data_9FQP
# 
_entry.id   9FQP 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9FQP         pdb_00009fqp 10.2210/pdb9fqp/pdb 
WWPDB D_1292139475 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 2025-01-29 
2 'Structure model' 1 1 2025-02-26 
# 
_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_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' citation        
2 2 'Structure model' citation_author 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.journal_volume'          
2 2 'Structure model' '_citation.page_first'              
3 2 'Structure model' '_citation.page_last'               
4 2 'Structure model' '_citation_author.identifier_ORCID' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9FQP 
_pdbx_database_status.recvd_initial_deposition_date   2024-06-17 
_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           N 
# 
_pdbx_contact_author.id                 3 
_pdbx_contact_author.email              brendan@scorpiontx.com 
_pdbx_contact_author.name_first         Brendan 
_pdbx_contact_author.name_last          Hilbert 
_pdbx_contact_author.name_mi            J 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-9353-1799 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Hilbert, B.J.'    1 0000-0001-9353-1799 
'Brooijmans, N.'   2 0000-0003-3514-4189 
'Milgram, B.C.'    3 0009-0008-5824-4645 
'Pagliarini, R.A.' 4 0000-0001-8920-8198 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            J.Med.Chem. 
_citation.journal_id_ASTM           JMCMAR 
_citation.journal_id_CSD            0151 
_citation.journal_id_ISSN           0022-2623 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            68 
_citation.language                  ? 
_citation.page_first                2403 
_citation.page_last                 2421 
_citation.title                     
;Discovery of STX-721, a Covalent, Potent, and Highly Mutant-Selective EGFR/HER2 Exon20 Insertion Inhibitor for the Treatment of Non-Small Cell Lung Cancer.
;
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1021/acs.jmedchem.4c02377 
_citation.pdbx_database_id_PubMed   39824516 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Milgram, B.C.'    1  ? 
primary 'Borrelli, D.R.'   2  ? 
primary 'Brooijmans, N.'   3  ? 
primary 'Henderson, J.A.'  4  ? 
primary 'Hilbert, B.J.'    5  ? 
primary 'Huff, M.R.'       6  ? 
primary 'Ito, T.'          7  ? 
primary 'Jackson, E.L.'    8  ? 
primary 'Jonsson, P.'      9  ? 
primary 'Ladd, B.'         10 ? 
primary 
;O'Hearn, E.L.
;
11 ? 
primary 'Pagliarini, R.A.' 12 ? 
primary 'Roberts, S.A.'    13 ? 
primary 'Ronseaux, S.'     14 ? 
primary 'Stuart, D.D.'     15 ? 
primary 'Wang, W.'         16 ? 
primary 'Guzman-Perez, A.' 17 ? 
# 
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 'Epidermal growth factor receptor' 38677.609 1  2.7.10.1 'V948R D770_N771insNPG' ? ? 
2 non-polymer syn 
;(7~{S})-3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-(3-fluoranylpyridin-4-yl)-7-(2-methoxyethyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
;
444.886   1  ?        ?                       ? ? 
3 water       nat water 18.015    84 ?        ?                       ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Proto-oncogene c-ErbB-1,Receptor tyrosine-protein kinase erbB-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       
;MSGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPG
NPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQH
VKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKG
ERLPQPPICTIDVYMIMRKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDV
VDADEYLIPQQGHHHHHH
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MSGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPG
NPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQH
VKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKG
ERLPQPPICTIDVYMIMRKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDV
VDADEYLIPQQGHHHHHH
;
_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 
;(7~{S})-3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-(3-fluoranylpyridin-4-yl)-7-(2-methoxyethyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
;
A1IEZ 
3 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   SER n 
1 3   GLY n 
1 4   GLU n 
1 5   ALA n 
1 6   PRO n 
1 7   ASN n 
1 8   GLN n 
1 9   ALA n 
1 10  LEU n 
1 11  LEU n 
1 12  ARG n 
1 13  ILE n 
1 14  LEU n 
1 15  LYS n 
1 16  GLU n 
1 17  THR n 
1 18  GLU n 
1 19  PHE n 
1 20  LYS n 
1 21  LYS n 
1 22  ILE n 
1 23  LYS n 
1 24  VAL n 
1 25  LEU n 
1 26  GLY n 
1 27  SER n 
1 28  GLY n 
1 29  ALA n 
1 30  PHE n 
1 31  GLY n 
1 32  THR n 
1 33  VAL n 
1 34  TYR n 
1 35  LYS n 
1 36  GLY n 
1 37  LEU n 
1 38  TRP n 
1 39  ILE n 
1 40  PRO n 
1 41  GLU n 
1 42  GLY n 
1 43  GLU n 
1 44  LYS n 
1 45  VAL n 
1 46  LYS n 
1 47  ILE n 
1 48  PRO n 
1 49  VAL n 
1 50  ALA n 
1 51  ILE n 
1 52  LYS n 
1 53  GLU n 
1 54  LEU n 
1 55  ARG n 
1 56  GLU n 
1 57  ALA n 
1 58  THR n 
1 59  SER n 
1 60  PRO n 
