.01150  195 LEU A CD1 
2841 C  CD2 . LEU A 191 ? 0.20320 0.22910 0.27240 -0.02090 0.02880  0.01010  195 LEU A CD2 
2853 N  N   . GLY A 192 ? 0.21090 0.19370 0.25900 -0.02560 0.04800  0.02760  196 GLY A N   
2854 C  CA  . GLY A 192 ? 0.21220 0.19990 0.27300 -0.01790 0.04610  0.02270  196 GLY A CA  
2855 C  C   . GLY A 192 ? 0.23240 0.22290 0.27930 -0.01520 0.03730  0.01230  196 GLY A C   
2856 O  O   . GLY A 192 ? 0.25410 0.24810 0.29690 -0.01530 0.02360  -0.00420 196 GLY A O   
2860 N  N   . SER A 193 ? 0.24810 0.22330 0.28290 -0.01310 0.05030  0.01270  197 SER A N   
2861 C  CA  . SER A 193 ? 0.27940 0.23350 0.29710 -0.00450 0.04460  0.00030  197 SER A CA  
2862 C  C   . SER A 193 ? 0.27130 0.22620 0.28520 -0.00730 0.04540  -0.01580 197 SER A C   
2863 O  O   . SER A 193 ? 0.30140 0.22190 0.30380 -0.01520 0.04530  -0.02400 197 SER A O   
2864 C  CB  . SER A 193 ? 0.33530 0.26590 0.33040 0.01590  0.03820  0.01420  197 SER A CB  
2865 O  OG  . SER A 193 ? 0.37680 0.28880 0.35790 0.03490  0.03100  0.01980  197 SER A OG  
2871 N  N   . ALA A 194 ? 0.23660 0.22780 0.26640 -0.01780 0.04260  -0.00980 198 ALA A N   
2872 C  CA  . ALA A 194 ? 0.22770 0.24200 0.25970 -0.01500 0.04610  -0.01560 198 ALA A CA  
2873 C  C   . ALA A 194 ? 0.24240 0.24710 0.26210 -0.01980 0.03750  -0.02060 198 ALA A C   
2874 O  O   . ALA A 194 ? 0.25750 0.26770 0.27290 -0.01900 0.03720  -0.01430 198 ALA A O   
2875 C  CB  . ALA A 194 ? 0.22040 0.24710 0.27100 -0.02330 0.07070  -0.00970 198 ALA A CB  
2881 N  N   . LEU A 195 ? 0.24020 0.23660 0.26000 -0.03650 0.02660  -0.02380 199 LEU A N   
2882 C  CA  . LEU A 195 ? 0.25710 0.23510 0.26040 -0.03910 0.01170  -0.02470 199 LEU A CA  
2883 C  C   . LEU A 195 ? 0.28630 0.24070 0.28180 -0.04820 0.01580  -0.01640 199 LEU A C   
2884 O  O   . LEU A 195 ? 0.32420 0.24690 0.28150 -0.06460 0.02760  -0.00200 199 LEU A O   
2885 C  CB  . LEU A 195 ? 0.23960 0.23650 0.26420 -0.04310 0.00460  -0.01930 199 LEU A CB  
2886 C  CG  . LEU A 195 ? 0.22110 0.23920 0.26330 -0.03800 0.02630  -0.00740 199 LEU A CG  
2887 C  CD1 . LEU A 195 ? 0.21870 0.24950 0.25980 -0.04570 0.02320  -0.01020 199 LEU A CD1 
2888 C  CD2 . LEU A 195 ? 0.23300 0.24340 0.28050 -0.01090 0.05400  0.00300  199 LEU A CD2 
2900 N  N   . ALA A 196 ? 0.28910 0.24190 0.29080 -0.05030 0.01330  -0.02800 200 ALA A N   
2901 C  CA  . ALA A 196 ? 0.30770 0.24950 0.32570 -0.05610 0.00430  -0.03460 200 ALA A CA  
2902 C  C   . ALA A 196 ? 0.29140 0.25280 0.33990 -0.07040 -0.00330 -0.03130 200 ALA A C   
2903 O  O   . ALA A 196 ? 0.27490 0.24390 0.31020 -0.06950 -0.00140 -0.03740 200 ALA A O   
2904 C  CB  . ALA A 196 ? 0.32600 0.25930 0.33530 -0.05280 -0.00740 -0.03650 200 ALA A CB  
2910 N  N   . ALA A 197 ? 0.29800 0.26180 0.35980 -0.07570 0.00000  -0.01370 201 ALA A N   
2911 C  CA  . ALA A 197 ? 0.29530 0.26210 0.36980 -0.08780 0.00660  -0.01280 201 ALA A CA  
2912 C  C   . ALA A 197 ? 0.28620 0.25330 0.36250 -0.09350 0.01760  -0.02780 201 ALA A C   
2913 O  O   . ALA A 197 ? 0.27170 0.24960 0.35480 -0.09520 0.02920  -0.03600 201 ALA A O   
2914 C  CB  . ALA A 197 ? 0.30280 0.27440 0.38760 -0.08620 0.01930  -0.00080 201 ALA A CB  
2920 N  N   . PRO A 198 ? 0.30750 0.24860 0.36320 -0.08720 0.01040  -0.04070 202 PRO A N   
2921 C  CA  . PRO A 198 ? 0.29210 0.24840 0.34810 -0.08120 0.00400  -0.05880 202 PRO A CA  
2922 C  C   . PRO A 198 ? 0.25130 0.24930 0.30790 -0.07990 0.00520  -0.06550 202 PRO A C   
2923 O  O   . PRO A 198 ? 0.24060 0.27810 0.29480 -0.07470 0.00430  -0.06090 202 PRO A O   
2924 C  CB  . PRO A 198 ? 0.31870 0.25670 0.35760 -0.07570 -0.00460 -0.06300 202 PRO A CB  
2925 C  CG  . PRO A 198 ? 0.34150 0.26040 0.38230 -0.07380 0.00110  -0.05470 202 PRO A CG  
2926 C  CD  . PRO A 198 ? 0.32860 0.25610 0.36980 -0.07620 0.00860  -0.04950 202 PRO A CD  
2934 N  N   . GLN A 199 ? 0.24980 0.25220 0.28850 -0.06650 0.02490  -0.05080 203 GLN A N   
2935 C  CA  . GLN A 199 ? 0.25100 0.24450 0.27200 -0.06030 0.02080  -0.05310 203 GLN A CA  
2936 C  C   . GLN A 199 ? 0.23740 0.23800 0.25460 -0.06000 0.01290  -0.04340 203 GLN A C   
2937 O  O   . GLN A 199 ? 0.22640 0.23640 0.24610 -0.04310 0.02480  -0.04430 203 GLN A O   
2938 C  CB  . GLN A 199 ? 0.27460 0.25080 0.28120 -0.05200 0.01990  -0.05620 203 GLN A CB  
2939 C  CG  . GLN A 199 ? 0.30490 0.26460 0.28850 -0.04170 0.01770  -0.06240 203 GLN A CG  
2940 C  CD  . GLN A 199 ? 0.32680 0.27920 0.28940 -0.04510 0.00710  -0.06260 203 GLN A CD  
2941 O  OE1 . GLN A 199 ? 0.30810 0.27250 0.29030 -0.05490 0.02470  -0.06080 203 GLN A OE1 
2942 N  NE2 . GLN A 199 ? 0.37730 0.29740 0.30860 -0.04780 -0.00550 -0.06730 203 GLN A NE2 
2951 N  N   A ARG A 200 ? 0.22280 0.23570 0.24970 -0.05560 0.02550  -0.04040 204 ARG A N   
2952 N  N   B ARG A 200 ? 0.22490 0.23170 0.24940 -0.06080 0.02880  -0.03700 204 ARG A N   
2953 C  CA  A ARG A 200 ? 0.22360 0.23150 0.24160 -0.05640 0.02160  -0.03490 204 ARG A CA  
2954 C  CA  B ARG A 200 ? 0.22380 0.22390 0.24220 -0.06580 0.03260  -0.02860 204 ARG A CA  
2955 C  C   A ARG A 200 ? 0.21290 0.22560 0.22750 -0.06550 0.03120  -0.03240 204 ARG A C   
2956 C  C   B ARG A 200 ? 0.21360 0.22310 0.23080 -0.07010 0.03630  -0.02910 204 ARG A C   
2957 O  O   A ARG A 200 ? 0.21240 0.22360 0.23010 -0.05590 0.02500  -0.03280 204 ARG A O   
2958 O  O   B ARG A 200 ? 0.21310 0.22190 0.23160 -0.06340 0.03260  -0.03020 204 ARG A O   
2959 C  CB  A ARG A 200 ? 0.23060 0.24070 0.25390 -0.05630 0.01380  -0.01920 204 ARG A CB  
2960 C  CB  B ARG A 200 ? 0.22830 0.22280 0.25110 -0.07300 0.03760  -0.01060 204 ARG A CB  
2961 C  CG  A ARG A 200 ? 0.23890 0.25560 0.26350 -0.05970 0.00520  -0.00890 204 ARG A CG  
2962 C  CG  B ARG A 200 ? 0.23390 0.22670 0.25900 -0.08060 0.03930  0.00090  204 ARG A CG  
2963 C  CD  A ARG A 200 ? 0.26450 0.27130 0.27100 -0.05890 0.00640  0.00390  204 ARG A CD  
2964 C  CD  B ARG A 200 ? 0.25470 0.23040 0.26690 -0.08160 0.04660  0.01700  204 ARG A CD  
2965 N  NE  A ARG A 200 ? 0.29780 0.27740 0.29400 -0.06720 0.01150  0.01420  204 ARG A NE  
2966 N  NE  B ARG A 200 ? 0.28660 0.23730 0.28570 -0.08300 0.04380  0.02580  204 ARG A NE  
2967 C  CZ  A ARG A 200 ? 0.32510 0.28840 0.32910 -0.06510 0.01640  0.01860  204 ARG A CZ  
2968 C  CZ  B ARG A 200 ? 0.30830 0.25150 0.30850 -0.07540 0.04360  0.02660  204 ARG A CZ  
2969 N  NH1 A ARG A 200 ? 0.34560 0.30030 0.35790 -0.05540 0.02080  0.02170  204 ARG A NH1 
2970 N  NH1 B ARG A 200 ? 0.32070 0.26090 0.32710 -0.07210 0.04560  0.03280  204 ARG A NH1 
2971 N  NH2 A ARG A 200 ? 0.31510 0.28380 0.32370 -0.06330 0.02850  0.01660  204 ARG A NH2 
2972 N  NH2 B ARG A 200 ? 0.32010 0.26230 0.32770 -0.06950 0.04510  0.02960  204 ARG A NH2 
2999 N  N   . GLN A 201 ? 0.20870 0.22890 0.23730 -0.07050 0.03140  -0.02710 205 GLN A N   
3000 C  CA  . GLN A 201 ? 0.20390 0.24570 0.24990 -0.07340 0.01820  -0.02380 205 GLN A CA  
3001 C  C   . GLN A 201 ? 0.19110 0.24450 0.24040 -0.07480 0.01650  -0.02470 205 GLN A C   
3002 O  O   . GLN A 201 ? 0.19040 0.24620 0.22950 -0.05980 0.02170  -0.02990 205 GLN A O   
3003 C  CB  . GLN A 201 ? 0.23110 0.26180 0.26580 -0.07190 0.03340  -0.02230 205 GLN A CB  
3004 C  CG  . GLN A 201 ? 0.22900 0.27460 0.25970 -0.06710 0.05000  -0.02280 205 GLN A CG  
3005 C  CD  . GLN A 201 ? 0.22330 0.29360 0.26530 -0.05920 0.04890  -0.01120 205 GLN A CD  
3006 O  OE1 . GLN A 201 ? 0.26760 0.31400 0.30010 -0.03660 0.04270  -0.00590 205 GLN A OE1 
3007 N  NE2 . GLN A 201 ? 0.22750 0.30300 0.25930 -0.07160 0.02770  -0.01530 205 GLN A NE2 
3017 N  N   . GLN A 202 ? 0.19630 0.24360 0.22810 -0.06830 0.00340  -0.02900 206 GLN A N   
3018 C  CA  . GLN A 202 ? 0.20430 0.24110 0.21860 -0.06010 0.00270  -0.03910 206 GLN A CA  
3019 C  C   . GLN A 202 ? 0.18010 0.23620 0.21700 -0.05130 0.01060  -0.03710 206 GLN A C   
3020 O  O   . GLN A 202 ? 0.18540 0.23750 0.19440 -0.05050 0.01980  -0.03710 206 GLN A O   
3021 C  CB  . GLN A 202 ? 0.21120 0.26080 0.22570 -0.06940 0.02300  -0.05190 206 GLN A CB  
3022 C  CG  . GLN A 202 ? 0.23120 0.28320 0.21850 -0.07480 0.01700  -0.05650 206 GLN A CG  
3023 C  CD  . GLN A 202 ? 0.23920 0.30390 0.23660 -0.07970 -0.00740 -0.05060 206 GLN A CD  
3024 O  OE1 . GLN A 202 ? 0.27590 0.32650 0.29190 -0.07400 -0.04000 -0.06100 206 GLN A OE1 
3025 N  NE2 . GLN A 202 ? 0.23040 0.30940 0.22560 -0.07110 -0.00020 -0.04270 206 GLN A NE2 
3034 N  N   . PHE A 203 ? 0.17030 0.23500 0.21780 -0.04780 0.00990  -0.02470 207 PHE A N   
3035 C  CA  . PHE A 203 ? 0.16210 0.22670 0.20690 -0.05070 0.01050  -0.03240 207 PHE A CA  
3036 C  C   . PHE A 203 ? 0.15050 0.23730 0.20480 -0.04990 0.02110  -0.03230 207 PHE A C   
3037 O  O   . PHE A 203 ? 0.15750 0.24010 0.18750 -0.04850 0.01720  -0.02990 207 PHE A O   
3038 C  CB  . PHE A 203 ? 0.16530 0.22560 0.21260 -0.03820 0.00710  -0.02230 207 PHE A CB  
3039 C  CG  . PHE A 203 ? 0.15860 0.21890 0.19970 -0.02880 0.02730  -0.01810 207 PHE A CG  
3040 C  CD1 . PHE A 203 ? 0.17300 0.21890 0.21350 -0.03850 0.01630  0.00320  207 PHE A CD1 
3041 C  CD2 . PHE A 203 ? 0.15870 0.22270 0.19240 -0.02460 0.03330  -0.02460 207 PHE A CD2 
3042 C  CE1 . PHE A 203 ? 0.17120 0.21180 0.21870 -0.03580 0.01980  0.00990  207 PHE A CE1 
3043 C  CE2 . PHE A 203 ? 0.16410 0.21290 0.19260 -0.02800 0.00810  -0.02260 207 PHE A CE2 
3044 C  CZ  . PHE A 203 ? 0.16480 0.21270 0.19800 -0.03360 0.02460  -0.01700 207 PHE A CZ  
3054 N  N   . VAL A 204 ? 0.15250 0.25320 0.20940 -0.05000 0.01560  -0.03190 208 VAL A N   
3055 C  CA  . VAL A 204 ? 0.16010 0.24750 0.20990 -0.05530 0.02190  -0.02460 208 VAL A CA  
3056 C  C   . VAL A 204 ? 0.16210 0.25100 0.20120 -0.05480 0.01590  -0.01460 208 VAL A C   
3057 O  O   . VAL A 204 ? 0.17010 0.25190 0.20120 -0.05490 0.01780  -0.00830 208 VAL A O   
3058 C  CB  . VAL A 204 ? 0.16820 0.24630 0.21090 -0.05370 0.01790  -0.02750 208 VAL A CB  
3059 C  CG1 . VAL A 204 ? 0.19140 0.24270 0.20890 -0.05140 0.02240  -0.01830 208 VAL A CG1 
3060 C  CG2 . VAL A 204 ? 0.18580 0.25120 0.21730 -0.03500 0.01550  -0.00820 208 VAL A CG2 
3070 N  N   . ASP A 205 ? 0.16310 0.25750 0.19840 -0.04610 0.02510  -0.02700 209 ASP A N   
3071 C  CA  . ASP A 205 ? 0.16110 0.26500 0.20950 -0.05690 0.00640  -0.03670 209 ASP A CA  
3072 C  C   . ASP A 205 ? 0.16150 0.26960 0.20340 -0.05140 0.00250  -0.03390 209 ASP A C   
3073 O  O   . ASP A 205 ? 0.15370 0.27340 0.20080 -0.04140 0.00810  -0.04260 209 ASP A O   
3074 C  CB  . ASP A 205 ? 0.18840 0.28780 0.23960 -0.07540 0.00650  -0.04430 209 ASP A CB  
3075 C  CG  . ASP A 205 ? 0.21520 0.30850 0.27940 -0.08430 0.00530  -0.04870 209 ASP A CG  
3076 O  OD1 . ASP A 205 ? 0.22920 0.31970 0.30530 -0.08090 0.02490  -0.02140 209 ASP A OD1 
3077 O  OD2 . ASP A 205 ? 0.23350 0.31710 0.31870 -0.09450 0.00310  -0.04540 209 ASP A OD2 
3082 N  N   . TRP A 206 ? 0.16660 0.26110 0.18750 -0.06020 0.01230  -0.03320 210 TRP A N   
3083 C  CA  . TRP A 206 ? 0.16830 0.25340 0.17790 -0.05070 0.01130  -0.02450 210 TRP A CA  
3084 C  C   . TRP A 206 ? 0.16340 0.24630 0.17760 -0.03610 0.00850  -0.02020 210 TRP A C   
3085 O  O   . TRP A 206 ? 0.15710 0.25880 0.18090 -0.02630 0.01500  -0.02420 210 TRP A O   
3086 C  CB  . TRP A 206 ? 0.17150 0.26130 0.16160 -0.04850 0.01100  -0.03100 210 TRP A CB  
3087 C  CG  . TRP A 206 ? 0.18500 0.26070 0.17840 -0.06340 0.00540  -0.03390 210 TRP A CG  
3088 C  CD1 . TRP A 206 ? 0.20240 0.27380 0.18880 -0.05220 0.00920  -0.03950 210 TRP A CD1 
3089 C  CD2 . TRP A 206 ? 0.19870 0.26090 0.17360 -0.06280 0.01240  -0.03420 210 TRP A CD2 
3090 N  NE1 . TRP A 206 ? 0.21240 0.27860 0.19460 -0.05010 -0.00510 -0.04730 210 TRP A NE1 
3091 C  CE2 . TRP A 206 ? 0.21960 0.26790 0.18540 -0.06340 0.02470  -0.03410 210 TRP A CE2 
3092 C  CE3 . TRP A 206 ? 0.20820 0.25920 0.16780 -0.05660 0.01870  -0.03010 210 TRP A CE3 
3093 C  CZ2 . TRP A 206 ? 0.24250 0.25890 0.18160 -0.06300 0.01790  -0.02940 210 TRP A CZ2 
3094 C  CZ3 . TRP A 206 ? 0.22710 0.25200 0.18760 -0.05150 0.02810  -0.03860 210 TRP A CZ3 
3095 C  CH2 . TRP A 206 ? 0.24360 0.25690 0.18740 -0.05340 0.02510  -0.03880 210 TRP A CH2 
3106 N  N   . LEU A 207 ? 0.15850 0.23070 0.18030 -0.02850 0.01660  -0.01980 211 LEU A N   
3107 C  CA  . LEU A 207 ? 0.14100 0.22020 0.18440 -0.02440 0.01670  -0.02330 211 LEU A CA  
3108 C  C   . LEU A 207 ? 0.13820 0.22450 0.17270 -0.02480 0.01250  -0.02180 211 LEU A C   
3109 O  O   . LEU A 207 ? 0.14930 0.22130 0.18360 -0.03430 0.01830  -0.01750 211 LEU A O   
3110 C  CB  . LEU A 207 ? 0.15380 0.21220 0.18840 -0.02260 0.00680  -0.03340 211 LEU A CB  
3111 C  CG  . LEU A 207 ? 0.14200 0.20150 0.18470 -0.01870 0.01470  -0.03400 211 LEU A CG  
3112 C  CD1 . LEU A 207 ? 0.15310 0.20810 0.21440 -0.00910 0.02200  -0.01840 211 LEU A CD1 
3113 C  CD2 . LEU A 207 ? 0.14750 0.20270 0.18430 -0.02790 0.00570  -0.02210 211 LEU A CD2 
3125 N  N   . LYS A 208 ? 0.13870 0.24150 0.18530 -0.03590 0.01400  -0.02910 212 LYS A N   
3126 C  CA  . LYS A 208 ? 0.13800 0.24310 0.19640 -0.04500 0.01370  -0.03450 212 LYS A CA  
3127 C  C   . LYS A 208 ? 0.13760 0.26270 0.20940 -0.02560 -0.00850 -0.04450 212 LYS A C   
3128 O  O   . LYS A 208 ? 0.15460 0.27060 0.22720 -0.01830 0.00770  -0.03580 212 LYS A O   
3129 C  CB  . LYS A 208 ? 0.15910 0.24090 0.21230 -0.05010 0.02890  -0.03850 212 LYS A CB  
3130 C  CG  . LYS A 208 ? 0.20030 0.25660 0.23170 -0.05950 0.05470  -0.02430 212 LYS A CG  
3131 C  CD  . LYS A 208 ? 0.23280 0.27450 0.25430 -0.05900 0.05510  -0.02060 212 LYS A CD  
3132 C  CE  . LYS A 208 ? 0.24640 0.29030 0.29060 -0.07850 0.04450  -0.02120 212 LYS A CE  
3133 N  NZ  . LYS A 208 ? 0.24450 0.29790 0.30050 -0.09980 0.07850  -0.02570 212 LYS A NZ  
3147 N  N   . GLY A 209 ? 0.13730 0.26700 0.19640 -0.03830 -0.01400 -0.05010 213 GLY A N   
3148 C  CA  . GLY A 209 ? 0.14050 0.27240 0.20700 -0.03080 -0.00930 -0.02820 213 GLY A CA  
3149 C  C   . GLY A 209 ? 0.13480 0.26640 0.19740 -0.03120 -0.00110 -0.02430 213 GLY A C   
3150 O  O   . GLY A 209 ? 0.15130 0.27790 0.20360 -0.02620 -0.01030 -0.03050 213 GLY A O   
3154 N  N   . ASN A 210 ? 0.13420 0.25350 0.18470 -0.03500 0.00590  -0.03440 214 ASN A N   
3155 C  CA  . ASN A 210 ? 0.12400 0.24930 0.18550 -0.02680 -0.00450 -0.02480 214 ASN A CA  
3156 C  C   . ASN A 210 ? 0.14180 0.25690 0.16280 -0.00790 -0.00120 -0.02500 214 ASN A C   
3157 O  O   . ASN A 210 ? 0.15180 0.26250 0.16460 -0.00980 0.00980  -0.01690 214 ASN A O   