1 61  LYS n 
1 62  ALA n 
1 63  ASN n 
1 64  LYS n 
1 65  GLU n 
1 66  ILE n 
1 67  LEU n 
1 68  ASP n 
1 69  GLU n 
1 70  ALA n 
1 71  TYR n 
1 72  VAL n 
1 73  MET n 
1 74  ALA n 
1 75  SER n 
1 76  VAL n 
1 77  ASP n 
1 78  ASN n 
1 79  PRO n 
1 80  GLY n 
1 81  ASN n 
1 82  PRO n 
1 83  HIS n 
1 84  VAL n 
1 85  CYS n 
1 86  ARG n 
1 87  LEU n 
1 88  LEU n 
1 89  GLY n 
1 90  ILE n 
1 91  CYS n 
1 92  LEU n 
1 93  THR n 
1 94  SER n 
1 95  THR n 
1 96  VAL n 
1 97  GLN n 
1 98  LEU n 
1 99  ILE n 
1 100 THR n 
1 101 GLN n 
1 102 LEU n 
1 103 MET n 
1 104 PRO n 
1 105 PHE n 
1 106 GLY n 
1 107 CYS n 
1 108 LEU n 
1 109 LEU n 
1 110 ASP n 
1 111 TYR n 
1 112 VAL n 
1 113 ARG n 
1 114 GLU n 
1 115 HIS n 
1 116 LYS n 
1 117 ASP n 
1 118 ASN n 
1 119 ILE n 
1 120 GLY n 
1 121 SER n 
1 122 GLN n 
1 123 TYR n 
1 124 LEU n 
1 125 LEU n 
1 126 ASN n 
1 127 TRP n 
1 128 CYS n 
1 129 VAL n 
1 130 GLN n 
1 131 ILE n 
1 132 ALA n 
1 133 LYS n 
1 134 GLY n 
1 135 MET n 
1 136 ASN n 
1 137 TYR n 
1 138 LEU n 
1 139 GLU n 
1 140 ASP n 
1 141 ARG n 
1 142 ARG n 
1 143 LEU n 
1 144 VAL n 
1 145 HIS n 
1 146 ARG n 
1 147 ASP n 
1 148 LEU n 
1 149 ALA n 
1 150 ALA n 
1 151 ARG n 
1 152 ASN n 
1 153 VAL n 
1 154 LEU n 
1 155 VAL n 
1 156 LYS n 
1 157 THR n 
1 158 PRO n 
1 159 GLN n 
1 160 HIS n 
1 161 VAL n 
1 162 LYS n 
1 163 ILE n 
1 164 THR n 
1 165 ASP n 
1 166 PHE n 
1 167 GLY n 
1 168 LEU n 
1 169 ALA n 
1 170 LYS n 
1 171 LEU n 
1 172 LEU n 
1 173 GLY n 
1 174 ALA n 
1 175 GLU n 
1 176 GLU n 
1 177 LYS n 
1 178 GLU n 
1 179 TYR n 
1 180 HIS n 
1 181 ALA n 
1 182 GLU n 
1 183 GLY n 
1 184 GLY n 
1 185 LYS n 
1 186 VAL n 
1 187 PRO n 
1 188 ILE n 
1 189 LYS n 
1 190 TRP n 
1 191 MET n 
1 192 ALA n 
1 193 LEU n 
1 194 GLU n 
1 195 SER n 
1 196 ILE n 
1 197 LEU n 
1 198 HIS n 
1 199 ARG n 
1 200 ILE n 
1 201 TYR n 
1 202 THR n 
1 203 HIS n 
1 204 GLN n 
1 205 SER n 
1 206 ASP n 
1 207 VAL n 
1 208 TRP n 
1 209 SER n 
1 210 TYR n 
1 211 GLY n 
1 212 VAL n 
1 213 THR n 
1 214 VAL n 
1 215 TRP n 
1 216 GLU n 
1 217 LEU n 
1 218 MET n 
1 219 THR n 
1 220 PHE n 
1 221 GLY n 
1 222 SER n 
1 223 LYS n 
1 224 PRO n 
1 225 TYR n 
1 226 ASP n 
1 227 GLY n 
1 228 ILE n 
1 229 PRO n 
1 230 ALA n 
1 231 SER n 
1 232 GLU n 
1 233 ILE n 
1 234 SER n 
1 235 SER n 
1 236 ILE n 
1 237 LEU n 
1 238 GLU n 
1 239 LYS n 
1 240 GLY n 
1 241 GLU n 
1 242 ARG n 
1 243 LEU n 
1 244 PRO n 
1 245 GLN n 
1 246 PRO n 
1 247 PRO n 
1 248 ILE n 
1 249 CYS n 
1 250 THR n 
1 251 ILE n 
1 252 ASP n 
1 253 VAL n 
1 254 TYR n 
1 255 MET n 
1 256 ILE n 
1 257 MET n 
1 258 ARG n 
1 259 LYS n 
1 260 CYS n 
1 261 TRP n 
1 262 MET n 
1 263 ILE n 
1 264 ASP n 
1 265 ALA n 
1 266 ASP n 
1 267 SER n 
1 268 ARG n 
1 269 PRO n 
1 270 LYS n 
1 271 PHE n 
1 272 ARG n 
1 273 GLU n 
1 274 LEU n 
1 275 ILE n 
1 276 ILE n 
1 277 GLU n 
1 278 PHE n 
1 279 SER n 
1 280 LYS n 
1 281 MET n 
1 282 ALA n 
1 283 ARG n 
1 284 ASP n 
1 285 PRO n 
1 286 GLN n 
1 287 ARG n 
1 288 TYR n 
1 289 LEU n 
1 290 VAL n 
1 291 ILE n 
1 292 GLN n 
1 293 GLY n 
1 294 ASP n 
1 295 GLU n 
1 296 ARG n 
1 297 MET n 
1 298 HIS n 
1 299 LEU n 
1 300 PRO n 
1 301 SER n 
1 302 PRO n 
1 303 THR n 
1 304 ASP n 
1 305 SER n 
1 306 ASN n 
1 307 PHE n 
1 308 TYR n 
1 309 ARG n 
1 310 ALA n 
1 311 LEU n 
1 312 MET n 
1 313 ASP n 
1 314 GLU n 
1 315 GLU n 
1 316 ASP n 
1 317 MET n 
1 318 ASP n 
1 319 ASP n 
1 320 VAL n 
1 321 VAL n 
1 322 ASP n 
1 323 ALA n 
1 324 ASP n 
1 325 GLU n 
1 326 TYR n 
1 327 LEU n 
1 328 ILE n 
1 329 PRO n 
1 330 GLN n 
1 331 GLN n 
1 332 GLY n 
1 333 HIS n 
1 334 HIS n 
1 335 HIS n 
1 336 HIS n 
1 337 HIS n 
1 338 HIS n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   338 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'EGFR, ERBB, ERBB1, HER1' 
_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      'Homo sapiens' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9606 
_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      'Spodoptera frugiperda' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     7108 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
A1IEZ non-polymer         . 
;(7~{S})-3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-(3-fluoranylpyridin-4-yl)-7-(2-methoxyethyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
;
? 'C22 H22 Cl F N4 O3' 444.886 
ALA   'L-peptide linking' y ALANINE ? 'C3 H7 N O2'         89.093  
ARG   'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1'     175.209 
ASN   'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3'        132.118 
ASP   'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'         133.103 
CYS   'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S'       121.158 
GLN   'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3'       146.144 
GLU   'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4'         147.129 
GLY   'peptide linking'   y GLYCINE ? 'C2 H5 N O2'         75.067  
HIS   'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1'     156.162 