3158 C  CB  . ASN A 210 ? 0.12600 0.25100 0.18830 -0.03130 -0.01750 -0.01710 214 ASN A CB  
3159 C  CG  . ASN A 210 ? 0.12070 0.24600 0.16280 -0.02460 -0.01280 -0.01140 214 ASN A CG  
3160 O  OD1 . ASN A 210 ? 0.14050 0.24300 0.16000 -0.01400 -0.00510 -0.00100 214 ASN A OD1 
3161 N  ND2 . ASN A 210 ? 0.13700 0.24050 0.16680 -0.01770 -0.01440 -0.01600 214 ASN A ND2 
3168 N  N   . THR A 211 ? 0.14960 0.25580 0.16390 -0.00110 0.00060  -0.00930 215 THR A N   
3169 C  CA  . THR A 211 ? 0.15020 0.26120 0.18510 -0.00110 -0.00580 0.00880  215 THR A CA  
3170 C  C   . THR A 211 ? 0.13600 0.25980 0.18840 0.00250  -0.00820 0.01210  215 THR A C   
3171 O  O   . THR A 211 ? 0.14830 0.26580 0.19460 0.01000  -0.01550 0.01710  215 THR A O   
3172 C  CB  . THR A 211 ? 0.14310 0.27890 0.19740 0.00170  -0.01230 0.00420  215 THR A CB  
3173 O  OG1 . THR A 211 ? 0.16240 0.29200 0.17920 0.00700  -0.02620 0.01140  215 THR A OG1 
3174 C  CG2 . THR A 211 ? 0.15700 0.28430 0.22750 0.00520  -0.01560 -0.00440 215 THR A CG2 
3182 N  N   . THR A 212 ? 0.13130 0.25080 0.16040 -0.00840 -0.00380 0.01100  216 THR A N   
3183 C  CA  . THR A 212 ? 0.13000 0.23980 0.16900 -0.01180 -0.01490 0.02170  216 THR A CA  
3184 C  C   . THR A 212 ? 0.13310 0.23120 0.17780 -0.00590 -0.00400 0.00190  216 THR A C   
3185 O  O   . THR A 212 ? 0.15380 0.22890 0.19140 -0.00960 -0.00700 0.01140  216 THR A O   
3186 C  CB  . THR A 212 ? 0.13920 0.24810 0.17400 -0.00850 -0.01520 0.01820  216 THR A CB  
3187 O  OG1 . THR A 212 ? 0.13760 0.24950 0.17840 -0.00900 -0.00460 0.00030  216 THR A OG1 
3188 C  CG2 . THR A 212 ? 0.18310 0.25770 0.19650 -0.01560 -0.00890 0.01310  216 THR A CG2 
3196 N  N   . GLY A 213 ? 0.13800 0.22500 0.17370 -0.00220 -0.00390 0.00140  217 GLY A N   
3197 C  CA  . GLY A 213 ? 0.14240 0.21880 0.16780 0.00290  0.00500  -0.01650 217 GLY A CA  
3198 C  C   . GLY A 213 ? 0.12570 0.22840 0.18900 0.00500  -0.00230 -0.00950 217 GLY A C   
3199 O  O   . GLY A 213 ? 0.14530 0.22910 0.17450 0.00540  0.00440  0.00650  217 GLY A O   
3203 N  N   . ASN A 214 ? 0.12230 0.24420 0.19460 0.00310  0.00920  -0.01010 218 ASN A N   
3204 C  CA  . ASN A 214 ? 0.13000 0.25330 0.20570 0.01640  0.00680  0.00510  218 ASN A CA  
3205 C  C   . ASN A 214 ? 0.14670 0.24720 0.20190 0.00730  0.01810  0.00140  218 ASN A C   
3206 O  O   . ASN A 214 ? 0.16190 0.26500 0.20680 -0.00880 0.02600  -0.00960 218 ASN A O   
3207 C  CB  . ASN A 214 ? 0.13700 0.28310 0.22060 0.01020  0.00000  0.00240  218 ASN A CB  
3208 C  CG  . ASN A 214 ? 0.15380 0.30910 0.28340 -0.00430 -0.03250 -0.01480 218 ASN A CG  
3209 O  OD1 . ASN A 214 ? 0.15320 0.31950 0.29060 -0.01060 -0.00500 -0.04280 218 ASN A OD1 
3210 N  ND2 . ASN A 214 ? 0.24130 0.33520 0.32400 -0.01280 -0.07280 -0.02140 218 ASN A ND2 
3217 N  N   . HIS A 215 ? 0.14890 0.22410 0.18460 0.01580  0.01710  -0.00540 219 HIS A N   
3218 C  CA  . HIS A 215 ? 0.16740 0.21630 0.19880 0.02890  0.01640  -0.00170 219 HIS A CA  
3219 C  C   . HIS A 215 ? 0.14350 0.20450 0.18330 0.01590  0.02330  -0.01110 219 HIS A C   
3220 O  O   . HIS A 215 ? 0.16690 0.20500 0.20170 0.01200  0.01180  -0.02020 219 HIS A O   
3221 C  CB  . HIS A 215 ? 0.18820 0.24440 0.22390 0.02870  0.00030  0.01040  219 HIS A CB  
3222 C  CG  . HIS A 215 ? 0.21980 0.28170 0.26810 0.04290  -0.00670 0.02370  219 HIS A CG  
3223 N  ND1 . HIS A 215 ? 0.22170 0.31000 0.31330 0.05900  -0.01480 0.02500  219 HIS A ND1 
3224 C  CD2 . HIS A 215 ? 0.26420 0.31030 0.29890 0.05170  -0.03240 0.02790  219 HIS A CD2 
3225 C  CE1 . HIS A 215 ? 0.23740 0.32400 0.32320 0.06840  -0.03020 0.03280  219 HIS A CE1 
3226 N  NE2 . HIS A 215 ? 0.26670 0.32710 0.31510 0.06670  -0.04070 0.03000  219 HIS A NE2 
3234 N  N   . ARG A 216 ? 0.12990 0.20140 0.17070 0.02510  0.01160  0.00000  220 ARG A N   
3235 C  CA  . ARG A 216 ? 0.13140 0.19410 0.17560 0.00930  0.01520  -0.00480 220 ARG A CA  
3236 C  C   . ARG A 216 ? 0.12760 0.19480 0.16440 -0.00170 0.01900  0.00170  220 ARG A C   
3237 O  O   . ARG A 216 ? 0.13410 0.20560 0.16810 -0.01010 0.02170  -0.00820 220 ARG A O   
3238 C  CB  . ARG A 216 ? 0.12590 0.18800 0.17090 0.00340  0.00470  -0.00260 220 ARG A CB  
3239 C  CG  . ARG A 216 ? 0.12910 0.19930 0.17270 0.00480  0.00040  0.00010  220 ARG A CG  
3240 C  CD  . ARG A 216 ? 0.13990 0.19800 0.16790 0.00150  0.01070  0.00730  220 ARG A CD  
3241 N  NE  . ARG A 216 ? 0.13570 0.20320 0.16520 0.00510  0.01610  0.00870  220 ARG A NE  
3242 C  CZ  . ARG A 216 ? 0.13300 0.20520 0.16720 -0.00120 -0.00170 0.02170  220 ARG A CZ  
3243 N  NH1 . ARG A 216 ? 0.13760 0.19890 0.15810 -0.00760 0.00220  0.01020  220 ARG A NH1 
3244 N  NH2 . ARG A 216 ? 0.15110 0.21910 0.19560 0.00040  0.00900  0.02730  220 ARG A NH2 
3258 N  N   . ILE A 217 ? 0.11990 0.19390 0.16580 -0.00710 0.01730  0.01840  221 ILE A N   
3259 C  CA  . ILE A 217 ? 0.13490 0.19370 0.14860 -0.00430 0.02470  -0.00430 221 ILE A CA  
3260 C  C   . ILE A 217 ? 0.14160 0.20340 0.15840 -0.00640 0.02090  0.00500  221 ILE A C   
3261 O  O   . ILE A 217 ? 0.14230 0.21990 0.15120 0.00240  0.03890  0.01090  221 ILE A O   
3262 C  CB  . ILE A 217 ? 0.13260 0.20080 0.15970 -0.00650 0.01540  -0.00280 221 ILE A CB  
3263 C  CG1 . ILE A 217 ? 0.14290 0.21350 0.16400 0.00680  0.01040  0.00080  221 ILE A CG1 
3264 C  CG2 . ILE A 217 ? 0.14080 0.20570 0.16580 0.00340  0.01670  0.01200  221 ILE A CG2 
3265 C  CD1 . ILE A 217 ? 0.14710 0.21260 0.15960 0.00210  0.01960  0.00680  221 ILE A CD1 
3277 N  N   . ARG A 218 ? 0.14040 0.21300 0.16200 -0.00720 0.02700  0.01500  222 ARG A N   
3278 C  CA  . ARG A 218 ? 0.12930 0.21920 0.18660 0.00250  0.00580  0.01360  222 ARG A CA  
3279 C  C   . ARG A 218 ? 0.12470 0.21470 0.19450 -0.00640 0.01540  0.01780  222 ARG A C   
3280 O  O   . ARG A 218 ? 0.13980 0.22260 0.19260 -0.01580 0.01580  0.01740  222 ARG A O   
3281 C  CB  . ARG A 218 ? 0.13440 0.22760 0.20420 -0.00670 0.01440  0.00850  222 ARG A CB  
3282 C  CG  . ARG A 218 ? 0.13650 0.22930 0.20030 -0.00720 0.00530  0.00780  222 ARG A CG  
3283 C  CD  . ARG A 218 ? 0.15760 0.23690 0.19840 -0.00740 -0.00800 0.00170  222 ARG A CD  
3284 N  NE  . ARG A 218 ? 0.15100 0.24840 0.18910 -0.02930 0.01120  -0.00340 222 ARG A NE  
3285 C  CZ  . ARG A 218 ? 0.16780 0.26450 0.19790 -0.03530 0.02220  0.00100  222 ARG A CZ  
3286 N  NH1 . ARG A 218 ? 0.16420 0.28320 0.22870 -0.04300 0.02980  -0.02250 222 ARG A NH1 
3287 N  NH2 . ARG A 218 ? 0.19000 0.25900 0.21380 -0.01630 0.03600  0.00310  222 ARG A NH2 
3301 N  N   . ALA A 219 ? 0.13470 0.20170 0.18500 0.00440  0.02770  0.01070  223 ALA A N   
3302 C  CA  . ALA A 219 ? 0.14910 0.22270 0.20510 -0.00040 0.02220  0.01070  223 ALA A CA  
3303 C  C   . ALA A 219 ? 0.17200 0.24670 0.20820 0.01520  0.03240  -0.00870 223 ALA A C   
3304 O  O   . ALA A 219 ? 0.20680 0.27280 0.22130 0.04350  0.04990  -0.02140 223 ALA A O   
3305 C  CB  . ALA A 219 ? 0.16910 0.22070 0.21240 0.01560  0.03140  -0.00830 223 ALA A CB  
3311 N  N   . ALA A 220 ? 0.15560 0.24980 0.19150 0.01470  0.01930  -0.00720 224 ALA A N   
3312 C  CA  . ALA A 220 ? 0.16450 0.27540 0.18890 0.01000  0.01510  -0.00640 224 ALA A CA  
3313 C  C   . ALA A 220 ? 0.16290 0.29450 0.18210 0.00590  0.03500  0.01910  224 ALA A C   
3314 O  O   . ALA A 220 ? 0.21660 0.32360 0.19760 0.00510  0.02000  0.04630  224 ALA A O   
3315 C  CB  . ALA A 220 ? 0.17170 0.28240 0.21300 -0.00440 -0.00780 -0.01350 224 ALA A CB  
3321 N  N   . VAL A 221 ? 0.15340 0.28460 0.19400 -0.00690 0.01820  0.02230  225 VAL A N   
3322 C  CA  . VAL A 221 ? 0.16540 0.28610 0.22110 -0.02520 0.04370  0.04580  225 VAL A CA  
3323 C  C   . VAL A 221 ? 0.17070 0.29070 0.23490 -0.02230 0.04860  0.05500  225 VAL A C   
3324 O  O   . VAL A 221 ? 0.16560 0.29420 0.26160 -0.01660 0.04430  0.05960  225 VAL A O   
3325 C  CB  . VAL A 221 ? 0.16340 0.27250 0.23460 -0.01610 0.03720  0.03950  225 VAL A CB  
3326 C  CG1 . VAL A 221 ? 0.18100 0.27480 0.26060 -0.02920 0.03610  0.02980  225 VAL A CG1 
3327 C  CG2 . VAL A 221 ? 0.17430 0.27400 0.24690 0.00700  0.03920  0.03730  225 VAL A CG2 
3337 N  N   . PRO A 222 ? 0.16930 0.29670 0.21020 -0.01920 0.03700  0.04340  226 PRO A N   
3338 C  CA  . PRO A 222 ? 0.17390 0.29980 0.21850 -0.02070 0.04150  0.05660  226 PRO A CA  
3339 C  C   . PRO A 222 ? 0.17240 0.29950 0.21650 -0.01400 0.03700  0.07220  226 PRO A C   
3340 O  O   . PRO A 222 ? 0.16150 0.30650 0.20840 -0.01980 0.04680  0.05380  226 PRO A O   
3341 C  CB  . PRO A 222 ? 0.19190 0.30400 0.21720 -0.02730 0.04890  0.05030  226 PRO A CB  
3342 C  CG  . PRO A 222 ? 0.20090 0.30420 0.20370 -0.01380 0.03690  0.05850  226 PRO A CG  
3343 C  CD  . PRO A 222 ? 0.20190 0.30460 0.20880 -0.01320 0.04580  0.04700  226 PRO A CD  
3351 N  N   . ALA A 223 ? 0.17340 0.30220 0.23550 -0.00430 0.03230  0.06800  227 ALA A N   
3352 C  CA  . ALA A 223 ? 0.19710 0.32480 0.24410 -0.00420 0.02350  0.06530  227 ALA A CA  
3353 C  C   . ALA A 223 ? 0.19060 0.33270 0.21700 -0.00790 0.01400  0.04370  227 ALA A C   
3354 O  O   . ALA A 223 ? 0.23140 0.35970 0.20470 -0.02130 0.01800  0.03780  227 ALA A O   
3355 C  CB  . ALA A 223 ? 0.23750 0.34030 0.27850 0.00670  -0.00740 0.05900  227 ALA A CB  
3361 N  N   . ASP A 224 ? 0.15880 0.30960 0.18890 0.00280  0.00970  0.03190  228 ASP A N   
3362 C  CA  . ASP A 224 ? 0.15930 0.28200 0.18380 -0.00640 0.01060  0.00110  228 ASP A CA  
3363 C  C   . ASP A 224 ? 0.16770 0.27520 0.20850 -0.00390 0.02310  0.01030  228 ASP A C   
3364 O  O   . ASP A 224 ? 0.17640 0.28690 0.21980 -0.00930 0.00520  0.03150  228 ASP A O   
3365 C  CB  . ASP A 224 ? 0.14960 0.27060 0.16660 -0.01680 0.00920  0.01620  228 ASP A CB  
3366 C  CG  . ASP A 224 ? 0.16260 0.26090 0.17310 -0.02320 0.02840  0.02280  228 ASP A CG  
3367 O  OD1 . ASP A 224 ? 0.16550 0.25530 0.16780 -0.02210 0.02510  0.02240  228 ASP A OD1 
3368 O  OD2 . ASP A 224 ? 0.18230 0.25980 0.19250 -0.03850 0.00200  0.01090  228 ASP A OD2 
3373 N  N   . TRP A 225 ? 0.16220 0.26210 0.18500 0.00240  0.02600  0.00180  229 TRP A N   
3374 C  CA  . TRP A 225 ? 0.16380 0.26260 0.19410 0.00870  0.02970  0.00070  229 TRP A CA  
3375 C  C   . TRP A 225 ? 0.19830 0.27480 0.17820 0.01580  0.01590  0.01270  229 TRP A C   
3376 O  O   . TRP A 225 ? 0.27680 0.30300 0.19450 0.03920  0.03690  0.01640  229 TRP A O   
3377 C  CB  . TRP A 225 ? 0.15880 0.26360 0.17190 0.00160  0.03600  0.00610  229 TRP A CB  
3378 C  CG  . TRP A 225 ? 0.14960 0.27470 0.18350 -0.01130 0.01970  0.01010  229 TRP A CG  
3379 C  CD1 . TRP A 225 ? 0.14950 0.27960 0.18330 -0.02570 0.01900  0.00980  229 TRP A CD1 
3380 C  CD2 . TRP A 225 ? 0.13350 0.28090 0.21890 -0.02130 0.01340  0.00150  229 TRP A CD2 
3381 N  NE1 . TRP A 225 ? 0.16430 0.28270 0.19910 -0.01690 0.02600  -0.00090 229 TRP A NE1 
3382 C  CE2 . TRP A 225 ? 0.15330 0.28840 0.21370 -0.02140 0.00800  -0.01240 229 TRP A CE2 
3383 C  CE3 . TRP A 225 ? 0.14310 0.28620 0.26100 -0.02080 0.01310  -0.01820 229 TRP A CE3 
3384 C  CZ2 . TRP A 225 ? 0.16730 0.30490 0.22870 -0.01810 0.00120  -0.02320 229 TRP A CZ2 
3385 C  CZ3 . TRP A 225 ? 0.16950 0.29770 0.27230 -0.03910 0.00670  -0.04560 229 TRP A CZ3 
3386 C  CH2 . TRP A 225 ? 0.17510 0.31200 0.25670 -0.02960 -0.01020 -0.03820 229 TRP A CH2 
3397 N  N   . ALA A 226 ? 0.16750 0.26140 0.16810 -0.01610 0.03810  -0.00340 230 ALA A N   
3398 C  CA  . ALA A 226 ? 0.15380 0.26530 0.17360 -0.03170 0.04550  -0.01700 230 ALA A CA  
3399 C  C   . ALA A 226 ? 0.15460 0.26550 0.16120 -0.02150 0.02260  -0.00700 230 ALA A C   
3400 O  O   . ALA A 226 ? 0.15890 0.24990 0.16690 -0.01850 0.00730  0.00990  230 ALA A O   
3401 C  CB  . ALA A 226 ? 0.16210 0.28120 0.19930 -0.03790 0.02660  -0.02780 230 ALA A CB  
3407 N  N   . VAL A 227 ? 0.12910 0.27560 0.16050 -0.01270 0.01470  0.01360  231 VAL A N   
3408 C  CA  . VAL A 227 ? 0.13520 0.26090 0.16540 -0.01620 0.02570  -0.00250 231 VAL A CA  
3409 C  C   . VAL A 227 ? 0.14360 0.24580 0.16860 -0.02080 0.02090  -0.00210 231 VAL A C   
3410 O  O   . VAL A 227 ? 0.15200 0.24970 0.17400 -0.01210 0.01000  0.00830  231 VAL A O   
3411 C  CB  . VAL A 227 ? 0.15710 0.27020 0.18410 -0.01660 0.00210  -0.01660 231 VAL A CB  
3412 C  CG1 . VAL A 227 ? 0.19930 0.28530 0.20330 -0.01490 -0.00010 -0.00660 231 VAL A CG1 
3413 C  CG2 . VAL A 227 ? 0.17170 0.25930 0.19940 -0.02970 -0.00260 -0.03660 231 VAL A CG2 
3423 N  N   . GLY A 228 ? 0.12930 0.22830 0.17830 -0.02300 0.02330  0.00290  232 GLY A N   
3424 C  CA  . GLY A 228 ? 0.15620 0.22300 0.16850 -0.03300 0.02050  0.00210  232 GLY A CA  
3425 C  C   . GLY A 228 ? 0.14300 0.21410 0.16200 -0.04340 0.01950  0.00070  232 GLY A C   
3426 O  O   . GLY A 228 ? 0.13840 0.23830 0.16580 -0.03800 -0.00380 0.00910  232 GLY A O   
3431 N  N   . ASP A 229 ? 0.12670 0.21280 0.15920 -0.03220 0.00720  0.00740  233 ASP A N   
3432 C  CA  . ASP A 229 ? 0.12010 0.20320 0.14330 -0.02860 0.01640  -0.00700 233 ASP A CA  
3433 C  C   . ASP A 229 ? 0.13600 0.21090 0.14520 -0.03270 0.01090  -0.00810 233 ASP A C   
3434 O  O   . ASP A 229 ? 0.12820 0.22450 0.15230 -0.02330 0.00370  -0.00490 233 ASP A O   
3435 C  CB  . ASP A 229 ? 0.13720 0.20260 0.14290 -0.03240 0.00910  -0.00610 233 ASP A CB  
3436 C  CG  . ASP A 229 ? 0.12000 0.21740 0.15570 -0.02590 0.00650  -0.01420 233 ASP A CG  
3437 O  OD1 . ASP A 229 ? 0.12080 0.23080 0.14940 -0.02300 0.00320  -0.01030 233 ASP A OD1 
3438 O  OD2 . ASP A 229 ? 0.12040 0.21380 0.16350 -0.01920 0.00190  -0.01020 233 ASP A OD2 
3443 N  N   . LYS A 230 ? 0.12980 0.20040 0.13760 -0.03270 -0.00210 0.00570  234 LYS A N   
3444 C  CA  . LYS A 230 ? 0.10930 0.19290 0.14860 -0.02510 0.00130  -0.00560 234 LYS A CA  
3445 C  C   . LYS A 230 ? 0.11500 0.19150 0.13400 -0.00930 0.00190  -0.00090 234 LYS A C   
3446 O  O   . LYS A 230 ? 0.12820 0.19530 0.13580 -0.00750 0.00000  -0.00730 234 LYS A O   
3447 C  CB  . LYS A 230 ? 0.12780 0.19690 0.15630 -0.01920 0.00670  -0.01000 234 LYS A CB  
3448 C  CG  . LYS A 230 ? 0.14280 0.22090 0.14060 -0.02470 0.01210  -0.00930 234 LYS A CG  
3449 C  CD  . LYS A 230 ? 0.15730 0.23960 0.15060 -0.03930 0.01540  -0.00780 234 LYS A CD  
3450 C  CE  . LYS A 230 ? 0.15290 0.24350 0.14580 -0.03980 -0.01090 -0.00760 234 LYS A CE  
3451 N  NZ  . LYS A 230 ? 0.13940 0.25950 0.14690 -0.03720 -0.00710 -0.01180 234 LYS A NZ  
3465 N  N   . THR A 231 ? 0.11390 0.20010 0.13410 -0.01770 -0.00700 0.00710  235 THR A N   
3466 C  CA  . THR A 231 ? 0.11260 0.19310 0.14760 -0.01000 -0.00450 -0.00230 235 THR A CA  
3467 C  C   . THR A 231 ? 0.12160 0.18440 0.13740 -0.00450 -0.00600 -0.00820 235 THR A C   
3468 O  O   . THR A 231 ? 0.13610 0.18830 0.14090 -0.02010 -0.00500 -0.01020 235 THR A O   
3469 C  CB  . THR A 231 ? 0.12550 0.20450 0.15930 -0.00460 0.00510  -0.00270 235 THR A CB  
3470 O  OG1 . THR A 231 ? 0.12640 0.22880 0.15610 -0.00570 -0.01060 0.00210  235 THR A OG1 
3471 C  CG2 . THR A 231 ? 0.13610 0.19060 0.16750 0.00470  -0.00130 -0.00050 235 THR A CG2 
3479 N  N   . GLY A 232 ? 0.12340 0.17910 0.13590 -0.01410 0.00030  -0.00920 236 GLY A N   
3480 C  CA  . GLY A 232 ? 0.11660 0.17490 0.14410 -0.01380 -0.00330 0.00470  236 GLY A CA  
3481 C  C   . GLY A 232 ? 0.11570 0.17350 0.13170 -0.00270 0.00140  0.01870  236 GLY A C   
3482 O  O   . GLY A 232 ? 0.14150 0.18650 0.13780 -0.00980 -0.00430 -0.00010 236 GLY A O   
3486 N  N   . THR A 233 ? 0.12940 0.17280 0.13340 0.00170  0.00050  0.00320  237 THR A N   
3487 C  CA  . THR A 233 ? 0.14540 0.17800 0.15420 -0.00300 -0.00520 0.01910  237 THR A CA  
3488 C  C   . THR A 233 ? 0.15190 0.18920 0.14820 -0.01350 -0.00370 0.00950  237 THR A C   
3489 O  O   . THR A 233 ? 0.16190 0.23770 0.14160 -0.02950 -0.01580 0.02230  237 THR A O   
3490 C  CB  . THR A 233 ? 0.15880 0.19920 0.17760 0.00610  0.00550  0.02980  237 THR A CB  
3491 O  OG1 . THR A 233 ? 0.15040 0.21880 0.18670 0.00530  0.01210  0.03410  237 THR A OG1 
3492 C  CG2 . THR A 233 ? 0.19260 0.20890 0.18360 0.02060  0.01530  0.02480  237 THR A CG2 
3500 N  N   . CYS A 234 ? 0.13420 0.18620 0.15640 -0.02620 -0.00550 0.00900  238 CYS A N   
3501 C  CA  . CYS A 234 ? 0.13670 0.20620 0.16710 -0.01620 -0.00530 0.02290  238 CYS A CA  
3502 C  C   . CYS A 234 ? 0.15590 0.22090 0.18100 -0.01180 -0.02210 0.03210  238 CYS A C   
3503 O  O   . CYS A 234 ? 0.19830 0.23690 0.18230 -0.01860 0.00010  0.05140  238 CYS A O   
3504 C  CB  . CYS A 234 ? 0.13560 0.20670 0.16800 -0.02460 -0.00210 0.01510  238 CYS A CB  
3505 S  SG  . CYS A 234 ? 0.13790 0.19520 0.17810 -0.01670 0.00080  -0.00700 238 CYS A SG  
3510 N  N   . GLY A 235 ? 0.15700 0.20300 0.20650 -0.00280 -0.03750 0.02220  239 GLY A N   
3511 C  CA  . GLY A 235 ? 0.18120 0.20550 0.20500 0.01050  -0.01750 0.02670  239 GLY A CA  
3512 C  C   . GLY A 235 ? 0.17220 0.20600 0.21430 0.01140  -0.00870 0.02750  239 GLY A C   
3513 O  O   . GLY A 235 ? 0.17960 0.21330 0.25060 0.01370  -0.01680 0.04190  239 GLY A O   
3517 N  N   . VAL A 236 ? 0.15940 0.20440 0.19350 -0.00100 -0.01380 0.01190  240 VAL A N   
3518 C  CA  . VAL A 236 ? 0.15330 0.19520 0.19630 -0.00060 -0.00440 0.00620  240 VAL A CA  
3519 C  C   . VAL A 236 ? 0.13130 0.16240 0.18190 -0.00700 0.00330  0.01430  240 VAL A C   
3520 O  O   . VAL A 236 ? 0.15440 0.16290 0.18420 -0.00880 0.00280  0.01760  240 VAL A O   
3521 C  CB  . VAL A 236 ? 0.16630 0.21170 0.20370 0.00060  0.00500  0.01770  240 VAL A CB  
3522 C  CG1 . VAL A 236 ? 0.19680 0.22770 0.21410 -0.01240 -0.00360 0.02990  240 VAL A CG1 
3523 C  CG2 . VAL A 236 ? 0.17100 0.22570 0.21980 -0.00160 0.00650  -0.00030 240 VAL A CG2 
3533 N  N   . TYR A 237 ? 0.14080 0.16370 0.19310 -0.00250 -0.00930 0.03010  241 TYR A N   
3534 C  CA  . TYR A 237 ? 0.15220 0.16000 0.17020 -0.00750 0.00370  0.01840  241 TYR A CA  
3535 C  C   . TYR A 237 ? 0.15310 0.16380 0.17230 -0.00780 -0.00300 -0.00370 241 TYR A C   
3536 O  O   . TYR A 237 ? 0.15490 0.16310 0.16700 -0.00670 0.00070  0.00540  241 TYR A O   
3537 C  CB  . TYR A 237 ? 0.16310 0.16080 0.16910 -0.00840 0.00000  0.03010  241 TYR A CB  
3538 C  CG  . TYR A 237 ? 0.15400 0.14910 0.17000 -0.00440 0.00370  0.01440  241 TYR A CG  
3539 C  CD1 . TYR A 237 ? 0.15190 0.15710 0.17780 0.00150  0.00450  0.00270  241 TYR A CD1 
3540 C  CD2 . TYR A 237 ? 0.14180 0.15720 0.18040 -0.01180 -0.00880 0.00900  241 TYR A CD2 
3541 C  CE1 . TYR A 237 ? 0.13350 0.16130 0.18460 0.00460  0.00180  0.01720  241 TYR A CE1 
3542 C  CE2 . TYR A 237 ? 0.15260 0.15840 0.19040 -0.01600 0.00630  0.01640  241 TYR A CE2 
3543 C  CZ  . TYR A 237 ? 0.13760 0.16150 0.19730 -0.01440 0.01700  0.02110  241 TYR A CZ  
3544 O  OH  . TYR A 237 ? 0.16080 0.18450 0.21840 -0.01510 0.02410  0.01130  241 TYR A OH  
3554 N  N   . GLY A 238 ? 0.15170 0.17330 0.19400 -0.01500 0.00880  -0.00140 242 GLY A N   
3555 C  CA  . GLY A 238 ? 0.15000 0.18180 0.17930 -0.01490 0.02750  -0.01440 242 GLY A CA  
3556 C  C   . GLY A 238 ? 0.15250 0.16910 0.16800 -0.00140 0.01430  -0.01560 242 GLY A C   
3557 O  O   . GLY A 238 ? 0.17920 0.17390 0.17140 -0.01060 0.01610  -0.01270 242 GLY A O   
3561 N  N   . THR A 239 ? 0.14200 0.16410 0.16210 -0.00870 -0.00030 -0.00230 243 THR A N   
3562 C  CA  . THR A 239 ? 0.15020 0.15580 0.15480 -0.02000 0.01200  0.00520  243 THR A CA  
3563 C  C   . THR A 239 ? 0.15080 0.16250 0.14700 -0.02040 0.00580  0.01260  243 THR A C   
3564 O  O   . THR A 239 ? 0.15720 0.18530 0.15040 -0.02180 -0.00800 0.01330  243 THR A O   
3565 C  CB  . THR A 239 ? 0.15450 0.16040 0.15000 -0.02070 0.01180  -0.01480 243 THR A CB  
3566 O  OG1 . THR A 239 ? 0.14430 0.17050 0.15610 -0.01570 0.00700  -0.00340 243 THR A OG1 
3567 C  CG2 . THR A 239 ? 0.15770 0.15810 0.17170 -0.00430 0.01240  -0.01580 243 THR A CG2 
3575 N  N   . ALA A 240 ? 0.13860 0.16130 0.14860 -0.01440 -0.00010 0.00750  244 ALA A N   
3576 C  CA  . ALA A 240 ? 0.13770 0.16180 0.14970 -0.01140 -0.01120 0.01820  244 ALA A CA  
3577 C  C   . ALA A 240 ? 0.12530 0.16470 0.15430 -0.00860 0.00230  0.01050  244 ALA A C   
3578 O  O   . ALA A 240 ? 0.14700 0.18420 0.13870 -0.00780 -0.01560 0.00460  244 ALA A O   
3579 C  CB  . ALA A 240 ? 0.16240 0.17740 0.14820 -0.00170 0.00010  0.01050  244 ALA A CB  
3585 N  N   . ASN A 241 ? 0.12200 0.15750 0.15420 -0.01900 0.00380  0.00460  245 ASN A N   
3586 C  CA  . ASN A 241 ? 0.12700 0.16190 0.15330 -0.02160 0.01240  0.01020  245 ASN A CA  
3587 C  C   . ASN A 241 ? 0.12200 0.15370 0.14980 -0.00850 0.00720  0.00960  245 ASN A C   
3588 O  O   . ASN A 241 ? 0.12540 0.16500 0.13740 -0.00810 -0.00780 0.01540  245 ASN A O   
3589 C  CB  . ASN A 241 ? 0.11600 0.17210 0.14350 -0.01430 0.00790  -0.00680 245 ASN A CB  
3590 C  CG  . ASN A 241 ? 0.12410 0.17830 0.13890 -0.00560 -0.00660 -0.00850 245 ASN A CG  
3591 O  OD1 . ASN A 241 ? 0.13780 0.18030 0.13710 -0.00760 -0.00620 -0.00190 245 ASN A OD1 
3592 N  ND2 . ASN A 241 ? 0.12260 0.18380 0.13690 -0.01100 0.00440  -0.00050 245 ASN A ND2 
3599 N  N   . ASP A 242 ? 0.12150 0.15710 0.14930 -0.00960 0.00280  0.00480  246 ASP A N   
3600 C  CA  . ASP A 242 ? 0.12810 0.15790 0.15140 -0.02100 0.01020  -0.00090 246 ASP A CA  
3601 C  C   . ASP A 242 ? 0.11020 0.16010 0.14370 -0.01820 0.01850  -0.00770 246 ASP A C   
3602 O  O   . ASP A 242 ? 0.13150 0.18530 0.14820 -0.01740 -0.00830 -0.00350 246 ASP A O   
3603 C  CB  . ASP A 242 ? 0.11400 0.17190 0.14250 -0.01020 0.00680  0.01010  246 ASP A CB  
3604 C  CG  . ASP A 242 ? 0.10700 0.19590 0.14830 -0.00080 0.00910  0.00690  246 ASP A CG  
3605 O  OD1 . ASP A 242 ? 0.12370 0.21600 0.14340 -0.01030 0.00570  -0.01220 246 ASP A OD1 
3606 O  OD2 . ASP A 242 ? 0.11840 0.20330 0.14850 -0.00590 0.00240  -0.00100 246 ASP A OD2 
3611 N  N   . TYR A 243 ? 0.12490 0.15960 0.14830 -0.02020 0.01550  -0.00330 247 TYR A N   
3612 C  CA  . TYR A 243 ? 0.12560 0.15970 0.16010 -0.02340 0.00420  -0.00600 247 TYR A CA  
3613 C  C   . TYR A 243 ? 0.11220 0.17370 0.15730 -0.01670 0.01250  0.00340  247 TYR A C   
3614 O  O   . TYR A 243 ? 0.12760 0.18340 0.15690 -0.02020 -0.00810 0.00720  247 TYR A O   
3615 C  CB  . TYR A 243 ? 0.12670 0.16640 0.16690 -0.01320 0.00460  0.00600  247 TYR A CB  
3616 C  CG  . TYR A 243 ? 0.11650 0.17060 0.14760 -0.01320 -0.00790 0.00970  247 TYR A CG  
3617 C  CD1 . TYR A 243 ? 0.13640 0.19320 0.15930 -0.02440 0.00030  0.01210  247 TYR A CD1 
3618 C  CD2 . TYR A 243 ? 0.11430 0.17440 0.16690 -0.01500 -0.00550 0.00130  247 TYR A CD2 
3619 C  CE1 . TYR A 243 ? 0.14320 0.20240 0.15990 -0.02260 -0.00380 0.00340  247 TYR A CE1 
3620 C  CE2 . TYR A 243 ? 0.14810 0.17760 0.14430 -0.01330 -0.00460 -0.00610 247 TYR A CE2 
3621 C  CZ  . TYR A 243 ? 0.14290 0.19830 0.15280 -0.01910 -0.00160 -0.00520 247 TYR A CZ  
3622 O  OH  . TYR A 243 ? 0.15330 0.21050 0.15340 -0.02450 -0.00160 -0.00500 247 TYR A OH  
3632 N  N   . ALA A 244 ? 0.13940 0.18310 0.14410 -0.02070 0.00040  0.00810  248 ALA A N   
3633 C  CA  . ALA A 244 ? 0.13970 0.19140 0.15890 -0.02850 0.01430  0.00710  248 ALA A CA  
3634 C  C   . ALA A 244 ? 0.12500 0.19170 0.16370 -0.02500 0.01620  0.00140  248 ALA A C   
3635 O  O   . ALA A 244 ? 0.12650 0.20850 0.16730 -0.02720 0.00640  0.00540  248 ALA A O   
3636 C  CB  . ALA A 244 ? 0.14100 0.20440 0.15350 -0.02370 0.01220  0.00860  248 ALA A CB  
3642 N  N   A VAL A 245 ? 0.13550 0.19220 0.15680 -0.03150 0.01990  0.01020  249 VAL A N   
3643 N  N   B VAL A 245 ? 0.13440 0.19660 0.16690 -0.03130 0.00900  0.00530  249 VAL A N   
3644 C  CA  A VAL A 245 ? 0.14300 0.19870 0.17100 -0.02640 0.03210  0.01600  249 VAL A CA  
3645 C  CA  B VAL A 245 ? 0.14700 0.20490 0.18220 -0.02810 0.01030  0.01070  249 VAL A CA  
3646 C  C   A VAL A 245 ? 0.13670 0.20580 0.16900 -0.02950 0.02160  0.01340  249 VAL A C   
3647 C  C   B VAL A 245 ? 0.14840 0.21530 0.18540 -0.02560 0.00760  0.01800  249 VAL A C   
3648 O  O   A VAL A 245 ? 0.13790 0.19060 0.15430 -0.03800 0.01350  0.00420  249 VAL A O   
3649 O  O   B VAL A 245 ? 0.15760 0.21280 0.19010 -0.03020 -0.00930 0.01640  249 VAL A O   
3650 C  CB  A VAL A 245 ? 0.17580 0.20220 0.20100 -0.01450 0.01800  0.02600  249 VAL A CB  
3651 C  CB  B VAL A 245 ? 0.16530 0.20350 0.19970 -0.02500 -0.00490 0.01020  249 VAL A CB  
3652 C  CG1 A VAL A 245 ? 0.19680 0.21340 0.20200 -0.01130 0.01130  0.02600  249 VAL A CG1 
3653 C  CG1 B VAL A 245 ? 0.15370 0.20010 0.20060 -0.02580 -0.00880 0.00200  249 VAL A CG1 
3654 C  CG2 A VAL A 245 ? 0.17350 0.20550 0.20490 -0.00640 0.02360  0.03050  249 VAL A CG2 
3655 C  CG2 B VAL A 245 ? 0.18130 0.20790 0.20700 -0.02140 -0.01190 0.01910  249 VAL A CG2 
3674 N  N   . VAL A 246 ? 0.14880 0.22570 0.18380 -0.02520 0.01790  0.03280  250 VAL A N   
3675 C  CA  . VAL A 246 ? 0.12910 0.24490 0.18280 -0.01560 0.02930  0.03710  250 VAL A CA  
3676 C  C   . VAL A 246 ? 0.13260 0.25400 0.18010 -0.01600 0.01620  0.03830  250 VAL A C   
3677 O  O   . VAL A 246 ? 0.13340 0.26460 0.21370 -0.01640 0.01240  0.06170  250 VAL A O   
3678 C  CB  . VAL A 246 ? 0.14880 0.25510 0.18160 -0.00960 0.01750  0.04030  250 VAL A CB  
3679 C  CG1 . VAL A 246 ? 0.18160 0.26280 0.18940 0.00200  0.02250  0.03210  250 VAL A CG1 
3680 C  CG2 . VAL A 246 ? 0.16510 0.25280 0.21570 -0.01740 -0.00030 0.03830  250 VAL A CG2 
3691 N  N   . TRP A 247 ? 0.13020 0.26230 0.19170 -0.03410 0.00040  0.04780  251 TRP A N   
3692 C  CA  . TRP A 247 ? 0.13690 0.26920 0.22370 -0.03300 0.01910  0.04710  251 TRP A CA  
3693 C  C   . TRP A 247 ? 0.13590 0.27040 0.23620 -0.02740 0.01460  0.04950  251 TRP A C   
3694 O  O   . TRP A 247 ? 0.13600 0.26190 0.29640 -0.02440 0.00960  0.03550  251 TRP A O   
3695 C  CB  . TRP A 247 ? 0.15720 0.27690 0.24390 -0.03570 0.01230  0.03600  251 TRP A CB  
3696 C  CG  . TRP A 247 ? 0.16610 0.27350 0.25560 -0.03240 0.01220  0.01130  251 TRP A CG  
3697 C  CD1 . TRP A 247 ? 0.18400 0.27340 0.26580 -0.03400 0.01360  0.01360  251 TRP A CD1 
3698 C  CD2 . TRP A 247 ? 0.16920 0.27110 0.24020 -0.03240 0.00640  -0.00530 251 TRP A CD2 
3699 N  NE1 . TRP A 247 ? 0.19780 0.26400 0.26180 -0.03430 0.00400  -0.00440 251 TRP A NE1 
3700 C  CE2 . TRP A 247 ? 0.17880 0.26910 0.24340 -0.03690 0.01430  -0.00200 251 TRP A CE2 
3701 C  CE3 . TRP A 247 ? 0.17170 0.27800 0.22770 -0.02360 0.00480  -0.01110 251 TRP A CE3 
3702 C  CZ2 . TRP A 247 ? 0.18990 0.27700 0.24690 -0.03530 0.01400  -0.01580 251 TRP A CZ2 
3703 C  CZ3 . TRP A 247 ? 0.18450 0.28420 0.23480 -0.02220 0.00590  -0.01270 251 TRP A CZ3 
3704 C  CH2 . TRP A 247 ? 0.18100 0.28150 0.22520 -0.02920 0.01450  -0.01810 251 TRP A CH2 
3715 N  N   . PRO A 248 ? 0.13340 0.29040 0.22760 -0.00390 0.01480  0.05470  252 PRO A N   
3716 C  CA  . PRO A 248 ? 0.15130 0.29350 0.23480 0.01650  0.04520  0.06840  252 PRO A CA  
3717 C  C   . PRO A 248 ? 0.16500 0.27580 0.29120 0.02490  0.07040  0.06530  252 PRO A C   
3718 O  O   . PRO A 248 ? 0.20550 0.27360 0.40280 0.02300  0.12400  0.09240  252 PRO A O   
3719 C  CB  . PRO A 248 ? 0.16610 0.31490 0.23380 0.02740  0.04980  0.06160  252 PRO A CB  
3720 C  CG  . PRO A 248 ? 0.16360 0.32250 0.23840 0.01800  0.03920  0.04350  252 PRO A CG  
3721 C  CD  . PRO A 248 ? 0.14180 0.31290 0.22230 0.01040  0.02480  0.04440  252 PRO A CD  
3729 N  N   . THR A 249 ? 0.15350 0.27170 0.20490 0.01380  0.03740  0.04950  253 THR A N   
3730 C  CA  . THR A 249 ? 0.16370 0.26860 0.19020 0.00460  0.02580  0.02860  253 THR A CA  
3731 C  C   . THR A 249 ? 0.15470 0.27720 0.21340 0.00570  0.03940  0.03030  253 THR A C   
3732 O  O   . THR A 249 ? 0.16890 0.28900 0.21310 -0.00470 0.01090  0.03090  253 THR A O   
3733 C  CB  . THR A 249 ? 0.16210 0.25620 0.18080 0.00480  0.01340  0.02010  253 THR A CB  
3734 O  OG1 . THR A 249 ? 0.14300 0.24630 0.18620 -0.01330 0.01490  0.00320  253 THR A OG1 
3735 C  CG2 . THR A 249 ? 0.18260 0.26250 0.19360 0.00750  0.00390  0.01530  253 THR A CG2 
3743 N  N   . GLY A 250 ? 0.17660 0.28560 0.25230 0.01070  0.06910  0.04260  254 GLY A N   
3744 C  CA  . GLY A 250 ? 0.17940 0.30570 0.26780 0.01050  0.05720  0.07430  254 GLY A CA  
3745 C  C   . GLY A 250 ? 0.17870 0.32290 0.27090 0.00960  0.04620  0.09720  254 GLY A C   
3746 O  O   . GLY A 250 ? 0.19070 0.34210 0.31590 0.00700  0.04090  0.11750  254 GLY A O   
3750 N  N   . ARG A 251 ? 0.16300 0.31840 0.25350 0.01390  0.03330  0.09550  255 ARG A N   
3751 C  CA  . ARG A 251 ? 0.17680 0.32160 0.23930 0.01750  0.03270  0.09190  255 ARG A CA  
3752 C  C   . ARG A 251 ? 0.17170 0.29920 0.24840 0.00880  0.02440  0.08290  255 ARG A C   
3753 O  O   . ARG A 251 ? 0.17030 0.30860 0.24520 0.00710  0.01320  0.06270  255 ARG A O   
3754 C  CB  . ARG A 251 ? 0.19030 0.33910 0.23380 0.02220  0.03500  0.08500  255 ARG A CB  
3755 C  CG  . ARG A 251 ? 0.21740 0.34980 0.23680 0.02090  0.01600  0.08100  255 ARG A CG  
3756 C  CD  . ARG A 251 ? 0.24230 0.37660 0.25510 0.01030  0.01340  0.05320  255 ARG A CD  
3757 N  NE  . ARG A 251 ? 0.25380 0.39350 0.24750 -0.00100 0.01780  0.03030  255 ARG A NE  