HOH   non-polymer         . WATER ? 'H2 O'               18.015  
ILE   'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2'        131.173 
LEU   'L-peptide linking' y LEUCINE ? 'C6 H13 N O2'        131.173 
LYS   'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1'     147.195 
MET   'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S'      149.211 
PHE   'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2'        165.189 
PRO   'L-peptide linking' y PROLINE ? 'C5 H9 N O2'         115.130 
SER   'L-peptide linking' y SERINE ? 'C3 H7 N O3'         105.093 
THR   'L-peptide linking' y THREONINE ? 'C4 H9 N O3'         119.119 
TRP   'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2'      204.225 
TYR   'L-peptide linking' y TYROSINE ? 'C9 H11 N O3'        181.189 
VAL   'L-peptide linking' y VALINE ? 'C5 H11 N O2'        117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   694  ?    ?   ?   A . n 
A 1 2   SER 2   695  ?    ?   ?   A . n 
A 1 3   GLY 3   696  ?    ?   ?   A . n 
A 1 4   GLU 4   697  ?    ?   ?   A . n 
A 1 5   ALA 5   698  ?    ?   ?   A . n 
A 1 6   PRO 6   699  ?    ?   ?   A . n 
A 1 7   ASN 7   700  ?    ?   ?   A . n 
A 1 8   GLN 8   701  701  GLN GLN A . n 
A 1 9   ALA 9   702  702  ALA ALA A . n 
A 1 10  LEU 10  703  703  LEU LEU A . n 
A 1 11  LEU 11  704  704  LEU LEU A . n 
A 1 12  ARG 12  705  705  ARG ARG A . n 
A 1 13  ILE 13  706  706  ILE ILE A . n 
A 1 14  LEU 14  707  707  LEU LEU A . n 
A 1 15  LYS 15  708  708  LYS LYS A . n 
A 1 16  GLU 16  709  709  GLU GLU A . n 
A 1 17  THR 17  710  710  THR THR A . n 
A 1 18  GLU 18  711  711  GLU GLU A . n 
A 1 19  PHE 19  712  712  PHE PHE A . n 
A 1 20  LYS 20  713  713  LYS LYS A . n 
A 1 21  LYS 21  714  714  LYS LYS A . n 
A 1 22  ILE 22  715  715  ILE ILE A . n 
A 1 23  LYS 23  716  716  LYS LYS A . n 
A 1 24  VAL 24  717  717  VAL VAL A . n 
A 1 25  LEU 25  718  718  LEU LEU A . n 
A 1 26  GLY 26  719  719  GLY GLY A . n 
A 1 27  SER 27  720  720  SER SER A . n 
A 1 28  GLY 28  721  721  GLY GLY A . n 
A 1 29  ALA 29  722  722  ALA ALA A . n 
A 1 30  PHE 30  723  723  PHE PHE A . n 
A 1 31  GLY 31  724  724  GLY GLY A . n 
A 1 32  THR 32  725  725  THR THR A . n 
A 1 33  VAL 33  726  726  VAL VAL A . n 
A 1 34  TYR 34  727  727  TYR TYR A . n 
A 1 35  LYS 35  728  728  LYS LYS A . n 
A 1 36  GLY 36  729  729  GLY GLY A . n 
A 1 37  LEU 37  730  730  LEU LEU A . n 
A 1 38  TRP 38  731  731  TRP TRP A . n 
A 1 39  ILE 39  732  732  ILE ILE A . n 
A 1 40  PRO 40  733  733  PRO PRO A . n 
A 1 41  GLU 41  734  734  GLU GLU A . n 
A 1 42  GLY 42  735  735  GLY GLY A . n 
A 1 43  GLU 43  736  736  GLU GLU A . n 
A 1 44  LYS 44  737  737  LYS LYS A . n 
A 1 45  VAL 45  738  738  VAL VAL A . n 
A 1 46  LYS 46  739  739  LYS LYS A . n 
A 1 47  ILE 47  740  740  ILE ILE A . n 
A 1 48  PRO 48  741  741  PRO PRO A . n 
A 1 49  VAL 49  742  742  VAL VAL A . n 
A 1 50  ALA 50  743  743  ALA ALA A . n 
A 1 51  ILE 51  744  744  ILE ILE A . n 
A 1 52  LYS 52  745  745  LYS LYS A . n 
A 1 53  GLU 53  746  746  GLU GLU A . n 
A 1 54  LEU 54  747  747  LEU LEU A . n 
A 1 55  ARG 55  748  ?    ?   ?   A . n 
A 1 56  GLU 56  749  ?    ?   ?   A . n 
A 1 57  ALA 57  750  ?    ?   ?   A . n 
A 1 58  THR 58  751  ?    ?   ?   A . n 
A 1 59  SER 59  752  ?    ?   ?   A . n 
A 1 60  PRO 60  753  ?    ?   ?   A . n 
A 1 61  LYS 61  754  ?    ?   ?   A . n 
A 1 62  ALA 62  755  755  ALA ALA A . n 
A 1 63  ASN 63  756  756  ASN ASN A . n 
A 1 64  LYS 64  757  757  LYS LYS A . n 
A 1 65  GLU 65  758  758  GLU GLU A . n 
A 1 66  ILE 66  759  759  ILE ILE A . n 
A 1 67  LEU 67  760  760  LEU LEU A . n 
A 1 68  ASP 68  761  761  ASP ASP A . n 
A 1 69  GLU 69  762  762  GLU GLU A . n 
A 1 70  ALA 70  763  763  ALA ALA A . n 
A 1 71  TYR 71  764  764  TYR TYR A . n 
A 1 72  VAL 72  765  765  VAL VAL A . n 
A 1 73  MET 73  766  766  MET MET A . n 
A 1 74  ALA 74  767  767  ALA ALA A . n 
A 1 75  SER 75  768  768  SER SER A . n 
A 1 76  VAL 76  769  769  VAL VAL A . n 
A 1 77  ASP 77  770  770  ASP ASP A . n 
A 1 78  ASN 78  770  770  ASN ASN A A n 
A 1 79  PRO 79  770  770  PRO PRO A B n 
A 1 80  GLY 80  770  770  GLY GLY A C n 
A 1 81  ASN 81  771  771  ASN ASN A . n 
A 1 82  PRO 82  772  772  PRO PRO A . n 
A 1 83  HIS 83  773  773  HIS HIS A . n 
A 1 84  VAL 84  774  774  VAL VAL A . n 
A 1 85  CYS 85  775  775  CYS CYS A . n 
A 1 86  ARG 86  776  776  ARG ARG A . n 
A 1 87  LEU 87  777  777  LEU LEU A . n 
A 1 88  LEU 88  778  778  LEU LEU A . n 
A 1 89  GLY 89  779  779  GLY GLY A . n 
A 1 90  ILE 90  780  780  ILE ILE A . n 
A 1 91  CYS 91  781  781  CYS CYS A . n 
A 1 92  LEU 92  782  782  LEU LEU A . n 
A 1 93  THR 93  783  783  THR THR A . n 
A 1 94  SER 94  784  784  SER SER A . n 
A 1 95  THR 95  785  785  THR THR A . n 
A 1 96  VAL 96  786  786  VAL VAL A . n 
A 1 97  GLN 97  787  787  GLN GLN A . n 
A 1 98  LEU 98  788  788  LEU LEU A . n 
A 1 99  ILE 99  789  789  ILE ILE A . n 
A 1 100 THR 100 790  790  THR THR A . n 