3758 C  CZ  . ARG A 251 ? 0.26020 0.41130 0.27860 -0.00070 0.03740  0.01830  255 ARG A CZ  
3759 N  NH1 . ARG A 251 ? 0.28240 0.41970 0.28370 0.00400  0.05180  0.00960  255 ARG A NH1 
3760 N  NH2 . ARG A 251 ? 0.26830 0.41960 0.30450 -0.01270 0.03440  0.02350  255 ARG A NH2 
3774 N  N   . ALA A 252 ? 0.16300 0.28400 0.25230 0.01350  0.02440  0.08120  256 ALA A N   
3775 C  CA  . ALA A 252 ? 0.16300 0.27140 0.24590 0.01060  0.03220  0.07730  256 ALA A CA  
3776 C  C   . ALA A 252 ? 0.15720 0.25190 0.21990 -0.00280 0.03840  0.04660  256 ALA A C   
3777 O  O   . ALA A 252 ? 0.15920 0.25310 0.21350 0.00070  0.02960  0.03050  256 ALA A O   
3778 C  CB  . ALA A 252 ? 0.17330 0.28470 0.26820 0.02200  0.02900  0.08260  256 ALA A CB  
3784 N  N   . PRO A 253 ? 0.16460 0.24380 0.22950 -0.01370 0.03070  0.03300  257 PRO A N   
3785 C  CA  . PRO A 253 ? 0.16760 0.23360 0.21710 -0.02950 0.02330  0.02870  257 PRO A CA  
3786 C  C   . PRO A 253 ? 0.14840 0.22690 0.20260 -0.02230 0.03000  0.03770  257 PRO A C   
3787 O  O   . PRO A 253 ? 0.14740 0.23250 0.22650 -0.01530 0.02780  0.03350  257 PRO A O   
3788 C  CB  . PRO A 253 ? 0.20560 0.25530 0.23690 -0.03180 0.03150  0.02400  257 PRO A CB  
3789 C  CG  . PRO A 253 ? 0.24100 0.26880 0.24450 -0.00970 0.01800  0.02910  257 PRO A CG  
3790 C  CD  . PRO A 253 ? 0.18480 0.25680 0.25670 -0.02870 0.02650  0.03030  257 PRO A CD  
3798 N  N   . ILE A 254 ? 0.13400 0.21860 0.19460 -0.01770 0.02210  0.05070  258 ILE A N   
3799 C  CA  . ILE A 254 ? 0.13440 0.21690 0.19770 -0.01560 0.02510  0.04170  258 ILE A CA  
3800 C  C   . ILE A 254 ? 0.13090 0.21220 0.18700 -0.00930 0.02500  0.03870  258 ILE A C   
3801 O  O   . ILE A 254 ? 0.14050 0.23330 0.18820 -0.00530 0.00990  0.03070  258 ILE A O   
3802 C  CB  . ILE A 254 ? 0.16090 0.23050 0.21360 -0.01160 0.03580  0.03790  258 ILE A CB  
3803 C  CG1 . ILE A 254 ? 0.20260 0.25870 0.24690 -0.00740 0.03590  0.02490  258 ILE A CG1 
3804 C  CG2 . ILE A 254 ? 0.18560 0.22180 0.20650 -0.01900 0.04450  0.04750  258 ILE A CG2 
3805 C  CD1 . ILE A 254 ? 0.21420 0.27590 0.27920 -0.00070 0.04500  0.01550  258 ILE A CD1 
3817 N  N   A VAL A 255 ? 0.13590 0.20280 0.17330 -0.01510 0.01540  0.03180  259 VAL A N   
3818 N  N   B VAL A 255 ? 0.13310 0.20650 0.17660 -0.01130 0.02600  0.03810  259 VAL A N   
3819 C  CA  A VAL A 255 ? 0.13860 0.19740 0.17310 -0.02210 0.00790  0.01900  259 VAL A CA  
3820 C  CA  B VAL A 255 ? 0.13520 0.20170 0.16820 -0.01360 0.02770  0.03710  259 VAL A CA  
3821 C  C   A VAL A 255 ? 0.15090 0.19240 0.15040 -0.01840 0.01520  0.02780  259 VAL A C   
3822 C  C   B VAL A 255 ? 0.13990 0.19760 0.15980 -0.01740 0.02200  0.02990  259 VAL A C   
3823 O  O   A VAL A 255 ? 0.17030 0.20880 0.17380 -0.02090 -0.01480 0.03710  259 VAL A O   
3824 O  O   B VAL A 255 ? 0.14570 0.20000 0.16770 -0.01710 0.01730  0.03290  259 VAL A O   
3825 C  CB  A VAL A 255 ? 0.15140 0.20960 0.19230 -0.02620 0.01220  0.00850  259 VAL A CB  
3826 C  CB  B VAL A 255 ? 0.13880 0.20330 0.16560 -0.01070 0.03820  0.04560  259 VAL A CB  
3827 C  CG1 A VAL A 255 ? 0.18860 0.22910 0.20820 -0.01740 0.00920  0.00270  259 VAL A CG1 
3828 C  CG1 B VAL A 255 ? 0.13720 0.20180 0.16030 -0.00670 0.05410  0.05140  259 VAL A CG1 
3829 C  CG2 A VAL A 255 ? 0.15360 0.20960 0.21230 -0.02020 0.03060  -0.01330 259 VAL A CG2 
3830 C  CG2 B VAL A 255 ? 0.15090 0.20860 0.17150 -0.00910 0.03440  0.04210  259 VAL A CG2 
3849 N  N   . LEU A 256 ? 0.13580 0.19640 0.15250 -0.02330 0.01380  0.01650  260 LEU A N   
3850 C  CA  . LEU A 256 ? 0.13130 0.18370 0.16940 -0.01440 0.01770  0.01340  260 LEU A CA  
3851 C  C   . LEU A 256 ? 0.12800 0.18930 0.15590 -0.01740 0.00560  0.01580  260 LEU A C   
3852 O  O   . LEU A 256 ? 0.13480 0.19990 0.15900 -0.03290 -0.00170 0.01550  260 LEU A O   
3853 C  CB  . LEU A 256 ? 0.14770 0.19280 0.17050 -0.00800 0.01860  0.00790  260 LEU A CB  
3854 C  CG  . LEU A 256 ? 0.16050 0.21100 0.17490 -0.01050 0.01700  0.00290  260 LEU A CG  
3855 C  CD1 . LEU A 256 ? 0.17450 0.21610 0.21190 0.00010  0.01860  -0.00690 260 LEU A CD1 
3856 C  CD2 . LEU A 256 ? 0.15490 0.22300 0.20550 0.00150  0.00470  -0.00670 260 LEU A CD2 
3869 N  N   . ALA A 257 ? 0.13080 0.19260 0.13810 -0.02500 0.00790  0.01270  261 ALA A N   
3870 C  CA  . ALA A 257 ? 0.13680 0.18550 0.13050 -0.02170 0.00080  0.01190  261 ALA A CA  
3871 C  C   . ALA A 257 ? 0.13780 0.17970 0.13940 -0.02310 0.00210  0.00830  261 ALA A C   
3872 O  O   . ALA A 257 ? 0.13850 0.19400 0.13990 -0.01780 -0.00650 0.00240  261 ALA A O   
3873 C  CB  . ALA A 257 ? 0.16220 0.19100 0.14550 -0.01760 0.00270  0.03210  261 ALA A CB  
3879 N  N   . VAL A 258 ? 0.13570 0.17310 0.13050 -0.01850 0.00290  0.01120  262 VAL A N   
3880 C  CA  . VAL A 258 ? 0.12120 0.17760 0.13100 -0.01110 0.00500  0.00150  262 VAL A CA  
3881 C  C   . VAL A 258 ? 0.12940 0.16870 0.14020 -0.01360 0.00070  0.00540  262 VAL A C   
3882 O  O   . VAL A 258 ? 0.13960 0.18560 0.13850 -0.02100 -0.00940 0.00810  262 VAL A O   
3883 C  CB  . VAL A 258 ? 0.13540 0.19970 0.15130 0.00190  0.02070  0.01650  262 VAL A CB  
3884 C  CG1 . VAL A 258 ? 0.17960 0.20730 0.14820 0.02570  0.01600  0.01520  262 VAL A CG1 
3885 C  CG2 . VAL A 258 ? 0.13670 0.21510 0.17010 0.01330  0.02320  0.01890  262 VAL A CG2 
3895 N  N   . TYR A 259 ? 0.13320 0.16580 0.12810 -0.02460 -0.00150 -0.00460 263 TYR A N   
3896 C  CA  . TYR A 259 ? 0.12550 0.17300 0.14130 -0.01580 0.00290  0.00870  263 TYR A CA  
3897 C  C   . TYR A 259 ? 0.12340 0.16700 0.14890 -0.01100 -0.00240 0.01550  263 TYR A C   
3898 O  O   . TYR A 259 ? 0.14560 0.17170 0.14330 -0.01120 -0.01460 0.00160  263 TYR A O   
3899 C  CB  . TYR A 259 ? 0.12500 0.17390 0.14180 -0.02420 -0.00840 0.00110  263 TYR A CB  
3900 C  CG  . TYR A 259 ? 0.12330 0.16560 0.13860 -0.01610 -0.00430 -0.00010 263 TYR A CG  
3901 C  CD1 . TYR A 259 ? 0.13810 0.17360 0.13040 -0.02200 0.00530  0.00230  263 TYR A CD1 
3902 C  CD2 . TYR A 259 ? 0.11990 0.16650 0.14030 -0.02030 -0.00630 0.01320  263 TYR A CD2 
3903 C  CE1 . TYR A 259 ? 0.14410 0.16300 0.14160 -0.02000 -0.00560 0.00900  263 TYR A CE1 
3904 C  CE2 . TYR A 259 ? 0.12430 0.15470 0.14100 -0.00940 -0.00410 -0.01570 263 TYR A CE2 
3905 C  CZ  . TYR A 259 ? 0.12700 0.15230 0.15580 -0.02090 -0.01460 -0.00720 263 TYR A CZ  
3906 O  OH  . TYR A 259 ? 0.13400 0.17290 0.15110 -0.02490 0.00340  -0.00490 263 TYR A OH  
3916 N  N   . THR A 260 ? 0.14120 0.15260 0.13160 -0.01670 0.00690  -0.00360 264 THR A N   
3917 C  CA  . THR A 260 ? 0.13090 0.16020 0.14910 -0.00890 -0.00560 -0.00440 264 THR A CA  
3918 C  C   . THR A 260 ? 0.14010 0.16430 0.15040 -0.01850 -0.00160 -0.00270 264 THR A C   
3919 O  O   . THR A 260 ? 0.14200 0.17450 0.15290 -0.01550 0.00330  -0.00540 264 THR A O   
3920 C  CB  . THR A 260 ? 0.13940 0.17870 0.15280 0.00450  -0.00060 -0.01130 264 THR A CB  
3921 O  OG1 . THR A 260 ? 0.14500 0.18460 0.16100 0.00810  -0.01220 -0.02020 264 THR A OG1 
3922 C  CG2 . THR A 260 ? 0.13090 0.18720 0.16570 0.00860  0.02410  -0.00230 264 THR A CG2 
3930 N  N   A ARG A 261 ? 0.13010 0.17060 0.15240 -0.00810 -0.00010 -0.00810 265 ARG A N   
3931 N  N   B ARG A 261 ? 0.14620 0.16800 0.15140 -0.02130 0.00190  -0.00140 265 ARG A N   
3932 C  CA  A ARG A 261 ? 0.12390 0.17710 0.16030 -0.00890 -0.00120 -0.00220 265 ARG A CA  
3933 C  CA  B ARG A 261 ? 0.15200 0.17190 0.15610 -0.03380 0.00380  0.01470  265 ARG A CA  
3934 C  C   A ARG A 261 ? 0.13790 0.17700 0.16240 -0.01710 0.00650  -0.00730 265 ARG A C   
3935 C  C   B ARG A 261 ? 0.15410 0.17460 0.16290 -0.02920 0.00920  -0.00200 265 ARG A C   
3936 O  O   A ARG A 261 ? 0.16710 0.17910 0.16220 -0.01580 0.01790  -0.01370 265 ARG A O   
3937 O  O   B ARG A 261 ? 0.18480 0.17710 0.16240 -0.02540 0.02110  -0.01200 265 ARG A O   
3938 C  CB  A ARG A 261 ? 0.11710 0.19580 0.17030 0.01450  -0.00010 -0.00700 265 ARG A CB  
3939 C  CB  B ARG A 261 ? 0.17700 0.19120 0.17090 -0.03040 0.01770  0.02700  265 ARG A CB  
3940 C  CG  A ARG A 261 ? 0.12020 0.21120 0.18180 0.03150  0.00400  -0.01180 265 ARG A CG  
3941 C  CG  B ARG A 261 ? 0.20230 0.20830 0.19140 -0.02500 0.02410  0.04190  265 ARG A CG  
3942 C  CD  A ARG A 261 ? 0.12750 0.23650 0.20740 0.02960  -0.03920 -0.02440 265 ARG A CD  
3943 C  CD  B ARG A 261 ? 0.22440 0.23490 0.22140 -0.02570 -0.00910 0.03990  265 ARG A CD  
3944 N  NE  A ARG A 261 ? 0.15960 0.25460 0.22620 0.00850  -0.04640 -0.02360 265 ARG A NE  
3945 N  NE  B ARG A 261 ? 0.24010 0.24840 0.22980 -0.04230 -0.02870 0.04750  265 ARG A NE  
3946 C  CZ  A ARG A 261 ? 0.15550 0.26360 0.24670 0.00780  -0.05380 -0.03420 265 ARG A CZ  
3947 C  CZ  B ARG A 261 ? 0.29190 0.26060 0.27480 -0.05550 -0.07190 0.05230  265 ARG A CZ  
3948 N  NH1 A ARG A 261 ? 0.15710 0.25770 0.26310 0.01670  -0.03320 -0.02420 265 ARG A NH1 
3949 N  NH1 B ARG A 261 ? 0.32110 0.26050 0.27790 -0.06770 -0.09580 0.06120  265 ARG A NH1 
3950 N  NH2 A ARG A 261 ? 0.13300 0.26730 0.24250 0.00510  -0.05310 -0.03820 265 ARG A NH2 
3951 N  NH2 B ARG A 261 ? 0.30960 0.27380 0.30420 -0.05420 -0.08300 0.05340  265 ARG A NH2 
3978 N  N   . ALA A 262 ? 0.15840 0.17640 0.15610 -0.03170 0.00410  -0.00820 266 ALA A N   
3979 C  CA  . ALA A 262 ? 0.16330 0.17030 0.18300 -0.02280 0.00260  0.00290  266 ALA A CA  
3980 C  C   . ALA A 262 ? 0.16130 0.17850 0.18220 -0.01900 0.00860  -0.00830 266 ALA A C   
3981 O  O   . ALA A 262 ? 0.15550 0.17690 0.18100 -0.02180 0.00720  0.00680  266 ALA A O   
3982 C  CB  . ALA A 262 ? 0.17150 0.17600 0.20860 -0.02910 0.01850  -0.01090 266 ALA A CB  
3989 N  N   . PRO A 263 ? 0.16050 0.18100 0.18660 -0.01710 0.00850  -0.01350 267 PRO A N   
3990 C  CA  . PRO A 263 ? 0.15470 0.18350 0.17450 -0.01500 0.00530  -0.00430 267 PRO A CA  
3991 C  C   . PRO A 263 ? 0.13540 0.17510 0.17980 -0.01030 0.00550  0.00370  267 PRO A C   
3992 O  O   . PRO A 263 ? 0.14020 0.17500 0.19030 -0.00700 0.00730  0.00370  267 PRO A O   
3993 C  CB  . PRO A 263 ? 0.18200 0.20910 0.17840 -0.03500 0.00930  -0.00240 267 PRO A CB  
3994 C  CG  . PRO A 263 ? 0.21240 0.22710 0.21610 -0.02890 0.02470  -0.02900 267 PRO A CG  
3995 C  CD  . PRO A 263 ? 0.18650 0.19750 0.17670 -0.02030 0.01730  -0.02520 267 PRO A CD  
4003 N  N   . ASN A 264 ? 0.14720 0.17590 0.19580 0.00390  0.01030  0.01040  268 ASN A N   
4004 C  CA  . ASN A 264 ? 0.15900 0.16500 0.20610 0.00130  0.00950  0.01170  268 ASN A CA  
4005 C  C   . ASN A 264 ? 0.14270 0.15980 0.20300 -0.01380 0.00610  0.00370  268 ASN A C   
4006 O  O   . ASN A 264 ? 0.13700 0.17220 0.21190 -0.00420 0.01230  0.00320  268 ASN A O   
4007 C  CB  . ASN A 264 ? 0.18640 0.17610 0.21520 -0.00230 0.01840  0.02290  268 ASN A CB  
4008 C  CG  . ASN A 264 ? 0.24050 0.22350 0.25410 -0.00960 0.01270  0.00020  268 ASN A CG  
4009 O  OD1 . ASN A 264 ? 0.26870 0.22990 0.23240 -0.05410 -0.01630 0.02770  268 ASN A OD1 
4010 N  ND2 . ASN A 264 ? 0.29580 0.25610 0.29340 0.00310  -0.00240 -0.04730 268 ASN A ND2 
4017 N  N   . LYS A 265 ? 0.14270 0.16260 0.19620 -0.01570 0.00730  0.00880  269 LYS A N   
4018 C  CA  . LYS A 265 ? 0.14870 0.17470 0.20410 -0.01110 -0.00120 0.01580  269 LYS A CA  
4019 C  C   . LYS A 265 ? 0.15920 0.18620 0.23310 -0.00790 0.00960  0.02690  269 LYS A C   
4020 O  O   . LYS A 265 ? 0.15900 0.20250 0.24040 -0.02540 -0.02130 0.03420  269 LYS A O   
4021 C  CB  . LYS A 265 ? 0.17080 0.18670 0.18740 -0.01510 0.00380  0.01540  269 LYS A CB  
4022 C  CG  . LYS A 265 ? 0.22220 0.19470 0.19300 -0.03490 -0.01200 0.02270  269 LYS A CG  
4023 C  CD  . LYS A 265 ? 0.28820 0.21660 0.21150 -0.07020 0.00100  0.00050  269 LYS A CD  
4024 C  CE  . LYS A 265 ? 0.35230 0.25080 0.22460 -0.06770 0.04280  0.00530  269 LYS A CE  
4025 N  NZ  . LYS A 265 ? 0.42410 0.27790 0.24020 -0.06880 0.05780  -0.00840 269 LYS A NZ  
4039 N  N   A ASP A 266 ? 0.16500 0.18570 0.26010 0.01750  0.01820  0.03970  270 ASP A N   
4040 N  N   B ASP A 266 ? 0.16270 0.18970 0.23780 -0.00010 0.01010  0.02780  270 ASP A N   
4041 C  CA  A ASP A 266 ? 0.17270 0.19760 0.30830 0.03200  0.01480  0.04820  270 ASP A CA  
4042 C  CA  B ASP A 266 ? 0.16810 0.20180 0.25790 0.00310  0.00420  0.03010  270 ASP A CA  
4043 C  C   A ASP A 266 ? 0.15240 0.19660 0.28750 0.02460  0.01660  0.03440  270 ASP A C   
4044 C  C   B ASP A 266 ? 0.15050 0.19640 0.25870 0.00850  0.01020  0.02520  270 ASP A C   
4045 O  O   A ASP A 266 ? 0.16230 0.21420 0.32180 0.02810  0.01530  0.03350  270 ASP A O   
4046 O  O   B ASP A 266 ? 0.15570 0.20810 0.28300 0.01070  0.00380  0.02180  270 ASP A O   
4047 C  CB  A ASP A 266 ? 0.21460 0.20810 0.36460 0.04480  0.03210  0.06850  270 ASP A CB  
4048 C  CB  B ASP A 266 ? 0.19710 0.22300 0.26160 -0.00420 0.00200  0.03360  270 ASP A CB  
4049 C  CG  A ASP A 266 ? 0.26110 0.20890 0.41450 0.03800  0.02980  0.06540  270 ASP A CG  
4050 C  CG  B ASP A 266 ? 0.24200 0.23750 0.27050 -0.02270 0.00350  0.03040  270 ASP A CG  
4051 O  OD1 A ASP A 266 ? 0.29550 0.21520 0.43510 0.02370  0.02650  0.04350  270 ASP A OD1 
4052 O  OD1 B ASP A 266 ? 0.26230 0.24710 0.27720 -0.02820 -0.00370 0.01790  270 ASP A OD1 
4053 O  OD2 A ASP A 266 ? 0.29100 0.22130 0.44820 0.03460  0.02550  0.08860  270 ASP A OD2 
4054 O  OD2 B ASP A 266 ? 0.26770 0.24630 0.26720 -0.02200 -0.02130 0.03320  270 ASP A OD2 
4063 N  N   . ASP A 267 ? 0.14820 0.18270 0.25280 0.00750  0.02510  0.03290  271 ASP A N   
4064 C  CA  . ASP A 267 ? 0.16200 0.18680 0.24720 0.00960  0.02630  0.01010  271 ASP A CA  
4065 C  C   . ASP A 267 ? 0.16020 0.19240 0.27470 0.00490  0.02540  0.01790  271 ASP A C   
4066 O  O   . ASP A 267 ? 0.17880 0.19890 0.29370 0.00430  -0.00700 0.01740  271 ASP A O   
4067 C  CB  . ASP A 267 ? 0.17660 0.18470 0.22280 0.02050  0.02020  -0.00030 271 ASP A CB  
4068 C  CG  . ASP A 267 ? 0.18220 0.19760 0.22600 0.01790  0.02830  -0.00040 271 ASP A CG  
4069 O  OD1 . ASP A 267 ? 0.23270 0.21350 0.25600 0.01770  0.01010  -0.00010 271 ASP A OD1 
4070 O  OD2 . ASP A 267 ? 0.17650 0.20900 0.21750 0.00290  0.02600  0.00010  271 ASP A OD2 
4075 N  N   . LYS A 268 ? 0.15790 0.20090 0.32300 0.00260  0.01510  0.02680  272 LYS A N   
4076 C  CA  . LYS A 268 ? 0.16040 0.20610 0.34670 0.01140  0.00300  0.04640  272 LYS A CA  
4077 C  C   . LYS A 268 ? 0.16350 0.19790 0.29100 0.00360  0.01760  0.03110  272 LYS A C   
4078 O  O   . LYS A 268 ? 0.21970 0.21130 0.26780 -0.01150 0.01240  0.00890  272 LYS A O   
4079 C  CB  . LYS A 268 ? 0.20220 0.24000 0.42540 0.01130  -0.00050 0.04570  272 LYS A CB  
4080 C  CG  . LYS A 268 ? 0.26390 0.27720 0.48440 0.01390  0.00930  0.04380  272 LYS A CG  
4081 C  CD  . LYS A 268 ? 0.34320 0.30890 0.53340 0.01060  0.01490  0.04520  272 LYS A CD  
4082 C  CE  . LYS A 268 ? 0.39300 0.33620 0.56590 0.00960  0.03240  0.04220  272 LYS A CE  
4083 N  NZ  . LYS A 268 ? 0.40170 0.35190 0.58680 0.01410  0.03750  0.03750  272 LYS A NZ  
4097 N  N   . HIS A 269 ? 0.17570 0.20090 0.24910 -0.00030 0.01610  0.02370  273 HIS A N   
4098 C  CA  . HIS A 269 ? 0.17430 0.20800 0.22730 -0.01380 0.02860  0.01950  273 HIS A CA  
4099 C  C   . HIS A 269 ? 0.15800 0.20350 0.24150 -0.00060 0.02780  0.02180  273 HIS A C   
4100 O  O   . HIS A 269 ? 0.17010 0.21280 0.28210 0.00650  0.03400  0.03120  273 HIS A O   
4101 C  CB  . HIS A 269 ? 0.19220 0.22550 0.22020 -0.00330 0.00940  0.00280  273 HIS A CB  
4102 C  CG  . HIS A 269 ? 0.22630 0.25040 0.20140 -0.00280 0.00890  0.01820  273 HIS A CG  
4103 N  ND1 . HIS A 269 ? 0.29020 0.27740 0.23910 -0.01800 -0.00570 0.01730  273 HIS A ND1 
4104 C  CD2 . HIS A 269 ? 0.23750 0.26760 0.22160 0.00280  -0.00510 0.01730  273 HIS A CD2 
4105 C  CE1 . HIS A 269 ? 0.28400 0.27900 0.25070 -0.01750 -0.02140 0.01070  273 HIS A CE1 
4106 N  NE2 . HIS A 269 ? 0.25820 0.28250 0.23890 0.00150  -0.01220 0.00310  273 HIS A NE2 
4114 N  N   . SER A 270 ? 0.15220 0.19080 0.21610 -0.00730 0.02100  0.01420  274 SER A N   
4115 C  CA  . SER A 270 ? 0.15790 0.20000 0.20870 -0.00280 0.03020  -0.00610 274 SER A CA  
4116 C  C   . SER A 270 ? 0.13700 0.20170 0.22070 0.00710  0.03280  0.00380  274 SER A C   
4117 O  O   . SER A 270 ? 0.14600 0.20200 0.23850 0.00600  0.00990  0.00660  274 SER A O   
4118 C  CB  . SER A 270 ? 0.19710 0.21670 0.21570 -0.01550 0.03580  -0.01900 274 SER A CB  
4119 O  OG  . SER A 270 ? 0.22190 0.23530 0.21160 -0.01770 0.04760  -0.02340 274 SER A OG  
4125 N  N   . GLU A 271 ? 0.14080 0.20450 0.20310 -0.00340 0.01900  -0.00130 275 GLU A N   
4126 C  CA  . GLU A 271 ? 0.14810 0.20430 0.20600 -0.00520 0.01460  -0.00140 275 GLU A CA  
4127 C  C   . GLU A 271 ? 0.14570 0.21220 0.20650 0.01160  0.01720  -0.00130 275 GLU A C   
4128 O  O   . GLU A 271 ? 0.14450 0.21610 0.20780 -0.00090 0.00850  -0.00180 275 GLU A O   
4129 C  CB  . GLU A 271 ? 0.16170 0.21170 0.21380 -0.01140 0.01820  0.00780  275 GLU A CB  
4130 C  CG  . GLU A 271 ? 0.16560 0.21540 0.22040 0.00450  0.01310  0.01720  275 GLU A CG  
4131 C  CD  . GLU A 271 ? 0.17290 0.22590 0.22660 0.01990  0.01220  0.00750  275 GLU A CD  
4132 O  OE1 . GLU A 271 ? 0.17800 0.24700 0.24620 0.03690  -0.01580 0.00090  275 GLU A OE1 
4133 O  OE2 . GLU A 271 ? 0.15700 0.23020 0.23720 0.00770  0.00850  0.00430  275 GLU A OE2 
4140 N  N   . ALA A 272 ? 0.17410 0.22810 0.21460 0.01910  0.03580  0.00910  276 ALA A N   
4141 C  CA  . ALA A 272 ? 0.17140 0.23070 0.22390 0.03330  0.04150  0.01050  276 ALA A CA  
4142 C  C   . ALA A 272 ? 0.17560 0.22650 0.21650 0.00640  0.03480  -0.01770 276 ALA A C   
4143 O  O   . ALA A 272 ? 0.17950 0.21830 0.20470 0.00360  0.03620  -0.01130 276 ALA A O   
4144 C  CB  . ALA A 272 ? 0.20960 0.25080 0.24510 0.04430  0.04900  0.01710  276 ALA A CB  
4150 N  N   A VAL A 273 ? 0.17690 0.22790 0.21180 -0.00740 0.01770  -0.02260 277 VAL A N   
4151 N  N   B VAL A 273 ? 0.18180 0.22160 0.21500 -0.00520 0.03310  -0.01860 277 VAL A N   
4152 C  CA  A VAL A 273 ? 0.16520 0.22740 0.19450 -0.00150 0.01300  -0.03400 277 VAL A CA  
4153 C  CA  B VAL A 273 ? 0.17940 0.21540 0.20550 -0.00250 0.03940  -0.02430 277 VAL A CA  
4154 C  C   A VAL A 273 ? 0.15900 0.22040 0.18300 0.00460  0.00900  -0.03910 277 VAL A C   
4155 C  C   B VAL A 273 ? 0.16220 0.21590 0.18970 0.00270  0.02900  -0.02940 277 VAL A C   
4156 O  O   A VAL A 273 ? 0.17230 0.22720 0.17640 -0.00810 0.00420  -0.03680 277 VAL A O   
4157 O  O   B VAL A 273 ? 0.16710 0.22110 0.18610 -0.01010 0.03110  -0.02350 277 VAL A O   
4158 C  CB  A VAL A 273 ? 0.16860 0.23710 0.21760 0.00180  0.00650  -0.03190 277 VAL A CB  
4159 C  CB  B VAL A 273 ? 0.19930 0.21130 0.23240 -0.00350 0.04780  -0.02080 277 VAL A CB  
4160 C  CG1 A VAL A 273 ? 0.16300 0.24240 0.22560 0.00600  0.01010  -0.01850 277 VAL A CG1 
4161 C  CG1 B VAL A 273 ? 0.21140 0.21270 0.24320 -0.00100 0.05540  -0.01180 277 VAL A CG1 
4162 C  CG2 A VAL A 273 ? 0.19330 0.24310 0.21720 -0.00110 -0.00140 -0.04010 277 VAL A CG2 
4163 C  CG2 B VAL A 273 ? 0.21790 0.20820 0.24300 -0.00710 0.05460  -0.02290 277 VAL A CG2 
4182 N  N   . ILE A 274 ? 0.14500 0.22090 0.18490 0.01010  0.01770  -0.02840 278 ILE A N   
4183 C  CA  . ILE A 274 ? 0.13500 0.22240 0.17280 0.01860  0.01130  -0.00720 278 ILE A CA  
4184 C  C   . ILE A 274 ? 0.13580 0.23330 0.17330 0.01100  0.01780  -0.01100 278 ILE A C   
4185 O  O   . ILE A 274 ? 0.14900 0.23680 0.15760 -0.00650 0.00830  -0.01230 278 ILE A O   
4186 C  CB  . ILE A 274 ? 0.14980 0.21470 0.15960 0.00310  0.01030  -0.00380 278 ILE A CB  
4187 C  CG1 . ILE A 274 ? 0.14110 0.21550 0.17440 0.00500  0.02760  -0.00680 278 ILE A CG1 
4188 C  CG2 . ILE A 274 ? 0.15380 0.21940 0.16870 0.00660  0.00210  -0.01200 278 ILE A CG2 
4189 C  CD1 . ILE A 274 ? 0.15110 0.21740 0.18110 0.00040  0.01170  -0.01250 278 ILE A CD1 
4202 N  N   . ALA A 275 ? 0.13710 0.23990 0.17330 -0.00070 0.01770  -0.00790 279 ALA A N   
4203 C  CA  . ALA A 275 ? 0.13860 0.23630 0.16900 0.00070  0.02050  -0.00720 279 ALA A CA  
4204 C  C   . ALA A 275 ? 0.13670 0.24470 0.16660 0.00500  0.02220  -0.00640 279 ALA A C   
4205 O  O   . ALA A 275 ? 0.15910 0.25160 0.15230 0.00210  0.02410  -0.00510 279 ALA A O   
4206 C  CB  . ALA A 275 ? 0.15750 0.24140 0.17690 -0.00020 0.01810  -0.00940 279 ALA A CB  
4212 N  N   . ALA A 276 ? 0.14900 0.24670 0.16980 0.00780  0.02370  -0.01170 280 ALA A N   
4213 C  CA  . ALA A 276 ? 0.15970 0.23610 0.17010 0.01160  0.02550  -0.01800 280 ALA A CA  
4214 C  C   . ALA A 276 ? 0.15430 0.22770 0.17180 0.00380  0.01510  -0.01450 280 ALA A C   
4215 O  O   . ALA A 276 ? 0.16840 0.22990 0.17620 0.00110  0.02310  -0.01130 280 ALA A O   
4216 C  CB  . ALA A 276 ? 0.16720 0.24740 0.18650 0.00380  0.03470  -0.02870 280 ALA A CB  
4222 N  N   . ALA A 277 ? 0.14220 0.23220 0.17560 0.01050  0.01710  -0.02620 281 ALA A N   
4223 C  CA  . ALA A 277 ? 0.12880 0.22980 0.17400 0.00210  0.01210  -0.01140 281 ALA A CA  
4224 C  C   . ALA A 277 ? 0.14110 0.23310 0.16360 -0.00100 0.02400  -0.00160 281 ALA A C   
4225 O  O   . ALA A 277 ? 0.15840 0.24090 0.15940 0.00330  0.00880  0.00290  281 ALA A O   
4226 C  CB  . ALA A 277 ? 0.13860 0.22940 0.18480 -0.00440 0.00670  -0.00760 281 ALA A CB  
4232 N  N   . ALA A 278 ? 0.14440 0.24290 0.16260 -0.01010 0.00800  -0.00620 282 ALA A N   
4233 C  CA  . ALA A 278 ? 0.15270 0.25700 0.16350 -0.00550 0.01270  -0.00760 282 ALA A CA  
4234 C  C   . ALA A 278 ? 0.15670 0.25830 0.16970 0.00760  0.01440  0.00090  282 ALA A C   
4235 O  O   . ALA A 278 ? 0.18410 0.25380 0.16780 0.00480  0.00950  0.00390  282 ALA A O   
4236 C  CB  . ALA A 278 ? 0.16240 0.26220 0.16470 0.00690  0.00790  -0.00570 282 ALA A CB  
4242 N  N   A ARG A 279 ? 0.15620 0.26300 0.17250 0.01040  0.03270  -0.00310 283 ARG A N   
4243 N  N   B ARG A 279 ? 0.14190 0.26130 0.17480 0.00080  0.00730  -0.00180 283 ARG A N   
4244 C  CA  A ARG A 279 ? 0.16740 0.27250 0.17510 0.01510  0.04930  -0.00540 283 ARG A CA  
4245 C  CA  B ARG A 279 ? 0.15630 0.27270 0.17790 0.00400  0.00500  -0.00110 283 ARG A CA  
4246 C  C   A ARG A 279 ? 0.16590 0.26600 0.16600 0.00300  0.04490  -0.00710 283 ARG A C   
4247 C  C   B ARG A 279 ? 0.15960 0.26730 0.17080 -0.00350 0.03040  -0.00190 283 ARG A C   
4248 O  O   A ARG A 279 ? 0.17960 0.26910 0.16710 0.00020  0.04390  -0.00350 283 ARG A O   
4249 O  O   B ARG A 279 ? 0.19100 0.27690 0.18400 -0.00580 0.03380  0.00830  283 ARG A O   
4250 C  CB  A ARG A 279 ? 0.18440 0.29050 0.18620 0.03020  0.08170  -0.00640 283 ARG A CB  
4251 C  CB  B ARG A 279 ? 0.18350 0.29500 0.19330 0.01340  0.01280  0.00170  283 ARG A CB  
4252 C  CG  A ARG A 279 ? 0.21010 0.30430 0.20710 0.04370  0.09150  -0.00730 283 ARG A CG  
4253 C  CG  B ARG A 279 ? 0.21210 0.31200 0.21570 0.02230  0.01450  0.00580  283 ARG A CG  
4254 C  CD  A ARG A 279 ? 0.24180 0.32050 0.23810 0.05700  0.08000  -0.00240 283 ARG A CD  
4255 C  CD  B ARG A 279 ? 0.22930 0.32570 0.24040 0.02900  0.01090  0.02540  283 ARG A CD  
4256 N  NE  A ARG A 279 ? 0.28170 0.33840 0.27490 0.06170  0.07580  -0.00210 283 ARG A NE  
4257 N  NE  B ARG A 279 ? 0.24280 0.33580 0.26620 0.03480  0.00980  0.03330  283 ARG A NE  
4258 C  CZ  A ARG A 279 ? 0.32190 0.35540 0.30890 0.05470  0.06220  -0.00110 283 ARG A CZ  
4259 C  CZ  B ARG A 279 ? 0.24190 0.34910 0.25150 0.03040  0.02050  0.04090  283 ARG A CZ  
4260 N  NH1 A ARG A 279 ? 0.33870 0.36120 0.32690 0.05430  0.05420  0.00190  283 ARG A NH1 
4261 N  NH1 B ARG A 279 ? 0.22910 0.34700 0.24930 0.02640  0.04440  0.04580  283 ARG A NH1 
4262 N  NH2 A ARG A 279 ? 0.34030 0.36320 0.32270 0.05030  0.05820  0.00070  283 ARG A NH2 
4263 N  NH2 B ARG A 279 ? 0.25270 0.36020 0.25740 0.02020  0.01090  0.02730  283 ARG A NH2 
4290 N  N   . LEU A 280 ? 0.17170 0.26190 0.16340 -0.00540 0.02080  -0.00930 284 LEU A N   
4291 C  CA  . LEU A 280 ? 0.17170 0.25910 0.17040 -0.01240 0.02540  0.00310  284 LEU A CA  
4292 C  C   . LEU A 280 ? 0.16730 0.25760 0.17650 -0.01100 0.02290  -0.01050 284 LEU A C   
4293 O  O   . LEU A 280 ? 0.17440 0.26510 0.18400 -0.02170 0.01170  0.01300  284 LEU A O   
4294 C  CB  . LEU A 280 ? 0.20030 0.26740 0.18050 -0.01400 0.00820  -0.01700 284 LEU A CB  
4295 C  CG  . LEU A 280 ? 0.21600 0.26950 0.18500 -0.01880 -0.00290 -0.02730 284 LEU A CG  
4296 C  CD1 . LEU A 280 ? 0.22400 0.27450 0.20960 -0.01120 0.01290  -0.02670 284 LEU A CD1 
4297 C  CD2 . LEU A 280 ? 0.22080 0.26760 0.20480 -0.01460 0.01200  -0.03580 284 LEU A CD2 
4310 N  N   . ALA A 281 ? 0.16600 0.26440 0.17950 0.00430  0.01310  -0.01410 285 ALA A N   
4311 C  CA  . ALA A 281 ? 0.17690 0.26520 0.18070 0.00400  0.02410  0.00070  285 ALA A CA  
4312 C  C   . ALA A 281 ? 0.17660 0.26650 0.17700 0.00950  0.01650  0.00560  285 ALA A C   
4313 O  O   . ALA A 281 ? 0.18030 0.27220 0.19420 0.01680  0.00960  0.02390  285 ALA A O   
4314 C  CB  . ALA A 281 ? 0.18520 0.26950 0.18310 0.00480  0.04710  0.00590  285 ALA A CB  
4320 N  N   . LEU A 282 ? 0.17660 0.26150 0.19040 0.00040  0.00100  0.00560  286 LEU A N   
4321 C  CA  . LEU A 282 ? 0.17580 0.27670 0.20660 -0.00430 -0.00810 0.00100  286 LEU A CA  
4322 C  C   . LEU A 282 ? 0.18160 0.28470 0.20440 -0.00720 0.02290  0.01270  286 LEU A C   
4323 O  O   . LEU A 282 ? 0.20070 0.29370 0.21980 -0.01200 0.02190  0.01370  286 LEU A O   
4324 C  CB  . LEU A 282 ? 0.20330 0.28870 0.24290 -0.00090 -0.01290 -0.00780 286 LEU A CB  
4325 C  CG  . LEU A 282 ? 0.23820 0.30350 0.26950 0.00700  -0.02970 -0.00950 286 LEU A CG  
4326 C  CD1 . LEU A 282 ? 0.26890 0.30780 0.27510 0.00980  -0.04160 -0.01280 286 LEU A CD1 
4327 C  CD2 . LEU A 282 ? 0.25130 0.31170 0.27400 0.01090  -0.03390 -0.01980 286 LEU A CD2 
4339 N  N   . GLU A 283 ? 0.17740 0.29450 0.19670 -0.00400 0.02590  0.01190  287 GLU A N   
4340 C  CA  . GLU A 283 ? 0.20110 0.31300 0.20840 0.01420  0.04200  -0.00160 287 GLU A CA  
4341 C  C   . GLU A 283 ? 0.20820 0.30550 0.21620 0.01350  0.02930  0.00950  287 GLU A C   
4342 O  O   . GLU A 283 ? 0.20660 0.29650 0.19030 0.01330  0.03830  0.01040  287 GLU A O   
4343 C  CB  . GLU A 283 ? 0.23380 0.34490 0.23310 0.03600  0.05090  -0.00680 287 GLU A CB  
4344 C  CG  . GLU A 283 ? 0.29760 0.38320 0.31350 0.04880  0.03470  -0.01330 287 GLU A CG  
4345 C  CD  . GLU A 283 ? 0.37610 0.42300 0.41340 0.06850  -0.01210 -0.01790 287 GLU A CD  
4346 O  OE1 . GLU A 283 ? 0.40660 0.44200 0.47650 0.05720  0.00250  -0.02830 287 GLU A OE1 
4347 O  OE2 . GLU A 283 ? 0.43460 0.44220 0.44910 0.07270  -0.04460 -0.00870 287 GLU A OE2 
4354 N  N   . GLY A 284 ? 0.17760 0.30500 0.18960 -0.00010 0.02190  0.01290  288 GLY A N   
4355 C  CA  . GLY A 284 ? 0.18560 0.30450 0.20030 -0.00540 0.01450  0.01430  288 GLY A CA  
4356 C  C   . GLY A 284 ? 0.20610 0.30030 0.19400 -0.00090 0.02630  0.02270  288 GLY A C   
4357 O  O   . GLY A 284 ? 0.26180 0.30670 0.21300 0.00380  -0.00200 0.02640  288 GLY A O   
4361 N  N   . LEU A 285 ? 0.19280 0.29630 0.19350 -0.00870 0.03410  0.02920  289 LEU A N   
4362 C  CA  . LEU A 285 ? 0.20470 0.29860 0.20230 -0.01570 0.01730  0.03490  289 LEU A CA  
4363 C  C   . LEU A 285 ? 0.21250 0.31400 0.21940 -0.02180 0.03410  0.04550  289 LEU A C   
4364 O  O   . LEU A 285 ? 0.21790 0.31120 0.22940 -0.01890 0.05810  0.05150  289 LEU A O   
4365 C  CB  . LEU A 285 ? 0.18880 0.28780 0.19410 -0.00930 0.00640  0.02400  289 LEU A CB  
4366 C  CG  . LEU A 285 ? 0.17710 0.27770 0.19450 -0.02300 0.02920  0.02360  289 LEU A CG  
4367 C  CD1 . LEU A 285 ? 0.20320 0.28560 0.19570 -0.02560 0.03920  0.02950  289 LEU A CD1 
4368 C  CD2 . LEU A 285 ? 0.17950 0.27640 0.23040 -0.01680 0.02180  0.02030  289 LEU A CD2 
4380 N  N   . GLY A 286 ? 0.21050 0.33690 0.20680 -0.02500 0.04000  0.03750  290 GLY A N   
4381 C  CA  . GLY A 286 ? 0.22910 0.36550 0.22720 -0.03160 0.04330  0.04890  290 GLY A CA  
4382 C  C   . GLY A 286 ? 0.21880 0.39020 0.27570 -0.02490 0.03420  0.06640  290 GLY A C   
4383 O  O   . GLY A 286 ? 0.23630 0.40600 0.30820 -0.04110 0.02720  0.06170  290 GLY A O   
4387 N  N   . VAL A 287 ? 0.20460 0.39930 0.30570 -0.01080 0.01550  0.05640  291 VAL A N   
4388 C  CA  . VAL A 287 ? 0.21000 0.40320 0.35220 -0.00280 -0.00490 0.05410  291 VAL A CA  
4389 C  C   . VAL A 287 ? 0.21850 0.40280 0.39280 0.00960  -0.00710 0.04570  291 VAL A C   
4390 O  O   . VAL A 287 ? 0.24370 0.40590 0.44270 0.01360  -0.01290 0.05640  291 VAL A O   
4391 C  CB  . VAL A 287 ? 0.22820 0.40510 0.36070 -0.01520 -0.02180 0.05860  291 VAL A CB  
4392 C  CG1 . VAL A 287 ? 0.23850 0.41370 0.38010 -0.01700 -0.04350 0.05570  291 VAL A CG1 
4393 C  CG2 . VAL A 287 ? 0.23140 0.40040 0.34730 -0.02310 -0.00280 0.06580  291 VAL A CG2 
4403 N  N   . ASN A 288 ? 0.21180 0.40060 0.37740 0.02310  -0.01180 0.02030  292 ASN A N   
4404 C  CA  . ASN A 288 ? 0.22730 0.40000 0.35240 0.03210  -0.02110 0.00160  292 ASN A CA  
4405 C  C   . ASN A 288 ? 0.27520 0.41050 0.35440 0.02960  -0.05360 -0.02450 292 ASN A C   