A 1 101 GLN 101 791  791  GLN GLN A . n 
A 1 102 LEU 102 792  792  LEU LEU A . n 
A 1 103 MET 103 793  793  MET MET A . n 
A 1 104 PRO 104 794  794  PRO PRO A . n 
A 1 105 PHE 105 795  795  PHE PHE A . n 
A 1 106 GLY 106 796  796  GLY GLY A . n 
A 1 107 CYS 107 797  797  CYS CYS A . n 
A 1 108 LEU 108 798  798  LEU LEU A . n 
A 1 109 LEU 109 799  799  LEU LEU A . n 
A 1 110 ASP 110 800  800  ASP ASP A . n 
A 1 111 TYR 111 801  801  TYR TYR A . n 
A 1 112 VAL 112 802  802  VAL VAL A . n 
A 1 113 ARG 113 803  803  ARG ARG A . n 
A 1 114 GLU 114 804  804  GLU GLU A . n 
A 1 115 HIS 115 805  805  HIS HIS A . n 
A 1 116 LYS 116 806  806  LYS LYS A . n 
A 1 117 ASP 117 807  807  ASP ASP A . n 
A 1 118 ASN 118 808  808  ASN ASN A . n 
A 1 119 ILE 119 809  809  ILE ILE A . n 
A 1 120 GLY 120 810  810  GLY GLY A . n 
A 1 121 SER 121 811  811  SER SER A . n 
A 1 122 GLN 122 812  812  GLN GLN A . n 
A 1 123 TYR 123 813  813  TYR TYR A . n 
A 1 124 LEU 124 814  814  LEU LEU A . n 
A 1 125 LEU 125 815  815  LEU LEU A . n 
A 1 126 ASN 126 816  816  ASN ASN A . n 
A 1 127 TRP 127 817  817  TRP TRP A . n 
A 1 128 CYS 128 818  818  CYS CYS A . n 
A 1 129 VAL 129 819  819  VAL VAL A . n 
A 1 130 GLN 130 820  820  GLN GLN A . n 
A 1 131 ILE 131 821  821  ILE ILE A . n 
A 1 132 ALA 132 822  822  ALA ALA A . n 
A 1 133 LYS 133 823  823  LYS LYS A . n 
A 1 134 GLY 134 824  824  GLY GLY A . n 
A 1 135 MET 135 825  825  MET MET A . n 
A 1 136 ASN 136 826  826  ASN ASN A . n 
A 1 137 TYR 137 827  827  TYR TYR A . n 
A 1 138 LEU 138 828  828  LEU LEU A . n 
A 1 139 GLU 139 829  829  GLU GLU A . n 
A 1 140 ASP 140 830  830  ASP ASP A . n 
A 1 141 ARG 141 831  831  ARG ARG A . n 
A 1 142 ARG 142 832  832  ARG ARG A . n 
A 1 143 LEU 143 833  833  LEU LEU A . n 
A 1 144 VAL 144 834  834  VAL VAL A . n 
A 1 145 HIS 145 835  835  HIS HIS A . n 
A 1 146 ARG 146 836  836  ARG ARG A . n 
A 1 147 ASP 147 837  837  ASP ASP A . n 
A 1 148 LEU 148 838  838  LEU LEU A . n 
A 1 149 ALA 149 839  839  ALA ALA A . n 
A 1 150 ALA 150 840  840  ALA ALA A . n 
A 1 151 ARG 151 841  841  ARG ARG A . n 
A 1 152 ASN 152 842  842  ASN ASN A . n 
A 1 153 VAL 153 843  843  VAL VAL A . n 
A 1 154 LEU 154 844  844  LEU LEU A . n 
A 1 155 VAL 155 845  845  VAL VAL A . n 
A 1 156 LYS 156 846  846  LYS LYS A . n 
A 1 157 THR 157 847  847  THR THR A . n 
A 1 158 PRO 158 848  848  PRO PRO A . n 
A 1 159 GLN 159 849  849  GLN GLN A . n 
A 1 160 HIS 160 850  850  HIS HIS A . n 
A 1 161 VAL 161 851  851  VAL VAL A . n 
A 1 162 LYS 162 852  852  LYS LYS A . n 
A 1 163 ILE 163 853  853  ILE ILE A . n 
A 1 164 THR 164 854  854  THR THR A . n 
A 1 165 ASP 165 855  855  ASP ASP A . n 
A 1 166 PHE 166 856  856  PHE PHE A . n 
A 1 167 GLY 167 857  857  GLY GLY A . n 
A 1 168 LEU 168 858  858  LEU LEU A . n 
A 1 169 ALA 169 859  859  ALA ALA A . n 
A 1 170 LYS 170 860  860  LYS LYS A . n 
A 1 171 LEU 171 861  861  LEU LEU A . n 
A 1 172 LEU 172 862  862  LEU LEU A . n 
A 1 173 GLY 173 863  863  GLY GLY A . n 
A 1 174 ALA 174 864  864  ALA ALA A . n 
A 1 175 GLU 175 865  865  GLU GLU A . n 
A 1 176 GLU 176 866  866  GLU GLU A . n 
A 1 177 LYS 177 867  867  LYS LYS A . n 
A 1 178 GLU 178 868  868  GLU GLU A . n 
A 1 179 TYR 179 869  869  TYR TYR A . n 
A 1 180 HIS 180 870  870  HIS HIS A . n 
A 1 181 ALA 181 871  871  ALA ALA A . n 
A 1 182 GLU 182 872  872  GLU GLU A . n 
A 1 183 GLY 183 873  873  GLY GLY A . n 
A 1 184 GLY 184 874  874  GLY GLY A . n 
A 1 185 LYS 185 875  875  LYS LYS A . n 
A 1 186 VAL 186 876  876  VAL VAL A . n 
A 1 187 PRO 187 877  877  PRO PRO A . n 
A 1 188 ILE 188 878  878  ILE ILE A . n 
A 1 189 LYS 189 879  879  LYS LYS A . n 
A 1 190 TRP 190 880  880  TRP TRP A . n 
A 1 191 MET 191 881  881  MET MET A . n 
A 1 192 ALA 192 882  882  ALA ALA A . n 
A 1 193 LEU 193 883  883  LEU LEU A . n 
A 1 194 GLU 194 884  884  GLU GLU A . n 
A 1 195 SER 195 885  885  SER SER A . n 
A 1 196 ILE 196 886  886  ILE ILE A . n 
A 1 197 LEU 197 887  887  LEU LEU A . n 
A 1 198 HIS 198 888  888  HIS HIS A . n 
A 1 199 ARG 199 889  889  ARG ARG A . n 
A 1 200 ILE 200 890  890  ILE ILE A . n 
A 1 201 TYR 201 891  891  TYR TYR A . n 
A 1 202 THR 202 892  892  THR THR A . n 
A 1 203 HIS 203 893  893  HIS HIS A . n 
A 1 204 GLN 204 894  894  GLN GLN A . n 
A 1 205 SER 205 895  895  SER SER A . n 
A 1 206 ASP 206 896  896  ASP ASP A . n 
A 1 207 VAL 207 897  897  VAL VAL A . n 
A 1 208 TRP 208 898  898  TRP TRP A . n 
A 1 209 SER 209 899  899  SER SER A . n 
A 1 210 TYR 210 900  900  TYR TYR A . n 
A 1 211 GLY 211 901  901  GLY GLY A . n 
A 1 212 VAL 212 902  902  VAL VAL A . n 
A 1 213 THR 213 903  903  THR THR A . n 
A 1 214 VAL 214 904  904  VAL VAL A . n 
A 1 215 TRP 215 905  905  TRP TRP A . n 
A 1 216 GLU 216 906  906  GLU GLU A . n 
A 1 217 LEU 217 907  907  LEU LEU A . n 
A 1 218 MET 218 908  908  MET MET A . n 
A 1 219 THR 219 909  909  THR THR A . n 
A 1 220 PHE 220 910  910  PHE PHE A . n 
A 1 221 GLY 221 911  911  GLY GLY A . n 