4406 O  O   . ASN A 288 ? 0.30620 0.41010 0.35250 0.01640  -0.03030 -0.03490 292 ASN A O   
4407 C  CB  . ASN A 288 ? 0.22980 0.39720 0.34300 0.01700  -0.01090 -0.00710 292 ASN A CB  
4408 C  CG  . ASN A 288 ? 0.22450 0.39810 0.34820 0.01250  -0.02070 -0.02750 292 ASN A CG  
4409 O  OD1 . ASN A 288 ? 0.28300 0.41040 0.40620 0.00620  -0.04590 -0.03710 292 ASN A OD1 
4410 N  ND2 . ASN A 288 ? 0.17460 0.38940 0.29480 0.01530  -0.00960 -0.02850 292 ASN A ND2 
4417 N  N   . GLY A 289 ? 0.31420 0.41430 0.36600 0.04140  -0.08330 -0.03580 293 GLY A N   
4418 C  CA  . GLY A 289 ? 0.34980 0.42790 0.39150 0.06110  -0.08690 -0.04310 293 GLY A CA  
4419 C  C   . GLY A 289 ? 0.38450 0.43640 0.42120 0.06380  -0.07870 -0.05360 293 GLY A C   
4420 O  O   . GLY A 289 ? 0.41010 0.44940 0.46890 0.05680  -0.06990 -0.05000 293 GLY A O   
4424 C  C1  A GOL B .   ? 0.22800 0.33130 0.29510 -0.05520 0.03980  -0.05790 301 GOL A C1  
4425 C  C1  B GOL B .   ? 0.30900 0.40550 0.36330 -0.04880 0.01870  -0.02190 301 GOL A C1  
4426 O  O1  A GOL B .   ? 0.21510 0.32750 0.28540 -0.05090 0.02440  -0.08150 301 GOL A O1  
4427 O  O1  B GOL B .   ? 0.31310 0.40310 0.36470 -0.04640 0.01630  -0.02910 301 GOL A O1  
4428 C  C2  A GOL B .   ? 0.24080 0.33310 0.28900 -0.06090 0.04960  -0.04140 301 GOL A C2  
4429 C  C2  B GOL B .   ? 0.30320 0.40680 0.35510 -0.05410 0.01670  -0.01500 301 GOL A C2  
4430 O  O2  A GOL B .   ? 0.23010 0.32870 0.27370 -0.07020 0.05020  -0.04190 301 GOL A O2  
4431 O  O2  B GOL B .   ? 0.30020 0.40630 0.35150 -0.06070 0.00770  -0.01490 301 GOL A O2  
4432 C  C3  A GOL B .   ? 0.25150 0.32950 0.28430 -0.06450 0.05010  -0.04030 301 GOL A C3  
4433 C  C3  B GOL B .   ? 0.29320 0.40480 0.34550 -0.05600 0.02270  -0.01440 301 GOL A C3  
4434 O  O3  A GOL B .   ? 0.26800 0.33320 0.29070 -0.06000 0.03140  -0.04180 301 GOL A O3  
4435 O  O3  B GOL B .   ? 0.28990 0.40550 0.33190 -0.05540 0.02460  -0.00660 301 GOL A O3  
4452 S  S   . SO4 C .   ? 0.20250 0.25540 0.37330 0.04590  0.04050  0.02590  302 SO4 A S   
4453 O  O1  . SO4 C .   ? 0.25280 0.27000 0.28640 0.07370  0.08140  0.05270  302 SO4 A O1  
4454 O  O2  . SO4 C .   ? 0.41070 0.25460 0.37850 0.03110  0.06000  -0.07000 302 SO4 A O2  
4455 O  O3  . SO4 C .   ? 0.20360 0.37520 0.43900 0.05930  0.03410  0.03900  302 SO4 A O3  
4456 O  O4  . SO4 C .   ? 0.16770 0.24310 0.28330 0.05170  0.00840  0.03640  302 SO4 A O4  
4457 S  S   . SO4 D .   ? 0.38680 1.16460 0.75420 -0.06400 0.08200  -0.15350 303 SO4 A S   
4458 O  O1  . SO4 D .   ? 0.60330 0.97510 0.81640 0.10750  -0.34940 -0.01930 303 SO4 A O1  
4459 O  O2  . SO4 D .   ? 0.54780 0.88990 1.06250 0.25700  -0.37370 0.06750  303 SO4 A O2  
4460 O  O3  . SO4 D .   ? 1.01820 0.75830 0.81290 -0.18500 0.05310  0.00330  303 SO4 A O3  
4461 O  O4  . SO4 D .   ? 0.32590 0.82170 1.00950 0.08140  -0.31680 -0.33360 303 SO4 A O4  
4462 C  C12 A XR9 E .   ? 0.17490 0.19290 0.18400 0.01370  0.00700  0.01480  304 XR9 A C12 
4463 C  C11 A XR9 E .   ? 0.18430 0.24070 0.24580 0.02230  0.02830  0.07150  304 XR9 A C11 
4464 C  C9  A XR9 E .   ? 0.22000 0.25220 0.17860 0.01160  -0.04860 0.06020  304 XR9 A C9  
4465 C  C7  A XR9 E .   ? 0.18670 0.24070 0.20510 0.01130  -0.01220 0.03380  304 XR9 A C7  
4466 C  C4  A XR9 E .   ? 0.14270 0.25040 0.30130 0.01940  0.00720  0.04060  304 XR9 A C4  
4467 N  N6  A XR9 E .   ? 0.27050 0.35190 0.29880 0.00760  -0.01640 0.05420  304 XR9 A N6  
4468 B  B2  A XR9 E .   ? 0.13560 0.21320 0.14080 -0.00420 -0.00850 0.00570  304 XR9 A B2  
4469 C  C10 A XR9 E .   ? 0.19130 0.30490 0.17350 0.02330  -0.00520 0.06140  304 XR9 A C10 
4470 C  C5  A XR9 E .   ? 0.27390 0.32060 0.26760 0.04380  0.06850  0.04920  304 XR9 A C5  
4471 C  C8  A XR9 E .   ? 0.18840 0.25470 0.20890 0.01360  -0.06800 0.02700  304 XR9 A C8  
4472 O  O1  A XR9 E .   ? 0.09510 0.23140 0.13220 -0.03100 0.01580  0.01290  304 XR9 A O1  
4473 O  O3  A XR9 E .   ? 0.14170 0.23340 0.20330 0.00580  -0.00990 -0.01810 304 XR9 A O3  
4480 S  S   B SO4 F .   ? 0.20630 0.25070 0.14860 -0.04870 -0.02150 -0.01120 305 SO4 A S   
4481 O  O1  B SO4 F .   ? 0.20510 0.29120 0.22890 -0.06920 -0.02460 -0.05040 305 SO4 A O1  
4482 O  O2  B SO4 F .   ? 0.12580 0.28570 0.13120 -0.05200 0.00460  0.03110  305 SO4 A O2  
4483 O  O3  B SO4 F .   ? 0.25400 0.32590 0.21460 -0.05340 -0.00960 0.00730  305 SO4 A O3  
4484 O  O4  B SO4 F .   ? 0.20370 0.24360 0.17470 -0.01110 -0.07570 -0.00050 305 SO4 A O4  
4485 S  S   A SO4 G .   ? 0.78900 0.77620 0.44460 -0.29770 0.10810  0.06690  306 SO4 A S   
4486 O  O1  A SO4 G .   ? 0.92510 0.56350 0.67470 -0.05670 0.10330  -0.11440 306 SO4 A O1  
4487 O  O2  A SO4 G .   ? 0.76710 0.84300 0.84110 -0.16250 0.24990  -0.29790 306 SO4 A O2  
4488 O  O3  A SO4 G .   ? 1.09300 0.83220 0.58810 0.23320  0.17110  0.01240  306 SO4 A O3  
4489 O  O4  A SO4 G .   ? 1.00810 0.51420 0.36630 0.05510  0.12510  0.25170  306 SO4 A O4  
4490 NA NA  A NA  H .   ? 0.20840 0.52730 0.47410 0.04680  0.00800  0.12740  307 NA  A NA  
4491 O  O   . HOH I .   ? 0.55030 1.42420 0.54460 -0.18970 -0.14450 0.09820  401 HOH A O   
4492 O  O   . HOH I .   ? 0.24630 0.46730 0.50390 -0.00910 -0.00310 0.02980  402 HOH A O   
4493 O  O   . HOH I .   ? 0.59650 0.51400 1.02260 -0.07990 0.43070  -0.10290 403 HOH A O   
4494 O  O   . HOH I .   ? 0.57000 0.26110 0.65920 0.09250  0.14200  -0.02160 404 HOH A O   
4495 O  O   . HOH I .   ? 0.53730 0.40370 0.28190 -0.12300 0.05020  0.03270  405 HOH A O   
4496 O  O   . HOH I .   ? 0.42250 0.48560 0.93960 -0.13690 0.27680  -0.23460 406 HOH A O   
4497 O  O   . HOH I .   ? 0.33440 0.34020 0.27460 -0.03050 -0.00450 0.03350  407 HOH A O   
4498 O  O   . HOH I .   ? 0.56540 0.30310 0.37460 0.10830  0.19950  0.08880  408 HOH A O   
4499 O  O   . HOH I .   ? 0.62570 0.59800 0.47810 -0.00890 0.02130  0.15050  409 HOH A O   
4500 O  O   . HOH I .   ? 0.95700 0.43720 1.01070 -0.19460 0.04180  0.18260  410 HOH A O   
4501 O  O   . HOH I .   ? 0.45220 0.82680 0.45150 0.09290  -0.08820 -0.08890 411 HOH A O   
4502 O  O   . HOH I .   ? 0.27820 0.37540 0.59420 -0.05820 -0.07870 0.16060  412 HOH A O   
4503 O  O   . HOH I .   ? 0.55890 0.57630 0.54330 -0.07040 -0.01790 0.05460  413 HOH A O   
4504 O  O   B HOH I .   ? 0.50450 0.43390 0.34210 0.02480  0.00970  0.00100  414 HOH A O   
4505 O  O   . HOH I .   ? 0.54950 1.05000 0.33410 -0.23840 0.07200  0.05760  415 HOH A O   
4506 O  O   . HOH I .   ? 0.22580 0.46690 0.18470 -0.13170 -0.00950 0.02970  416 HOH A O   
4507 O  O   . HOH I .   ? 0.85990 0.72850 0.36240 0.00940  -0.22300 -0.14510 417 HOH A O   
4508 O  O   . HOH I .   ? 0.95690 0.69370 0.52780 0.42400  0.31760  0.22330  418 HOH A O   
4509 O  O   . HOH I .   ? 0.75200 0.96740 0.43710 -0.21620 0.10160  0.16210  419 HOH A O   
4510 O  O   . HOH I .   ? 0.56980 0.90630 0.27500 0.26120  0.02620  -0.04180 420 HOH A O   
4511 O  O   . HOH I .   ? 0.41720 0.25650 0.37420 -0.00220 -0.02650 -0.11320 421 HOH A O   
4512 O  O   . HOH I .   ? 0.72830 0.82630 0.84610 0.03250  -0.43170 -0.21040 422 HOH A O   
4513 O  O   . HOH I .   ? 0.39680 0.91260 0.69260 0.00240  -0.16840 0.08460  423 HOH A O   
4514 O  O   . HOH I .   ? 0.27320 0.63460 0.43840 -0.07770 -0.07110 0.13580  424 HOH A O   
4515 O  O   . HOH I .   ? 0.30090 0.21650 0.27230 -0.01450 -0.02020 0.03600  425 HOH A O   
4516 O  O   . HOH I .   ? 0.77680 0.41310 0.37710 0.11770  -0.12020 0.01590  426 HOH A O   
4517 O  O   A HOH I .   ? 0.16010 0.27430 0.22330 0.03060  -0.00720 -0.05680 427 HOH A O   
4518 O  O   . HOH I .   ? 0.38590 0.49170 0.37890 0.08570  0.00780  -0.17000 428 HOH A O   
4519 O  O   . HOH I .   ? 0.30350 0.68530 0.37690 0.06080  0.07430  0.04260  429 HOH A O   
4520 O  O   . HOH I .   ? 0.25210 0.31440 0.33300 -0.05650 0.06850  -0.01590 430 HOH A O   
4521 O  O   . HOH I .   ? 0.24670 0.63160 0.30200 -0.06160 -0.01630 0.14030  431 HOH A O   
4522 O  O   . HOH I .   ? 0.14160 0.18610 0.16540 -0.01160 0.00860  -0.00180 432 HOH A O   
4523 O  O   . HOH I .   ? 0.24100 0.43010 0.24960 -0.01310 0.03550  0.06580  433 HOH A O   
4524 O  O   . HOH I .   ? 0.40140 0.90140 0.62420 0.10250  0.06370  0.12220  434 HOH A O   
4525 O  O   . HOH I .   ? 0.60820 0.47910 0.78740 0.10690  0.39590  0.16150  435 HOH A O   
4526 O  O   . HOH I .   ? 0.69000 0.45180 0.62190 -0.24600 0.35940  -0.22710 436 HOH A O   
4527 O  O   . HOH I .   ? 0.34510 0.31650 0.27750 -0.06580 -0.02200 0.01650  437 HOH A O   
4528 O  O   . HOH I .   ? 0.40090 0.69840 0.56130 -0.28650 0.06770  -0.02380 438 HOH A O   
4529 O  O   . HOH I .   ? 0.49860 0.43160 1.09560 0.08990  0.28830  -0.04610 439 HOH A O   
4530 O  O   . HOH I .   ? 0.42350 0.73780 0.60500 -0.18300 -0.16630 0.37870  440 HOH A O   
4531 O  O   . HOH I .   ? 0.30720 0.35090 0.24750 0.03450  -0.04620 -0.02510 441 HOH A O   
4532 O  O   . HOH I .   ? 0.49820 0.56460 0.38800 -0.12270 -0.08460 0.14660  442 HOH A O   
4533 O  O   . HOH I .   ? 0.94320 0.64550 0.49100 0.32740  0.13660  0.06450  443 HOH A O   
4534 O  O   . HOH I .   ? 0.16300 0.57180 0.30380 -0.06120 0.03120  -0.07310 444 HOH A O   
4535 O  O   . HOH I .   ? 0.31820 0.32920 0.30320 0.03160  -0.06400 -0.07430 445 HOH A O   
4536 O  O   . HOH I .   ? 0.66340 0.74500 0.37190 -0.06280 0.22430  -0.00960 446 HOH A O   
4537 O  O   . HOH I .   ? 0.21240 0.46270 0.23450 -0.04270 0.01650  0.04570  447 HOH A O   
4538 O  O   . HOH I .   ? 0.18730 0.37980 0.21130 -0.04860 -0.03050 -0.01880 448 HOH A O   
4539 O  O   . HOH I .   ? 0.30630 0.59860 0.25530 -0.04450 -0.01110 0.09980  449 HOH A O   
4540 O  O   . HOH I .   ? 0.65470 0.35320 0.47430 0.05460  -0.02060 0.12710  450 HOH A O   
4541 O  O   . HOH I .   ? 0.61580 0.85530 0.59010 0.38220  -0.23480 -0.29010 451 HOH A O   
4542 O  O   . HOH I .   ? 0.26590 0.23320 0.30020 -0.00210 -0.02380 -0.02070 452 HOH A O   
4543 O  O   . HOH I .   ? 0.51440 0.51320 0.72130 -0.18070 0.31000  -0.10100 453 HOH A O   
4544 O  O   . HOH I .   ? 0.76830 0.59150 0.53500 0.12880  -0.30620 0.10920  454 HOH A O   
4545 O  O   . HOH I .   ? 0.16540 0.19020 0.18140 -0.00460 -0.00260 -0.01530 455 HOH A O   
4546 O  O   . HOH I .   ? 0.16590 0.30360 0.39840 0.01780  -0.03550 0.05450  456 HOH A O   
4547 O  O   . HOH I .   ? 0.15760 0.17730 0.16970 -0.00930 -0.00370 -0.00420 457 HOH A O   
4548 O  O   . HOH I .   ? 0.42050 0.45780 0.68040 0.21030  -0.15230 -0.18920 458 HOH A O   
4549 O  O   . HOH I .   ? 0.22360 0.37530 0.26400 -0.00020 -0.00060 -0.03940 459 HOH A O   
4550 O  O   . HOH I .   ? 0.14500 0.17780 0.18620 -0.00810 0.01370  -0.00870 460 HOH A O   
4551 O  O   . HOH I .   ? 0.22560 0.44050 0.36550 -0.06760 -0.10970 0.03750  461 HOH A O   
4552 O  O   . HOH I .   ? 0.29130 0.34140 0.72220 -0.04090 -0.08880 0.12770  462 HOH A O   
4553 O  O   . HOH I .   ? 0.33250 0.37080 0.29220 0.00860  0.05750  0.06230  463 HOH A O   
4554 O  O   . HOH I .   ? 0.49510 0.66280 0.25310 -0.06670 0.05750  -0.00430 464 HOH A O   
4555 O  O   . HOH I .   ? 0.96820 0.83100 0.45450 0.34520  0.02770  -0.00110 465 HOH A O   
4556 O  O   . HOH I .   ? 0.19060 0.26430 0.27400 0.04150  0.01410  0.01300  466 HOH A O   
4557 O  O   . HOH I .   ? 0.25780 0.46820 0.32420 -0.09840 0.04480  -0.11490 467 HOH A O   
4558 O  O   . HOH I .   ? 0.19650 0.25020 0.21260 -0.03930 0.01660  0.00590  468 HOH A O   
4559 O  O   . HOH I .   ? 0.27910 0.27590 0.32330 0.01410  -0.04610 -0.11680 469 HOH A O   
4560 O  O   . HOH I .   ? 0.34740 0.73800 0.41690 0.06720  -0.02230 0.14350  470 HOH A O   
4561 O  O   . HOH I .   ? 0.27060 0.34450 0.24590 -0.11970 -0.01790 0.02740  471 HOH A O   
4562 O  O   . HOH I .   ? 0.33500 0.67760 0.43610 0.17810  0.02050  -0.04960 472 HOH A O   
4563 O  O   . HOH I .   ? 0.53470 0.65410 1.07860 -0.13010 -0.05680 -0.28590 473 HOH A O   
4564 O  O   . HOH I .   ? 0.34320 0.19480 0.23800 -0.02270 -0.10090 -0.00360 474 HOH A O   
4565 O  O   . HOH I .   ? 0.19720 0.18670 0.20490 0.00890  -0.02080 -0.01310 475 HOH A O   
4566 O  O   . HOH I .   ? 0.44280 0.28660 0.31740 0.04960  0.00160  -0.00820 476 HOH A O   
4567 O  O   . HOH I .   ? 0.29340 0.40610 0.35060 0.08340  0.04070  -0.03420 477 HOH A O   
4568 O  O   . HOH I .   ? 0.29170 0.36910 0.61120 -0.05160 0.11890  0.14650  478 HOH A O   
4569 O  O   . HOH I .   ? 0.49170 0.48770 0.47900 -0.00520 -0.14860 -0.13070 479 HOH A O   
4570 O  O   . HOH I .   ? 0.54980 0.56920 0.41370 0.19810  0.21280  0.04980  480 HOH A O   
4571 O  O   . HOH I .   ? 0.13380 0.21570 0.15060 -0.02700 0.01470  -0.00650 481 HOH A O   
4572 O  O   . HOH I .   ? 0.17530 0.21230 0.22410 -0.01550 -0.00040 0.01340  482 HOH A O   
4573 O  O   . HOH I .   ? 0.45200 0.34600 0.68860 0.08870  -0.14830 0.07480  483 HOH A O   
4574 O  O   . HOH I .   ? 0.24360 0.44130 0.39810 -0.07390 0.06150  0.06630  484 HOH A O   
4575 O  O   . HOH I .   ? 0.26440 0.56180 0.30520 0.01070  0.00760  -0.01220 485 HOH A O   
4576 O  O   . HOH I .   ? 0.20840 0.27100 0.21730 -0.01730 0.01170  0.00040  486 HOH A O   
4577 O  O   . HOH I .   ? 0.40560 0.35830 0.34310 -0.11530 -0.04130 -0.03780 487 HOH A O   
4578 O  O   . HOH I .   ? 0.55560 0.44850 0.24290 -0.12500 0.04060  0.03220  488 HOH A O   
4579 O  O   . HOH I .   ? 0.25250 0.49770 0.36780 -0.12680 0.07630  -0.03470 489 HOH A O   
4580 O  O   . HOH I .   ? 0.25680 0.33830 0.40500 -0.14030 0.02070  0.02060  490 HOH A O   
4581 O  O   . HOH I .   ? 0.18140 0.46830 0.45240 -0.04480 -0.01470 -0.14710 491 HOH A O   
4582 O  O   . HOH I .   ? 0.47150 0.65620 0.36860 -0.19090 -0.01350 -0.01810 492 HOH A O   
4583 O  O   . HOH I .   ? 0.33920 0.41110 0.34210 -0.17770 0.02500  -0.01690 493 HOH A O   
4584 O  O   . HOH I .   ? 0.46140 0.50920 0.35840 -0.10420 -0.16290 0.07760  494 HOH A O   
4585 O  O   . HOH I .   ? 0.35250 0.39470 0.38680 -0.00590 0.18540  0.08710  495 HOH A O   
4586 O  O   . HOH I .   ? 0.45630 0.22560 0.21300 -0.03770 0.00730  0.02830  496 HOH A O   
4587 O  O   . HOH I .   ? 0.15850 0.26990 0.18850 -0.02200 -0.01350 0.01140  497 HOH A O   
4588 O  O   . HOH I .   ? 0.25690 0.46180 0.29500 -0.05840 0.13960  -0.00250 498 HOH A O   
4589 O  O   . HOH I .   ? 0.22480 0.29630 0.23100 0.04210  0.06030  0.00410  499 HOH A O   
4590 O  O   . HOH I .   ? 0.26780 0.36600 0.26020 -0.05730 0.03650  0.03090  500 HOH A O   
4591 O  O   . HOH I .   ? 0.68650 0.59690 0.35980 -0.33920 0.10360  -0.05950 501 HOH A O   