A 1 222 SER 222 912  912  SER SER A . n 
A 1 223 LYS 223 913  913  LYS LYS A . n 
A 1 224 PRO 224 914  914  PRO PRO A . n 
A 1 225 TYR 225 915  915  TYR TYR A . n 
A 1 226 ASP 226 916  916  ASP ASP A . n 
A 1 227 GLY 227 917  917  GLY GLY A . n 
A 1 228 ILE 228 918  918  ILE ILE A . n 
A 1 229 PRO 229 919  919  PRO PRO A . n 
A 1 230 ALA 230 920  920  ALA ALA A . n 
A 1 231 SER 231 921  921  SER SER A . n 
A 1 232 GLU 232 922  922  GLU GLU A . n 
A 1 233 ILE 233 923  923  ILE ILE A . n 
A 1 234 SER 234 924  924  SER SER A . n 
A 1 235 SER 235 925  925  SER SER A . n 
A 1 236 ILE 236 926  926  ILE ILE A . n 
A 1 237 LEU 237 927  927  LEU LEU A . n 
A 1 238 GLU 238 928  928  GLU GLU A . n 
A 1 239 LYS 239 929  929  LYS LYS A . n 
A 1 240 GLY 240 930  930  GLY GLY A . n 
A 1 241 GLU 241 931  931  GLU GLU A . n 
A 1 242 ARG 242 932  932  ARG ARG A . n 
A 1 243 LEU 243 933  933  LEU LEU A . n 
A 1 244 PRO 244 934  934  PRO PRO A . n 
A 1 245 GLN 245 935  935  GLN GLN A . n 
A 1 246 PRO 246 936  936  PRO PRO A . n 
A 1 247 PRO 247 937  937  PRO PRO A . n 
A 1 248 ILE 248 938  938  ILE ILE A . n 
A 1 249 CYS 249 939  939  CYS CYS A . n 
A 1 250 THR 250 940  940  THR THR A . n 
A 1 251 ILE 251 941  941  ILE ILE A . n 
A 1 252 ASP 252 942  942  ASP ASP A . n 
A 1 253 VAL 253 943  943  VAL VAL A . n 
A 1 254 TYR 254 944  944  TYR TYR A . n 
A 1 255 MET 255 945  945  MET MET A . n 
A 1 256 ILE 256 946  946  ILE ILE A . n 
A 1 257 MET 257 947  947  MET MET A . n 
A 1 258 ARG 258 948  948  ARG ARG A . n 
A 1 259 LYS 259 949  949  LYS LYS A . n 
A 1 260 CYS 260 950  950  CYS CYS A . n 
A 1 261 TRP 261 951  951  TRP TRP A . n 
A 1 262 MET 262 952  952  MET MET A . n 
A 1 263 ILE 263 953  953  ILE ILE A . n 
A 1 264 ASP 264 954  954  ASP ASP A . n 
A 1 265 ALA 265 955  955  ALA ALA A . n 
A 1 266 ASP 266 956  956  ASP ASP A . n 
A 1 267 SER 267 957  957  SER SER A . n 
A 1 268 ARG 268 958  958  ARG ARG A . n 
A 1 269 PRO 269 959  959  PRO PRO A . n 
A 1 270 LYS 270 960  960  LYS LYS A . n 
A 1 271 PHE 271 961  961  PHE PHE A . n 
A 1 272 ARG 272 962  962  ARG ARG A . n 
A 1 273 GLU 273 963  963  GLU GLU A . n 
A 1 274 LEU 274 964  964  LEU LEU A . n 
A 1 275 ILE 275 965  965  ILE ILE A . n 
A 1 276 ILE 276 966  966  ILE ILE A . n 
A 1 277 GLU 277 967  967  GLU GLU A . n 
A 1 278 PHE 278 968  968  PHE PHE A . n 
A 1 279 SER 279 969  969  SER SER A . n 
A 1 280 LYS 280 970  970  LYS LYS A . n 
A 1 281 MET 281 971  971  MET MET A . n 
A 1 282 ALA 282 972  972  ALA ALA A . n 
A 1 283 ARG 283 973  973  ARG ARG A . n 
A 1 284 ASP 284 974  974  ASP ASP A . n 
A 1 285 PRO 285 975  975  PRO PRO A . n 
A 1 286 GLN 286 976  976  GLN GLN A . n 
A 1 287 ARG 287 977  977  ARG ARG A . n 
A 1 288 TYR 288 978  978  TYR TYR A . n 
A 1 289 LEU 289 979  979  LEU LEU A . n 
A 1 290 VAL 290 980  980  VAL VAL A . n 
A 1 291 ILE 291 981  981  ILE ILE A . n 
A 1 292 GLN 292 982  982  GLN GLN A . n 
A 1 293 GLY 293 983  983  GLY GLY A . n 
A 1 294 ASP 294 984  984  ASP ASP A . n 
A 1 295 GLU 295 985  985  GLU GLU A . n 
A 1 296 ARG 296 986  986  ARG ARG A . n 
A 1 297 MET 297 987  987  MET MET A . n 
A 1 298 HIS 298 988  988  HIS HIS A . n 
A 1 299 LEU 299 989  989  LEU LEU A . n 
A 1 300 PRO 300 990  990  PRO PRO A . n 
A 1 301 SER 301 991  ?    ?   ?   A . n 
A 1 302 PRO 302 992  ?    ?   ?   A . n 
A 1 303 THR 303 993  ?    ?   ?   A . n 
A 1 304 ASP 304 994  ?    ?   ?   A . n 
A 1 305 SER 305 995  ?    ?   ?   A . n 
A 1 306 ASN 306 996  ?    ?   ?   A . n 
A 1 307 PHE 307 997  ?    ?   ?   A . n 
A 1 308 TYR 308 998  ?    ?   ?   A . n 
A 1 309 ARG 309 999  ?    ?   ?   A . n 
A 1 310 ALA 310 1000 ?    ?   ?   A . n 
A 1 311 LEU 311 1001 ?    ?   ?   A . n 
A 1 312 MET 312 1002 ?    ?   ?   A . n 
A 1 313 ASP 313 1003 ?    ?   ?   A . n 
A 1 314 GLU 314 1004 ?    ?   ?   A . n 
A 1 315 GLU 315 1005 ?    ?   ?   A . n 
A 1 316 ASP 316 1006 ?    ?   ?   A . n 
A 1 317 MET 317 1007 ?    ?   ?   A . n 
A 1 318 ASP 318 1008 ?    ?   ?   A . n 
A 1 319 ASP 319 1009 ?    ?   ?   A . n 
A 1 320 VAL 320 1010 ?    ?   ?   A . n 
A 1 321 VAL 321 1011 ?    ?   ?   A . n 
A 1 322 ASP 322 1012 ?    ?   ?   A . n 
A 1 323 ALA 323 1013 ?    ?   ?   A . n 
A 1 324 ASP 324 1014 ?    ?   ?   A . n 
A 1 325 GLU 325 1015 1015 GLU GLU A . n 
A 1 326 TYR 326 1016 1016 TYR TYR A . n 
A 1 327 LEU 327 1017 1017 LEU LEU A . n 
A 1 328 ILE 328 1018 1018 ILE ILE A . n 
A 1 329 PRO 329 1019 1019 PRO PRO A . n 
A 1 330 GLN 330 1020 1020 GLN GLN A . n 
A 1 331 GLN 331 1021 ?    ?   ?   A . n 
A 1 332 GLY 332 1022 ?    ?   ?   A . n 
A 1 333 HIS 333 1023 ?    ?   ?   A . n 
A 1 334 HIS 334 1024 ?    ?   ?   A . n 
A 1 335 HIS 335 1025 ?    ?   ?   A . n 
A 1 336 HIS 336 1026 ?    ?   ?   A . n 
A 1 337 HIS 337 1027 ?    ?   ?   A . n 
A 1 338 HIS 338 1028 ?    ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1IEZ 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1IEZ 
_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 A1IEZ 1  2001 2001 A1IEZ LIG A . 
C 3 HOH   1  2101 21   HOH   HOH A . 
C 3 HOH   2  2102 19   HOH   HOH A . 
C 3 HOH   3  2103 9    HOH   HOH A . 
C 3 HOH   4  2104 1    HOH   HOH A . 
C 3 HOH   5  2105 13   HOH   HOH A . 
C 3 HOH   6  2106 51   HOH   HOH A . 
C 3 HOH   7  2107 11   HOH   HOH A . 
C 3 HOH   8  2108 18   HOH   HOH A . 
C 3 HOH   9  2109 15   HOH   HOH A . 
C 3 HOH   10 2110 20   HOH   HOH A . 
C 3 HOH   11 2111 7    HOH   HOH A . 
C 3 HOH   12 2112 45   HOH   HOH A . 
C 3 HOH   13 2113 34   HOH   HOH A . 
C 3 HOH   14 2114 32   HOH   HOH A . 
C 3 HOH   15 2115 22   HOH   HOH A . 
C 3 HOH   16 2116 56   HOH   HOH A . 
C 3 HOH   17 2117 35   HOH   HOH A . 
C 3 HOH   18 2118 49   HOH   HOH A . 
C 3 HOH   19 2119 12   HOH   HOH A . 
C 3 HOH   20 2120 8    HOH   HOH A . 
C 3 HOH   21 2121 17   HOH   HOH A . 
C 3 HOH   22 2122 59   HOH   HOH A . 
C 3 HOH   23 2123 4    HOH   HOH A . 
C 3 HOH   24 2124 46   HOH   HOH A . 
C 3 HOH   25 2125 58   HOH   HOH A . 
C 3 HOH   26 2126 64   HOH   HOH A . 
C 3 HOH   27 2127 39   HOH   HOH A . 
C 3 HOH   28 2128 82   HOH   HOH A . 
C 3 HOH   29 2129 29   HOH   HOH A . 
C 3 HOH   30 2130 30   HOH   HOH A . 
C 3 HOH   31 2131 73   HOH   HOH A . 
C 3 HOH   32 2132 23   HOH   HOH A . 
C 3 HOH   33 2133 54   HOH   HOH A . 
C 3 HOH   34 2134 6    HOH   HOH A . 
C 3 HOH   35 2135 84   HOH   HOH A . 
C 3 HOH   36 2136 31   HOH   HOH A . 
C 3 HOH   37 2137 70   HOH   HOH A . 
C 3 HOH   38 2138 43   HOH   HOH A . 
C 3 HOH   39 2139 42   HOH   HOH A . 
C 3 HOH   40 2140 25   HOH   HOH A . 
C 3 HOH   41 2141 40   HOH   HOH A . 
C 3 HOH   42 2142 57   HOH   HOH A . 
C 3 HOH   43 2143 53   HOH   HOH A . 
C 3 HOH   44 2144 41   HOH   HOH A . 
C 3 HOH   45 2145 44   HOH   HOH A . 
C 3 HOH   46 2146 66   HOH   HOH A . 
C 3 HOH   47 2147 79   HOH   HOH A . 
C 3 HOH   48 2148 72   HOH   HOH A . 
C 3 HOH   49 2149 14   HOH   HOH A . 
C 3 HOH   50 2150 83   HOH   HOH A . 
C 3 HOH   51 2151 24   HOH   HOH A . 
C 3 HOH   52 2152 71   HOH   HOH A . 
C 3 HOH   53 2153 36   HOH   HOH A . 
C 3 HOH   54 2154 27   HOH   HOH A . 
C 3 HOH   55 2155 28   HOH   HOH A . 
C 3 HOH   56 2156 26   HOH   HOH A . 
C 3 HOH   57 2157 74   HOH   HOH A . 
C 3 HOH   58 2158 76   HOH   HOH A . 
C 3 HOH   59 2159 5    HOH   HOH A . 
C 3 HOH   60 2160 69   HOH   HOH A . 
C 3 HOH   61 2161 50   HOH   HOH A . 
C 3 HOH   62 2162 61   HOH   HOH A . 
C 3 HOH   63 2163 81   HOH   HOH A . 
C 3 HOH   64 2164 65   HOH   HOH A . 
C 3 HOH   65 2165 3    HOH   HOH A . 
C 3 HOH   66 2166 10   HOH   HOH A . 
C 3 HOH   67 2167 33   HOH   HOH A . 
C 3 HOH   68 2168 47   HOH   HOH A . 
C 3 HOH   69 2169 16   HOH   HOH A . 
C 3 HOH   70 2170 55   HOH   HOH A . 
C 3 HOH   71 2171 2    HOH   HOH A . 
C 3 HOH   72 2172 68   HOH   HOH A . 
C 3 HOH   73 2173 62   HOH   HOH A . 
C 3 HOH   74 2174 77   HOH   HOH A . 
C 3 HOH   75 2175 60   HOH   HOH A . 
C 3 HOH   76 2176 80   HOH   HOH A . 
C 3 HOH   77 2177 63   HOH   HOH A . 
C 3 HOH   78 2178 48   HOH   HOH A . 
C 3 HOH   79 2179 78   HOH   HOH A . 
C 3 HOH   80 2180 37   HOH   HOH A . 
C 3 HOH   81 2181 38   HOH   HOH A . 
C 3 HOH   82 2182 67   HOH   HOH A . 
C 3 HOH   83 2183 52   HOH   HOH A . 
C 3 HOH   84 2184 75   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 
? 'data processing' ? ? ? ? ? ? ? ? ? ? ? autoPROC  ? ? ? '1.1.7 20230222' 1 
? 'data reduction'  ? ? ? ? ? ? ? ? ? ? ? XDS       ? ? ? 'Jan 10, 2022'   2 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? Aimless   ? ? ? 0.7.9            3 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? STARANISO ? ? ? 2.3.92           4 
? phasing           ? ? ? ? ? ? ? ? ? ? ? PHASER    ? ? ? 2.8.3            5 
? refinement        ? ? ? ? ? ? ? ? ? ? ? BUSTER    ? ? ? 2.11.8           6 
# 
_cell.angle_alpha                  90 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9FQP 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     40.763 
_cell.length_a_esd                 ? 
_cell.length_b                     107.213 
_cell.length_b_esd                 ? 
_cell.length_c                     175.363 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9FQP 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                20 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'C 2 2 21' 
_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                   9FQP 
_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             2.48 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          50.34 
_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              7.9 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.3 M Sodium Chloride, 50 mM TRIS-HCl pH 7.9, 9% v/v PEG 400' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_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 PILATUS 2M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2021-04-29 
_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   0.965459 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'ESRF BEAMLINE MASSIF-1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.965459 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   MASSIF-1 
_diffrn_source.pdbx_synchrotron_site       ESRF 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9FQP 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.495 
_reflns.d_resolution_low                               33.937 
_reflns.details                                        
;Some remarks regarding the mmCIF items written, the PDB Exchange Dictionary (PDBx/mmCIF) Version 5.0 supporting the data files in the current PDB archive (dictionary version 5.325, last updated 2020-04-13: http://mmcif.wwpdb.org/dictionaries/mmcif_pdbx_v50.dic/Index/) and the actual quantities provided by MRFANA (https://github.com/githubgphl/MRFANA) from the autoPROC package (https://www.globalphasing.com/autoproc/). In general, the mmCIF categories here should provide items that are currently used in the PDB archive. If there are alternatives, the one recommended by the PDB developers has been selected.