4592 O  O   . HOH I .   ? 0.24620 0.28860 0.25150 0.06990  0.01620  -0.06740 502 HOH A O   
4593 O  O   . HOH I .   ? 0.36940 0.34600 0.23400 -0.07070 -0.04600 0.04650  503 HOH A O   
4594 O  O   . HOH I .   ? 0.17200 0.20730 0.20230 0.00690  0.00760  0.04180  504 HOH A O   
4595 O  O   . HOH I .   ? 0.17340 0.16330 0.17490 -0.00490 0.00000  0.00000  505 HOH A O   
4596 O  O   . HOH I .   ? 0.30610 0.37800 0.31290 0.00940  -0.03520 -0.14900 506 HOH A O   
4597 O  O   . HOH I .   ? 0.22710 0.29110 0.19560 -0.04230 -0.03360 0.01850  507 HOH A O   
4598 O  O   . HOH I .   ? 0.29990 0.26180 0.41170 -0.03340 0.04750  -0.04800 508 HOH A O   
4599 O  O   . HOH I .   ? 0.27100 0.45760 0.48280 -0.09230 -0.05130 -0.14010 509 HOH A O   
4600 O  O   . HOH I .   ? 0.51250 0.83450 0.53300 0.01140  -0.30280 -0.04900 510 HOH A O   
4601 O  O   . HOH I .   ? 0.16290 0.38940 0.44960 -0.04790 -0.00640 0.15080  511 HOH A O   
4602 O  O   . HOH I .   ? 0.20420 0.38400 0.27450 0.00800  -0.01140 -0.02010 512 HOH A O   
4603 O  O   . HOH I .   ? 0.13550 0.22560 0.16680 -0.00060 0.02030  0.02520  513 HOH A O   
4604 O  O   . HOH I .   ? 0.26950 0.37350 0.32240 0.05340  0.03010  -0.01890 514 HOH A O   
4605 O  O   . HOH I .   ? 0.32420 0.41370 0.45540 -0.18030 0.02950  -0.03550 515 HOH A O   
4606 O  O   . HOH I .   ? 0.72260 0.45540 0.54770 -0.21260 -0.03150 -0.20950 516 HOH A O   
4607 O  O   . HOH I .   ? 0.36420 0.44010 0.20390 0.07140  -0.04270 -0.02970 517 HOH A O   
4608 O  O   . HOH I .   ? 0.34850 0.58370 0.48470 -0.16780 0.11690  -0.10470 518 HOH A O   
4609 O  O   . HOH I .   ? 0.63970 0.52300 0.56620 -0.23780 -0.14060 0.00820  519 HOH A O   
4610 O  O   . HOH I .   ? 0.21070 0.29180 0.23110 0.05670  0.02660  0.03940  520 HOH A O   
4611 O  O   . HOH I .   ? 0.27350 0.32780 0.41930 -0.01780 0.04250  -0.01590 521 HOH A O   
4612 O  O   . HOH I .   ? 0.17580 0.29560 0.19480 0.04730  -0.02680 -0.00640 522 HOH A O   
4613 O  O   . HOH I .   ? 0.28730 0.57120 0.40210 -0.00960 -0.11160 -0.02190 523 HOH A O   
4614 O  O   . HOH I .   ? 0.30150 0.35890 0.23170 -0.11390 -0.02380 0.02390  524 HOH A O   
4615 O  O   . HOH I .   ? 0.27500 0.40030 0.20810 -0.01300 0.00780  -0.01990 525 HOH A O   
4616 O  O   . HOH I .   ? 0.15610 0.22040 0.21130 0.01850  -0.00380 0.00730  526 HOH A O   
4617 O  O   . HOH I .   ? 0.66890 0.52720 0.54440 -0.27490 -0.17800 0.01450  527 HOH A O   
4618 O  O   . HOH I .   ? 0.28050 0.26090 0.29470 0.00330  -0.04520 0.00590  528 HOH A O   
4619 O  O   . HOH I .   ? 0.73810 0.35470 0.64400 0.18780  0.23830  -0.02080 529 HOH A O   
4620 O  O   . HOH I .   ? 0.29920 0.40470 0.20270 0.01740  0.01080  0.01170  530 HOH A O   
4621 O  O   . HOH I .   ? 0.25250 0.25270 0.38210 0.05160  0.04240  -0.07500 531 HOH A O   
4622 O  O   . HOH I .   ? 0.38080 0.81130 0.44910 -0.21230 -0.01540 0.01810  532 HOH A O   
4623 O  O   . HOH I .   ? 0.27360 0.80030 0.81770 -0.10240 -0.09820 0.14180  533 HOH A O   
4624 O  O   . HOH I .   ? 0.25700 0.35700 0.23610 0.01950  -0.01390 0.00550  534 HOH A O   
4625 O  O   . HOH I .   ? 0.30000 0.39550 0.47660 0.07480  0.02030  0.05280  535 HOH A O   
4626 O  O   . HOH I .   ? 1.28890 1.02800 1.33220 0.35770  0.42220  -0.02940 536 HOH A O   
4627 O  O   . HOH I .   ? 0.20540 0.34390 0.34390 -0.03370 0.04640  -0.00450 537 HOH A O   
4628 O  O   B HOH I .   ? 0.46430 0.19620 0.14340 -0.03690 -0.01830 0.00110  538 HOH A O   
4629 O  O   . HOH I .   ? 0.27630 0.42580 0.36470 -0.09440 0.00370  -0.04260 539 HOH A O   
4630 O  O   . HOH I .   ? 0.38150 0.35950 0.43170 -0.02190 0.08330  -0.02710 540 HOH A O   
4631 O  O   . HOH I .   ? 0.52090 0.43700 0.36500 0.18280  0.05080  0.03760  541 HOH A O   
4632 O  O   . HOH I .   ? 0.50300 0.58170 0.83470 0.22060  0.29360  0.20360  542 HOH A O   
4633 O  O   . HOH I .   ? 0.52700 0.30670 0.42180 -0.08490 0.04230  -0.12920 543 HOH A O   
4634 O  O   . HOH I .   ? 0.19040 0.28600 0.19840 -0.00760 0.01750  0.02190  544 HOH A O   
4635 O  O   . HOH I .   ? 0.14280 0.24540 0.19110 -0.00880 0.02900  0.00930  545 HOH A O   
4636 O  O   . HOH I .   ? 0.18970 0.35250 0.23690 -0.02450 0.00240  0.04710  546 HOH A O   
4637 O  O   . HOH I .   ? 0.30070 0.51090 0.64450 -0.02470 0.17010  0.03410  547 HOH A O   
4638 O  O   . HOH I .   ? 0.22090 0.35410 0.34000 0.01830  0.03800  -0.02120 548 HOH A O   
4639 O  O   . HOH I .   ? 1.16280 0.44650 0.62400 -0.26090 -0.35990 0.08840  549 HOH A O   
4640 O  O   . HOH I .   ? 0.23660 0.66880 0.24970 0.01160  0.03550  0.03460  550 HOH A O   
4641 O  O   . HOH I .   ? 0.18910 0.54390 0.26560 0.04040  -0.00140 0.03850  551 HOH A O   
4642 O  O   . HOH I .   ? 0.37340 0.40440 0.81980 0.04590  -0.05320 -0.21590 552 HOH A O   
4643 O  O   . HOH I .   ? 0.23990 0.21260 0.28500 -0.02040 0.02000  0.00500  553 HOH A O   
4644 O  O   . HOH I .   ? 0.27910 0.38610 0.34100 0.03530  0.00200  -0.08350 554 HOH A O   
4645 O  O   . HOH I .   ? 0.19790 0.17560 0.30040 -0.01920 0.02580  0.01090  555 HOH A O   
4646 O  O   . HOH I .   ? 0.45340 0.39360 0.44060 -0.05530 -0.06790 0.16820  556 HOH A O   
4647 O  O   . HOH I .   ? 0.45900 0.68690 0.57270 -0.24940 -0.09580 0.20510  557 HOH A O   
4648 O  O   . HOH I .   ? 0.59400 0.34820 0.41590 0.00320  -0.06760 0.09090  558 HOH A O   
4649 O  O   B HOH I .   ? 0.34580 0.21040 0.20180 0.02420  0.03170  0.00400  559 HOH A O   
4650 O  O   . HOH I .   ? 0.30600 0.40850 0.31500 0.11300  0.10430  0.02920  560 HOH A O   
4651 O  O   . HOH I .   ? 0.42960 0.49940 0.33240 0.06890  -0.01940 -0.10750 561 HOH A O   
4652 O  O   . HOH I .   ? 0.20520 0.32700 0.43810 0.00470  0.05940  0.07490  562 HOH A O   
4653 O  O   . HOH I .   ? 0.88060 0.75400 0.60650 0.12150  0.27840  0.31210  563 HOH A O   
4654 O  O   . HOH I .   ? 0.62090 0.73210 0.56450 -0.28850 -0.29210 0.22850  564 HOH A O   
4655 O  O   . HOH I .   ? 0.23830 0.27350 0.50660 0.00260  0.08360  0.01210  565 HOH A O   
4656 O  O   . HOH I .   ? 0.49420 0.63400 0.39260 -0.19390 -0.19830 0.00120  566 HOH A O   
4657 O  O   . HOH I .   ? 0.40190 0.63920 0.48390 -0.14610 -0.10750 -0.10240 567 HOH A O   
4658 O  O   . HOH I .   ? 0.89800 0.47010 0.53480 0.09290  0.28530  0.00560  568 HOH A O   
4659 O  O   . HOH I .   ? 0.23220 0.49220 0.31330 -0.15780 -0.04670 0.01710  569 HOH A O   
4660 O  O   . HOH I .   ? 0.36240 1.06160 0.38480 -0.15590 -0.05240 -0.05850 570 HOH A O   
4661 O  O   . HOH I .   ? 0.31980 0.79940 0.28170 0.21170  0.06580  0.16320  571 HOH A O   
4662 O  O   . HOH I .   ? 0.29600 0.41000 0.26710 -0.09170 -0.00130 -0.00820 572 HOH A O   
4663 O  O   . HOH I .   ? 0.34500 0.43750 0.25750 0.02850  -0.05720 -0.02510 573 HOH A O   
4664 O  O   . HOH I .   ? 0.41520 0.38000 0.52090 0.00190  -0.25520 0.07080  574 HOH A O   
4665 O  O   . HOH I .   ? 1.00370 0.62450 0.34010 0.38310  -0.12160 -0.04920 575 HOH A O   
4666 O  O   . HOH I .   ? 0.37170 0.30720 0.51890 0.01750  0.13800  -0.08190 576 HOH A O   
4667 O  O   . HOH I .   ? 0.32810 0.23990 0.90490 -0.03300 -0.03360 -0.02570 577 HOH A O   
4668 O  O   . HOH I .   ? 0.79550 0.31430 0.64020 0.10280  -0.21430 -0.04500 578 HOH A O   
4669 O  O   . HOH I .   ? 0.25720 0.39590 0.24730 0.04520  0.05200  -0.02750 579 HOH A O   
4670 O  O   . HOH I .   ? 0.68900 0.40560 0.51870 -0.04160 -0.04430 -0.05340 580 HOH A O   
4671 O  O   . HOH I .   ? 0.16300 0.33390 0.29800 -0.00570 -0.00570 0.04910  581 HOH A O   
4672 O  O   . HOH I .   ? 0.30650 0.35930 0.48660 0.01200  -0.03900 -0.10580 582 HOH A O   
4673 O  O   . HOH I .   ? 0.45010 0.70310 0.68320 0.14670  0.18040  0.39440  583 HOH A O   
4674 O  O   . HOH I .   ? 0.38240 0.56250 0.45800 -0.09240 0.18730  -0.13980 584 HOH A O   
4675 O  O   . HOH I .   ? 0.19470 0.42490 0.27400 -0.02890 0.05180  -0.06610 585 HOH A O   
4676 O  O   . HOH I .   ? 0.23690 0.34920 0.58820 -0.03730 0.04170  -0.02280 586 HOH A O   
4677 O  O   . HOH I .   ? 0.41530 0.86900 0.38790 -0.28810 0.03340  0.05660  587 HOH A O   
4678 O  O   . HOH I .   ? 0.36480 0.78390 0.91640 0.11890  -0.04150 0.25250  588 HOH A O   
4679 O  O   . HOH I .   ? 0.48070 0.32510 0.87640 -0.06080 0.08910  0.18930  589 HOH A O   
4680 O  O   . HOH I .   ? 0.44030 0.48100 0.32520 0.08480  0.05730  0.05480  590 HOH A O   
4681 O  O   . HOH I .   ? 0.56860 0.28650 0.32440 -0.02330 -0.18880 -0.00240 591 HOH A O   
4682 O  O   . HOH I .   ? 0.17310 0.27790 0.25860 0.01040  0.00590  -0.03130 592 HOH A O   
4683 O  O   . HOH I .   ? 0.33330 0.38910 0.32360 -0.09320 0.00070  0.03080  593 HOH A O   
4684 O  O   . HOH I .   ? 0.52740 0.54740 0.74930 -0.14020 0.16660  -0.14450 594 HOH A O   
4685 O  O   . HOH I .   ? 0.51790 0.60590 0.47490 -0.29070 -0.20690 0.16560  595 HOH A O   
4686 O  O   . HOH I .   ? 0.74630 0.63570 0.63010 0.16090  0.38770  0.05130  596 HOH A O   
4687 O  O   . HOH I .   ? 0.41130 1.16080 0.53420 0.26190  0.02290  0.18610  597 HOH A O   
4688 O  O   . HOH I .   ? 0.28850 0.32790 0.22990 0.00510  0.07360  -0.02370 598 HOH A O   
4689 O  O   . HOH I .   ? 0.45910 0.42520 0.48430 0.10060  0.24250  0.09860  599 HOH A O   
4690 O  O   . HOH I .   ? 0.87040 0.48820 0.63490 0.21710  0.02890  -0.12420 600 HOH A O   
4691 O  O   . HOH I .   ? 0.55580 0.52270 0.38040 -0.06000 -0.12760 -0.03430 601 HOH A O   
4692 O  O   . HOH I .   ? 0.14580 0.17260 0.15510 -0.01460 0.00500  0.00600  602 HOH A O   
4693 O  O   . HOH I .   ? 0.27250 0.39130 0.41760 -0.05430 0.00670  0.05900  603 HOH A O   
4694 O  O   . HOH I .   ? 0.21850 0.63790 0.23330 0.00480  -0.02010 0.03710  604 HOH A O   
4695 O  O   . HOH I .   ? 0.72090 0.76150 0.29270 -0.29080 -0.02840 -0.08050 605 HOH A O   
4696 O  O   . HOH I .   ? 0.98250 0.46400 0.46710 0.15410  -0.30350 -0.09400 606 HOH A O   
4697 O  O   . HOH I .   ? 0.35100 0.58940 0.94500 0.11720  0.20080  0.00360  607 HOH A O   
4698 O  O   . HOH I .   ? 0.35180 0.92450 0.25250 0.16390  0.02970  0.01390  608 HOH A O   
4699 O  O   . HOH I .   ? 0.35080 0.56790 0.84890 -0.02270 0.12660  0.29610  609 HOH A O   
4700 O  O   . HOH I .   ? 0.49490 0.76860 0.96260 0.25350  0.25890  0.12880  610 HOH A O   
4701 O  O   . HOH I .   ? 0.84280 0.47760 0.38120 -0.26860 -0.15660 -0.02280 611 HOH A O   
4702 O  O   . HOH I .   ? 0.26550 0.54210 0.29260 0.04940  0.01950  -0.10840 612 HOH A O   
4703 O  O   . HOH I .   ? 0.29090 0.91740 0.38910 0.09520  -0.01910 -0.19790 613 HOH A O   
4704 O  O   . HOH I .   ? 0.35230 0.51240 0.22900 -0.11990 -0.00220 0.00940  614 HOH A O   
4705 O  O   . HOH I .   ? 0.66040 0.25460 0.86410 0.01390  0.09320  0.08860  615 HOH A O   
4706 O  O   . HOH I .   ? 0.31580 0.35720 0.26550 0.00040  -0.00700 0.06360  616 HOH A O   
4707 O  O   . HOH I .   ? 0.26940 0.36310 0.23070 -0.00410 -0.01640 0.00770  617 HOH A O   
4708 O  O   . HOH I .   ? 0.31200 0.29650 0.27730 -0.06190 -0.04590 0.00860  618 HOH A O   
4709 O  O   . HOH I .   ? 0.26260 0.63640 0.37090 0.02790  -0.03110 -0.03550 619 HOH A O   
4710 O  O   . HOH I .   ? 0.36460 0.67780 0.73930 0.09140  0.09120  0.12430  620 HOH A O   
4711 O  O   . HOH I .   ? 0.68530 0.42250 0.36460 0.00690  -0.15650 0.08050  621 HOH A O   
4712 O  O   . HOH I .   ? 0.78440 0.95060 1.00570 0.20700  0.37200  0.49180  622 HOH A O   
4713 O  O   . HOH I .   ? 0.71930 0.83040 0.56820 0.23360  0.33310  0.09690  623 HOH A O   
4714 O  O   . HOH I .   ? 0.31260 0.46300 0.30250 0.05820  0.03160  -0.02880 624 HOH A O   
4715 O  O   . HOH I .   ? 0.33510 0.65010 1.00420 -0.15960 -0.07480 -0.05580 625 HOH A O   
4716 O  O   . HOH I .   ? 0.63050 0.63830 0.85120 -0.04620 0.42820  -0.06330 626 HOH A O   
4717 O  O   . HOH I .   ? 0.37440 0.59780 0.50840 0.04320  0.05950  -0.07220 627 HOH A O   
4718 O  O   . HOH I .   ? 0.28520 0.81380 0.35800 -0.03920 0.06590  -0.07890 628 HOH A O   
4719 O  O   . HOH I .   ? 0.64400 0.37330 0.21000 0.03470  -0.12280 0.01420  629 HOH A O   
4720 O  O   . HOH I .   ? 0.28690 0.48380 0.31320 0.03930  0.00130  0.02780  630 HOH A O   
4721 O  O   . HOH I .   ? 0.67620 0.73020 0.46920 0.03290  -0.16250 -0.13680 631 HOH A O   
4722 O  O   . HOH I .   ? 0.42040 0.48190 0.66250 0.10990  -0.12140 0.07420  632 HOH A O   
4723 O  O   . HOH I .   ? 0.25620 0.41700 0.29050 -0.08200 0.02150  -0.04330 633 HOH A O   
4724 O  O   . HOH I .   ? 0.42760 0.53280 0.54370 -0.01610 -0.01750 0.32250  634 HOH A O   
4725 O  O   . HOH I .   ? 0.32020 0.78470 0.70250 0.02740  -0.04640 -0.09530 635 HOH A O   
4726 O  O   . HOH I .   ? 0.42850 0.31190 0.18310 -0.01340 0.06150  0.04460  636 HOH A O   
4727 O  O   . HOH I .   ? 0.22210 0.59060 0.25360 0.01680  0.00960  0.03700  637 HOH A O   
4728 O  O   . HOH I .   ? 0.34480 0.69310 0.34510 0.16130  0.04870  0.23510  638 HOH A O   
4729 O  O   . HOH I .   ? 0.66510 0.67630 0.47670 0.12800  -0.20230 -0.27950 639 HOH A O   
4730 O  O   . HOH I .   ? 0.16800 0.29900 0.23230 -0.01540 0.00690  0.03360  640 HOH A O   
4731 O  O   . HOH I .   ? 0.36850 0.49960 0.31680 -0.06450 0.05760  0.01670  641 HOH A O   
4732 O  O   . HOH I .   ? 0.69940 0.88120 0.51600 0.41820  0.02630  0.18060  642 HOH A O   
4733 O  O   . HOH I .   ? 0.41300 0.49780 0.92300 0.16280  -0.12810 -0.27120 643 HOH A O   
4734 O  O   . HOH I .   ? 0.25520 0.64090 0.83700 0.03790  -0.01480 -0.24520 644 HOH A O   
4735 O  O   . HOH I .   ? 0.58530 0.60210 0.60780 0.21230  0.10480  -0.12240 645 HOH A O   
4736 O  O   . HOH I .   ? 0.29190 0.45940 0.36710 -0.08390 -0.00090 -0.04250 646 HOH A O   
4737 O  O   . HOH I .   ? 0.69070 1.35710 0.39110 -0.17200 -0.07210 0.16520  647 HOH A O   
4738 O  O   . HOH I .   ? 0.28010 0.44800 0.32930 0.00670  -0.04100 -0.01400 648 HOH A O   
4739 O  O   . HOH I .   ? 0.98570 0.51550 0.72960 -0.06400 -0.32200 -0.20820 649 HOH A O   
4740 O  O   . HOH I .   ? 0.44020 0.85470 0.45060 -0.15350 0.09580  -0.02200 650 HOH A O   
4741 O  O   . HOH I .   ? 0.60550 0.34840 0.29000 0.12360  0.13400  0.06600  651 HOH A O   
4742 O  O   . HOH I .   ? 0.55820 0.44870 0.27020 -0.12950 0.06390  0.02630  652 HOH A O   
4743 O  O   . HOH I .   ? 0.34040 0.77630 0.69050 0.00840  -0.07700 -0.32580 653 HOH A O   
4744 O  O   . HOH I .   ? 1.23510 0.58080 0.58550 -0.15370 -0.13910 0.13250  654 HOH A O   
4745 O  O   . HOH I .   ? 1.27830 0.76620 0.32420 -0.02150 -0.05360 -0.01420 655 HOH A O   
4746 O  O   . HOH I .   ? 1.29130 0.47460 0.57450 0.22690  0.33300  0.01500  656 HOH A O   
4747 O  O   B HOH I .   ? 0.43610 0.28080 0.57010 0.17300  0.07180  0.09410  657 HOH A O   