The distinction between *_all and *_obs quantities is not always clear: often only one version is actively used within the PDB archive (or is the one recommended by PDB developers). The intention of distinguishing between classes of reflections before and after some kind of observation criterion was applied, can in principle be useful - but such criteria change in various ways throughout the data processing steps (rejection of overloaded or too partial reflections, outlier/misfit rejections during scaling etc) and there is no retrospect computation of data scaling/merging statistics for the reflections used in the final refinement (where another observation criterion might have been applied). Typical data processing will usually only provide one version of statistics at various stages and these are given in the recommended item here, irrespective of the "_all" and "_obs" connotation, see e.g. the use of _reflns.pdbx_Rmerge_I_obs, _reflns.pdbx_Rrim_I_all and _reflns.pdbx_Rpim_I_all.

Please note that all statistics related to "merged intensities" (or "merging") are based on inverse-variance weighting of the individual measurements making up a symmetry-unique reflection. This is standard for several decades now, even if some of the dictionary definitions seem to suggest that a simple "mean" or "average" intensity is being used instead.

R-values are always given for all symmetry-equivalent reflections following Friedel's law, i.e. Bijvoet pairs are not treated separately (since we want to describe the overall mean intensity and not the mean I(+) and I(-) here).

The Rrim metric is identical to the Rmeas R-value and only differs in name.

_reflns.pdbx_number_measured_all is the number of measured intensities just before the final merging step (at which point no additional rejection takes place).

_reflns.number_obs is the number of symmetry-unique observations, i.e. the result of merging those measurements via inverse-variance weighting.

_reflns.pdbx_netI_over_sigmaI is based on the merged intensities (_reflns.number_obs) as expected.

_reflns.pdbx_redundancy is synonymous with "multiplicity".

The per-shell item _reflns_shell.number_measured_all corresponds to the overall value _reflns.pdbx_number_measured_all.

The per-shell item _reflns_shell.number_unique_all corresponds to the overall value _reflns.number_obs.

The per-shell item _reflns_shell.percent_possible_all corresponds to the overall value _reflns.percent_possible_obs.

The per-shell item _reflns_shell.meanI_over_sigI_obs corresponds to the overall value given as _reflns.pdbx_netI_over_sigmaI. But be aware of the incorrect definition of the former in the current dictionary!
;
_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                                     12861 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           92.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                3.10 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          8.47 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.0881 
_reflns.pdbx_Rpim_I_all                                0.0493 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       39852 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.979 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.0722 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   1.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   0.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   0.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   0.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   1.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   0.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   0.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   0.00000 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   1.00000 
_reflns.pdbx_aniso_diffraction_limit_1                 2.32000 
_reflns.pdbx_aniso_diffraction_limit_2                 2.50200 
_reflns.pdbx_aniso_diffraction_limit_3                 2.46000 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     1.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     0.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     0.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     0.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     1.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     0.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     0.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     0.0000 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     1.0000 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               45.0642 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               52.6375 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               0.0000 
_reflns.pdbx_orthogonalization_convention              pdb 
_reflns.pdbx_percent_possible_ellipsoidal              92.9 
_reflns.pdbx_percent_possible_spherical                92.9 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    84.7 
_reflns.pdbx_percent_possible_spherical_anomalous      84.7 
_reflns.pdbx_redundancy_anomalous                      1.76 
_reflns.pdbx_CC_half_anomalous                         -0.266 
_reflns.pdbx_absDiff_over_sigma_anomalous              0.708 
_reflns.pdbx_percent_possible_anomalous                84.7 
_reflns.pdbx_observed_signal_threshold                 1.20 
_reflns.pdbx_signal_type                               'local <I/sigmaI>' 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_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 
5.496 33.937 ? 15.47 3856 3856 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.00 ? ? ? 0.0708 0.0397 ? 1  ? 0.967 ? ? 92.0 ? 0.0578 ? 92.0 
92.0 89.0 89.0 1.75 -0.309 0.687 89.0 
4.333 5.495  ? 14.72 3977 3977 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.09 ? ? ? 0.0729 0.0400 ? 2  ? 0.989 ? ? 93.7 ? 0.0604 ? 93.7 
93.7 83.5 83.5 1.81 -0.167 0.721 83.5 
3.782 4.332  ? 13.96 4046 4046 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.15 ? ? ? 0.0769 0.0424 ? 3  ? 0.989 ? ? 95.9 ? 0.0635 ? 95.9 
95.9 86.9 86.9 1.81 -0.203 0.738 86.9 
3.433 3.782  ? 12.35 4168 4168 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.24 ? ? ? 0.0940 0.0519 ? 4  ? 0.985 ? ? 96.5 ? 0.0776 ? 96.5 
96.5 89.0 89.0 1.83 -0.210 0.760 89.0 
3.180 3.433  ? 9.45  3773 3773 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 2.93 ? ? ? 0.1147 0.0654 ? 5  ? 0.985 ? ? 95.0 ? 0.0933 ? 95.0 
95.0 86.2 86.2 1.66 -0.128 0.735 86.2 
2.986 3.179  ? 6.86  3742 3742 ? 1287 1287 ? ? ? ? ? ? ? ? ? ? ? 2.91 ? ? ? 0.1834 0.1069 ? 6  ? 0.969 ? ? 93.5 ? 0.1475 ? 93.5 
93.5 80.4 80.4 1.68 -0.024 0.744 80.4 
2.836 2.986  ? 4.92  3942 3942 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.07 ? ? ? 0.2590 0.1483 ? 7  ? 0.954 ? ? 96.0 ? 0.2102 ? 96.0 
96.0 87.2 87.2 1.73 0.164  0.713 87.2 
2.711 2.836  ? 3.28  3962 3962 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.08 ? ? ? 0.4570 0.2635 ? 8  ? 0.857 ? ? 97.1 ? 0.3695 ? 97.1 
97.1 87.5 87.5 1.74 -0.066 0.686 87.5 
2.606 2.711  ? 2.20  4124 4124 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.21 ? ? ? 0.6488 0.3739 ? 9  ? 0.841 ? ? 96.4 ? 0.5246 ? 96.4 
96.4 87.9 87.9 1.79 0.031  0.668 87.9 
2.495 2.606  ? 1.49  4262 4262 ? 1286 1286 ? ? ? ? ? ? ? ? ? ? ? 3.31 ? ? ? 1.0345 0.6000 ? 10 ? 0.568 ? ? 77.4 ? 0.8333 ? 77.4 
77.3 73.9 73.8 1.80 0.087  0.640 73.9 
# 
_refine.aniso_B[1][1]                            0.1986 
_refine.aniso_B[1][2]                            0 
_refine.aniso_B[1][3]                            0 
_refine.aniso_B[2][2]                            0.9356 
_refine.aniso_B[2][3]                            0 
_refine.aniso_B[3][3]                            -1.1342 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               58.9 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.911 
_refine.correlation_coeff_Fo_to_Fc_free          0.861 
_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                                 9FQP 
_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                            2.495 
_refine.ls_d_res_low                             33.94 
_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                     12861 
_refine.ls_number_reflns_R_free                  597 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    92.9 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2443 
_refine.ls_R_factor_R_free                       0.2749 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2428 
_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                    ? 