4748 O  O   . HOH I .   ? 0.64110 0.71600 0.29040 -0.14350 -0.09220 0.15250  658 HOH A O   
4749 O  O   . HOH I .   ? 0.30230 0.57950 0.68730 -0.17220 0.08170  0.05320  659 HOH A O   
4750 O  O   . HOH I .   ? 0.87010 0.85580 0.44690 0.14000  -0.18210 0.18960  660 HOH A O   
4751 O  O   . HOH I .   ? 0.19630 0.26950 0.21180 -0.02940 -0.00520 0.04340  661 HOH A O   
4752 O  O   . HOH I .   ? 0.31860 0.70920 0.44420 0.16860  0.12620  0.28420  662 HOH A O   
4753 O  O   . HOH I .   ? 0.92500 0.52370 0.60840 0.35620  -0.03840 -0.12930 663 HOH A O   
4754 O  O   . HOH I .   ? 0.58170 0.91370 0.50990 0.19880  -0.02190 -0.05380 664 HOH A O   
4755 O  O   . HOH I .   ? 0.64060 0.79370 0.73490 -0.11200 0.29260  -0.36270 665 HOH A O   
4756 O  O   . HOH I .   ? 0.66490 0.87450 0.38580 0.27540  0.06560  0.23530  666 HOH A O   
4757 O  O   . HOH I .   ? 0.48660 0.39910 1.16510 0.03370  0.06480  -0.09140 667 HOH A O   
4758 O  O   . HOH I .   ? 0.22620 0.57820 0.68430 0.04530  0.03470  0.23920  668 HOH A O   
4759 O  O   . HOH I .   ? 0.33550 1.13400 0.73740 -0.18630 0.00970  -0.01000 669 HOH A O   
4760 O  O   . HOH I .   ? 0.18790 0.38460 0.21190 0.06450  -0.00500 -0.03440 670 HOH A O   
4761 O  O   . HOH I .   ? 0.72260 0.85110 0.56660 -0.18720 -0.17490 0.10070  671 HOH A O   
4762 O  O   . HOH I .   ? 0.72560 0.94750 0.46700 -0.30220 -0.22890 0.01880  672 HOH A O   
4763 O  O   . HOH I .   ? 0.62690 0.82610 0.79330 -0.13860 0.17580  0.18940  673 HOH A O   
4764 O  O   . HOH I .   ? 0.25470 0.65420 0.27250 0.11040  0.02620  -0.11130 674 HOH A O   
4765 O  O   . HOH I .   ? 0.47130 0.36920 0.78630 -0.02630 -0.23500 0.01400  675 HOH A O   
4766 O  O   . HOH I .   ? 0.47970 0.55310 1.39330 -0.02190 0.14380  0.04230  676 HOH A O   
4767 O  O   . HOH I .   ? 0.60630 0.36710 0.41320 0.06740  -0.01230 -0.04480 677 HOH A O   
4768 O  O   . HOH I .   ? 0.85860 0.52310 0.82840 0.20800  0.01680  -0.18230 678 HOH A O   
4769 O  O   . HOH I .   ? 0.72400 0.88040 0.80700 0.29270  -0.09090 0.04800  679 HOH A O   
4770 O  O   . HOH I .   ? 0.59540 0.88190 0.94710 -0.23510 0.20970  0.27540  680 HOH A O   
4771 O  O   . HOH I .   ? 0.40080 0.69990 0.62910 0.01460  -0.13170 0.32900  681 HOH A O   
4772 O  O   . HOH I .   ? 1.01350 0.41120 0.42110 0.28060  -0.12840 -0.08810 682 HOH A O   
4773 O  O   . HOH I .   ? 0.72550 0.62650 1.03730 -0.00810 -0.31310 0.35350  683 HOH A O   
4774 O  O   . HOH I .   ? 1.48670 0.52370 0.70510 -0.30760 -0.05730 0.12710  684 HOH A O   
4775 O  O   . HOH I .   ? 0.30270 0.76030 0.87160 -0.00880 -0.02970 0.31430  685 HOH A O   
4776 O  O   . HOH I .   ? 0.90310 0.52100 0.77620 -0.03820 -0.44900 0.16420  686 HOH A O   
4777 O  O   . HOH I .   ? 0.50710 0.63220 0.87140 -0.12560 -0.08250 0.15510  687 HOH A O   
4778 O  O   . HOH I .   ? 0.92130 0.28250 0.62960 -0.02890 0.23580  -0.07850 688 HOH A O   
4779 O  O   . HOH I .   ? 0.29450 0.79510 0.93910 -0.16280 0.07000  -0.03200 689 HOH A O   
4780 O  O   . HOH I .   ? 0.82780 0.36040 0.34300 -0.10900 0.03590  -0.07320 690 HOH A O   
4781 O  O   . HOH I .   ? 0.77200 0.73130 0.68450 0.14500  0.00070  -0.03130 691 HOH A O   
4782 O  O   . HOH I .   ? 0.27340 0.59960 0.20390 0.07650  -0.02420 0.02030  692 HOH A O   
4783 O  O   . HOH I .   ? 0.95720 1.08750 0.46800 0.01910  0.19820  -0.12730 693 HOH A O   
4784 O  O   . HOH I .   ? 0.58670 0.84990 0.38170 -0.40530 0.08130  -0.10530 694 HOH A O   
4785 O  O   . HOH I .   ? 0.84780 0.80080 0.36530 0.05930  -0.24010 -0.05820 695 HOH A O   
4786 O  O   . HOH I .   ? 0.34960 0.70030 0.90930 0.00140  -0.14830 -0.32160 696 HOH A O   
4787 O  O   A HOH I .   ? 0.29800 0.43660 0.18600 -0.10300 -0.02440 0.02930  697 HOH A O   
4788 O  O   . HOH I .   ? 0.63630 0.85550 0.57320 -0.42610 0.08720  -0.09380 698 HOH A O   
4789 O  O   . HOH I .   ? 0.40990 0.67400 0.57390 0.21950  0.13310  0.16990  699 HOH A O   
4790 O  O   . HOH I .   ? 0.63020 0.39590 0.51830 -0.02960 -0.17100 0.14770  700 HOH A O   
4791 O  O   . HOH I .   ? 0.80680 0.44230 0.83370 0.18110  0.18540  0.21920  701 HOH A O   
4792 O  O   . HOH I .   ? 0.71870 0.75950 0.59100 -0.19820 0.03540  0.19630  702 HOH A O   
4793 O  O   . HOH I .   ? 0.48920 0.81580 0.72450 0.14930  0.30610  -0.05460 703 HOH A O   
4794 O  O   . HOH I .   ? 0.66270 0.46950 0.66300 0.09140  -0.37070 -0.16920 704 HOH A O   
4795 O  O   . HOH I .   ? 0.88220 0.45980 0.37360 -0.31400 -0.11370 0.01070  705 HOH A O   
4796 O  O   . HOH I .   ? 0.92240 1.00240 0.62760 -0.39810 -0.04860 0.17560  706 HOH A O   
4797 O  O   . HOH I .   ? 0.38630 0.44280 0.28930 0.01020  0.00550  -0.00520 707 HOH A O   
4798 O  O   A HOH I .   ? 0.46440 0.45810 0.78700 -0.22450 0.16320  -0.07760 708 HOH A O   
4799 O  O   B HOH I .   ? 0.49660 0.42740 0.83430 -0.17550 0.21270  0.03430  708 HOH A O   
4800 O  O   . HOH I .   ? 1.05330 1.02210 0.64800 0.26460  0.17810  0.10520  709 HOH A O   
4801 O  O   . HOH I .   ? 0.82600 0.41710 0.54980 -0.17730 -0.21590 -0.10080 710 HOH A O   
4802 O  O   . HOH I .   ? 0.35470 0.66320 0.43350 -0.09920 -0.02720 -0.10400 711 HOH A O   
4803 O  O   . HOH I .   ? 0.63960 0.65230 0.36240 0.05870  0.12500  0.07140  712 HOH A O   
4804 O  O   . HOH I .   ? 0.17080 0.24760 0.20410 -0.04440 -0.00180 -0.00500 713 HOH A O   
4805 O  O   . HOH I .   ? 0.41100 0.44750 0.35250 -0.01240 -0.01670 -0.06390 714 HOH A O   
4806 O  O   . HOH I .   ? 0.74590 0.55970 0.53060 -0.33340 -0.11170 -0.00660 715 HOH A O   
4807 O  O   . HOH I .   ? 0.85630 0.49570 0.61310 0.12840  0.30880  -0.12460 716 HOH A O   
4808 O  O   . HOH I .   ? 0.68020 0.63070 0.39190 -0.08220 0.06460  -0.16700 717 HOH A O   
4809 O  O   . HOH I .   ? 0.63260 0.74470 1.16290 0.08020  -0.45870 -0.15720 718 HOH A O   
4810 O  O   . HOH I .   ? 1.00820 0.49470 0.58430 0.02910  -0.38330 0.02920  719 HOH A O   
4811 O  O   . HOH I .   ? 1.09450 0.51880 0.78940 -0.22810 0.27200  0.11500  720 HOH A O   
4812 O  O   . HOH I .   ? 0.63940 0.50380 0.83960 -0.08100 0.29770  -0.20560 721 HOH A O   
4813 O  O   . HOH I .   ? 0.47200 0.52700 0.77330 -0.00580 0.06030  -0.25030 722 HOH A O   
4814 O  O   . HOH I .   ? 0.48620 0.64650 0.25170 0.17140  0.08070  0.10500  723 HOH A O   
4815 O  O   . HOH I .   ? 0.41330 0.40120 0.93640 0.05180  0.03710  -0.02010 724 HOH A O   
4816 O  O   . HOH I .   ? 0.66870 0.64490 0.39380 -0.13740 0.08910  -0.10030 725 HOH A O   
4817 O  O   . HOH I .   ? 0.56280 0.50240 1.22560 0.20730  -0.00310 -0.12970 726 HOH A O   
4818 O  O   . HOH I .   ? 0.22930 0.31260 0.28830 0.00310  0.00730  0.03140  727 HOH A O   
4819 O  O   . HOH I .   ? 0.51230 0.82710 0.85960 0.16290  -0.04070 0.13500  728 HOH A O   
4820 O  O   . HOH I .   ? 0.40090 0.47160 0.48900 -0.02780 0.03610  0.08290  729 HOH A O   
4821 O  O   . HOH I .   ? 0.73220 0.48550 0.26650 0.10350  -0.03780 0.07390  730 HOH A O   
4822 O  O   . HOH I .   ? 0.82220 0.86170 0.58160 -0.08740 -0.15090 0.21940  731 HOH A O   
4823 O  O   . HOH I .   ? 0.57510 0.69400 0.47430 0.05530  0.14280  -0.05100 732 HOH A O   
4824 O  O   . HOH I .   ? 0.36760 0.66040 0.26940 -0.12270 -0.04710 0.01000  733 HOH A O   
4825 O  O   . HOH I .   ? 0.60430 0.56530 0.71150 -0.20070 -0.36020 0.17300  734 HOH A O   
4826 O  O   . HOH I .   ? 0.36700 0.80710 0.28280 0.04990  -0.01100 0.00020  735 HOH A O   
4827 O  O   . HOH I .   ? 0.52930 0.39330 0.42910 0.19620  -0.04030 -0.07080 736 HOH A O   
4828 O  O   . HOH I .   ? 0.78350 0.62970 0.48530 -0.21430 -0.27380 0.10250  737 HOH A O   
4829 O  O   . HOH I .   ? 0.96710 0.97130 0.32410 0.11980  -0.14190 0.09850  738 HOH A O   
4830 O  O   . HOH I .   ? 0.45390 1.02000 0.61290 0.23770  -0.09040 -0.28030 739 HOH A O   
4831 O  O   . HOH I .   ? 1.15200 0.64140 0.36410 -0.44040 0.07360  -0.05370 740 HOH A O   
4832 O  O   . HOH I .   ? 0.22900 0.43740 0.32740 -0.05380 0.03690  -0.11350 741 HOH A O   
4833 O  O   . HOH I .   ? 0.56810 1.15670 0.77630 -0.29440 0.01140  -0.24560 742 HOH A O   
4834 O  O   . HOH I .   ? 0.95950 0.50190 0.70010 0.21100  -0.09100 -0.27600 743 HOH A O   
4835 O  O   . HOH I .   ? 0.50270 0.31040 0.33860 0.02030  -0.05560 0.08110  744 HOH A O   
4836 O  O   . HOH I .   ? 0.30840 0.55290 0.53310 -0.07480 0.00090  0.07840  745 HOH A O   
4837 O  O   . HOH I .   ? 0.29640 0.84940 0.48350 -0.00650 0.01080  0.05280  746 HOH A O   
4838 O  O   . HOH I .   ? 1.17440 0.51340 0.89470 0.12350  -0.33520 0.07430  747 HOH A O   
4839 O  O   . HOH I .   ? 0.84460 0.52440 1.04470 -0.30290 0.19550  -0.21700 748 HOH A O   
4840 O  O   . HOH I .   ? 0.63280 0.70800 0.61440 -0.37790 -0.16130 0.18710  749 HOH A O   
4841 O  O   . HOH I .   ? 0.49900 0.77130 0.43850 -0.15930 0.13440  -0.09250 750 HOH A O   
4842 O  O   . HOH I .   ? 0.47620 0.50510 0.37840 0.05700  0.01380  0.03300  751 HOH A O   
4843 O  O   . HOH I .   ? 0.57040 0.63870 0.55220 0.01520  0.09930  -0.24840 752 HOH A O   
4844 O  O   . HOH I .   ? 0.97920 0.72880 0.56090 -0.02670 0.19150  -0.27110 753 HOH A O   
4845 O  O   . HOH I .   ? 0.51490 0.80830 0.55690 -0.31300 0.19850  -0.22170 754 HOH A O   
4846 O  O   . HOH I .   ? 0.48310 0.55950 0.46690 0.07200  -0.00610 -0.22380 755 HOH A O   
4847 O  O   . HOH I .   ? 0.82740 0.99090 0.38130 0.10190  0.11000  0.18320  756 HOH A O   
4848 O  O   . HOH I .   ? 1.22940 0.82510 0.31620 0.09570  -0.02660 0.03260  757 HOH A O   
4849 O  O   . HOH I .   ? 0.43310 0.44350 0.45480 0.19040  -0.21490 -0.22720 758 HOH A O   
4850 O  O   . HOH I .   ? 0.66850 1.05290 0.70600 -0.25430 0.22250  -0.46270 759 HOH A O   
4851 O  O   . HOH I .   ? 1.09620 0.52800 0.70540 0.14290  0.26910  -0.18420 760 HOH A O   
4852 O  O   . HOH I .   ? 0.33670 0.47100 0.45520 -0.01350 -0.07850 0.04300  761 HOH A O   
4853 O  O   . HOH I .   ? 0.87520 0.60770 0.80800 0.28930  0.34410  0.19660  762 HOH A O   
4854 O  O   . HOH I .   ? 0.56260 0.56400 0.58600 -0.24490 0.12820  -0.15650 763 HOH A O   
4855 O  O   . HOH I .   ? 0.48000 0.92150 0.51920 0.26500  0.08820  -0.11330 764 HOH A O   
4856 O  O   . HOH I .   ? 0.23640 0.37430 0.38820 -0.01260 -0.00870 -0.00550 765 HOH A O   
4857 O  O   . HOH I .   ? 0.66210 0.92870 0.38130 -0.36730 0.12980  -0.16470 766 HOH A O   
4858 O  O   . HOH I .   ? 0.54620 0.48310 0.91060 0.05160  0.31750  -0.13570 767 HOH A O   
4859 O  O   . HOH I .   ? 0.85290 0.46620 0.50330 0.20990  -0.15770 -0.12260 768 HOH A O   
4860 O  O   . HOH I .   ? 0.85990 0.86570 0.48880 0.13300  0.05530  -0.14080 769 HOH A O   
4861 O  O   . HOH I .   ? 0.61560 0.44680 1.05920 0.06800  -0.26710 0.20090  770 HOH A O   
4862 O  O   . HOH I .   ? 0.34690 0.84340 0.56980 -0.03470 -0.00060 0.26890  771 HOH A O   
4863 O  O   . HOH I .   ? 1.14070 0.44980 0.79400 0.20120  -0.42800 -0.03340 772 HOH A O   
4864 O  O   . HOH I .   ? 1.07680 0.38120 0.62200 -0.15340 0.02460  0.15510  773 HOH A O   
4865 O  O   . HOH I .   ? 0.30210 0.50670 0.27110 0.05340  0.03530  0.10480  774 HOH A O   
4866 O  O   . HOH I .   ? 0.43000 1.10730 0.59660 0.09490  0.01250  0.04400  775 HOH A O   
4867 O  O   . HOH I .   ? 0.33860 0.35860 0.32070 0.00960  0.01620  -0.05290 776 HOH A O   
4868 O  O   . HOH I .   ? 0.71970 0.40240 0.60280 -0.02140 -0.10400 -0.05950 777 HOH A O   
4869 O  O   . HOH I .   ? 0.40080 0.53240 0.75090 -0.14310 -0.11820 0.15040  778 HOH A O   
4870 O  O   . HOH I .   ? 0.29220 0.86580 0.42110 0.16380  0.06510  0.20440  779 HOH A O   
4871 O  O   . HOH I .   ? 0.50230 0.42170 0.69320 -0.09920 -0.15310 0.15420  780 HOH A O   
4872 O  O   . HOH I .   ? 0.55050 0.82090 0.25850 0.20590  -0.00010 0.01600  781 HOH A O   
4873 O  O   . HOH I .   ? 0.61890 0.41940 0.84600 0.05560  0.38630  -0.05720 782 HOH A O   
4874 O  O   . HOH I .   ? 0.52170 0.30410 0.88770 -0.10180 -0.01670 -0.11210 783 HOH A O   
4875 O  O   . HOH I .   ? 0.78320 0.68530 0.80800 -0.07870 -0.12280 -0.09010 784 HOH A O   
4876 O  O   . HOH I .   ? 0.75920 0.44230 0.50400 0.07910  -0.01570 0.18710  785 HOH A O   
4877 O  O   . HOH I .   ? 0.22920 0.48460 0.21540 -0.00200 -0.00610 -0.04110 786 HOH A O   
4878 O  O   . HOH I .   ? 0.39370 0.35850 1.11600 0.01790  0.24530  0.02100  787 HOH A O   
4879 O  O   . HOH I .   ? 0.79070 1.05390 0.71770 -0.30950 0.03550  -0.21670 788 HOH A O   
4880 O  O   . HOH I .   ? 0.50000 0.52890 0.45310 0.13430  -0.16180 -0.14870 789 HOH A O   
4881 O  O   . HOH I .   ? 0.40430 0.61920 0.67250 -0.02270 0.04900  0.02560  790 HOH A O   
4882 O  O   . HOH I .   ? 0.55880 0.71110 0.41080 -0.03460 0.12630  -0.07160 791 HOH A O   
4883 O  O   . HOH I .   ? 0.69810 0.94460 0.49880 0.26780  -0.02930 -0.09530 792 HOH A O   
4884 O  O   . HOH I .   ? 0.45400 0.44550 0.72210 -0.06220 0.19040  0.00410  793 HOH A O   
4885 O  O   . HOH I .   ? 0.32260 0.92230 0.26010 -0.09210 0.03020  -0.04010 794 HOH A O   
4886 O  O   . HOH I .   ? 1.17130 0.57150 0.65220 0.40880  -0.07590 -0.11200 795 HOH A O   
4887 O  O   . HOH I .   ? 0.90680 0.98310 0.65340 -0.03800 0.28220  0.35060  796 HOH A O   
4888 O  O   . HOH I .   ? 0.38220 0.96280 0.64900 -0.13570 -0.05910 0.27950  797 HOH A O   
4889 O  O   . HOH I .   ? 0.75640 0.73270 0.40500 0.05680  -0.02110 -0.22150 798 HOH A O   
4890 O  O   . HOH I .   ? 0.94700 0.69600 0.45710 -0.00130 -0.20380 -0.05820 799 HOH A O   
4891 O  O   . HOH I .   ? 0.39090 1.16850 0.38720 0.22900  0.05760  0.07740  800 HOH A O   
4892 O  O   . HOH I .   ? 0.65100 0.90770 0.34000 -0.07900 -0.12110 0.04020  801 HOH A O   
4893 O  O   . HOH I .   ? 0.50170 1.10980 0.55520 -0.30490 0.06580  0.08680  802 HOH A O   
4894 O  O   . HOH I .   ? 0.69070 0.70900 0.66600 0.05840  0.21380  0.21810  803 HOH A O   
4895 O  O   . HOH I .   ? 0.85730 0.88490 0.65360 0.32350  0.20410  -0.21580 804 HOH A O   
4896 O  O   . HOH I .   ? 0.41070 0.41050 0.31850 -0.05710 0.05720  0.10870  805 HOH A O   
4897 O  O   . HOH I .   ? 0.52630 0.79240 0.59010 0.31160  0.07320  0.16140  806 HOH A O   
4898 O  O   . HOH I .   ? 0.96810 0.65530 0.34910 0.13280  0.17300  -0.07120 807 HOH A O   
4899 O  O   . HOH I .   ? 0.65070 0.58680 1.00220 -0.02550 -0.12870 -0.08210 808 HOH A O   
4900 O  O   . HOH I .   ? 0.41110 0.63410 0.81990 0.16650  0.11800  -0.00580 809 HOH A O   
4901 O  O   . HOH I .   ? 0.81530 0.64220 0.82550 -0.10900 0.22950  -0.14940 810 HOH A O   
4902 O  O   . HOH I .   ? 0.30480 0.27640 0.23950 0.03230  -0.04390 0.03830  811 HOH A O   
# 