_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                          ? 
_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               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_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                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          0.308 
_refine.pdbx_overall_SU_R_Blow_DPI               0.609 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            ? 
_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_analyze.entry_id                        9FQP 
_refine_analyze.pdbx_refine_id                  'X-RAY DIFFRACTION' 
_refine_analyze.Luzzati_coordinate_error_free   ? 
_refine_analyze.Luzzati_coordinate_error_obs    0.38 
_refine_analyze.Luzzati_d_res_low_free          ? 
_refine_analyze.Luzzati_d_res_low_obs           ? 
_refine_analyze.Luzzati_sigma_a_free            ? 
_refine_analyze.Luzzati_sigma_a_free_details    ? 
_refine_analyze.Luzzati_sigma_a_obs             ? 
_refine_analyze.Luzzati_sigma_a_obs_details     ? 
_refine_analyze.number_disordered_residues      ? 
_refine_analyze.occupancy_sum_hydrogen          ? 
_refine_analyze.occupancy_sum_non_hydrogen      ? 
_refine_analyze.RG_d_res_high                   ? 
_refine_analyze.RG_d_res_low                    ? 
_refine_analyze.RG_free                         ? 
_refine_analyze.RG_work                         ? 
_refine_analyze.RG_free_work_ratio              ? 
_refine_analyze.pdbx_Luzzati_d_res_high_obs     ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.495 
_refine_hist.d_res_low                        33.94 
_refine_hist.number_atoms_solvent             84 
_refine_hist.number_atoms_total               2463 
_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        2348 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         31 
_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' ? 0.008 ? 4861 ? t_bond_d                  2  HARMONIC     
'X-RAY DIFFRACTION' ? 0.88  ? 8828 ? t_angle_deg               2  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 1444 ? t_dihedral_angle_d        2  SINUSOIDAL   
'X-RAY DIFFRACTION' ? ?     ? 756  ? t_gen_planes              5  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 2446 ? t_it                      10 HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 311  ? t_chiral_improper_torsion 5  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? ?     ? 3755 ? t_ideal_dist_contact      4  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? 2.45  ? ?    ? t_omega_torsion           ?  ?            
'X-RAY DIFFRACTION' ? 14.63 ? ?    ? t_other_torsion           ?  ?            
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       2.5 
_refine_ls_shell.d_res_low                        2.54 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                444 
_refine_ls_shell.number_reflns_R_free             23 
_refine_ls_shell.number_reflns_R_work             ? 
_refine_ls_shell.percent_reflns_obs               67.17 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.R_factor_all                     ? 
_refine_ls_shell.R_factor_obs                     0.3165 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.R_factor_R_work                  0.3143 
_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                  0.359 
# 
_struct.entry_id                     9FQP 
_struct.title                        'EGFR Exon20 insertion mutant NPG bound with Compound 23' 
_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        9FQP 
_struct_keywords.text            'Kinase, inhibitor, TRANSFERASE' 
_struct_keywords.pdbx_keywords   TRANSFERASE 
# 
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 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    EGFR_HUMAN 
_struct_ref.pdbx_db_accession          P00533 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;SGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPHV
CRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKIT
DFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLP
QPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDVVDAD
EYLIPQQG
;
_struct_ref.pdbx_align_begin           695 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9FQP 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 2 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 332 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P00533 
_struct_ref_seq.db_align_beg                  695 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  1022 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       695 
_struct_ref_seq.pdbx_auth_seq_align_end       1022 
# 
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 9FQP MET A 1   ? UNP P00533 ?   ?   'initiating methionine' 694  1  
1 9FQP ASN A 78  A UNP P00533 ?   ?   insertion               770  2  
1 9FQP PRO A 79  B UNP P00533 ?   ?   insertion               770  3  
1 9FQP GLY A 80  C UNP P00533 ?   ?   insertion               770  4  
1 9FQP ARG A 258 ? UNP P00533 VAL 948 'engineered mutation'   948  5  
1 9FQP HIS A 333 ? UNP P00533 ?   ?   'expression tag'        1023 6  
1 9FQP HIS A 334 ? UNP P00533 ?   ?   'expression tag'        1024 7  
1 9FQP HIS A 335 ? UNP P00533 ?   ?   'expression tag'        1025 8  
1 9FQP HIS A 336 ? UNP P00533 ?   ?   'expression tag'        1026 9  
1 9FQP HIS A 337 ? UNP P00533 ?   ?   'expression tag'        1027 10 
1 9FQP HIS A 338 ? UNP P00533 ?   ?   'expression tag'        1028 11 
# 
_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)' 0     ? 
1 MORE         0     ? 
1 'SSA (A^2)'  14010 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 LYS A 15  ? THR A 17  ? LYS A 708 THR A 710 5 ? 3  
HELX_P HELX_P2  AA2 ASN A 63  ? VAL A 76  ? ASN A 756 VAL A 769 1 ? 14 
HELX_P HELX_P3  AA3 CYS A 107 ? HIS A 115 ? CYS A 797 HIS A 805 1 ? 9  
HELX_P HELX_P4  AA4 GLY A 120 ? ARG A 141 ? GLY A 810 ARG A 831 1 ? 22 
HELX_P HELX_P5  AA5 ALA A 149 ? ARG A 151 ? ALA A 839 ARG A 841 5 ? 3  
HELX_P HELX_P6  AA6 ALA A 192 ? ARG A 199 ? ALA A 882 ARG A 889 1 ? 8  
HELX_P HELX_P7  AA7 THR A 202 ? THR A 219 ? THR A 892 THR A 909 1 ? 18 
HELX_P HELX_P8  AA8 PRO A 229 ? SER A 231 ? PRO A 919 SER A 921 5 ? 3  
HELX_P HELX_P9  AA9 GLU A 232 ? LYS A 239 ? GLU A 922 LYS A 929 1 ? 8  
HELX_P HELX_P10 AB1 THR A 250 ? TRP A 261 ? THR A 940 TRP A 951 1 ? 12 
HELX_P HELX_P11 AB2 LYS A 270 ? ASP A 284 ? LYS A 960 ASP A 974 1 ? 15 
HELX_P HELX_P12 AB3 ASP A 284 ? LEU A 289 ? ASP A 974 LEU A 979 1 ? 6  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          ASN 
_struct_mon_prot_cis.label_seq_id           78 
_struct_mon_prot_cis.label_asym_id          A 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      A 
_struct_mon_prot_cis.auth_comp_id           ASN 
_struct_mon_prot_cis.auth_seq_id            770 
_struct_mon_prot_cis.auth_asym_id           A 
_struct_mon_prot_cis.pdbx_label_comp_id_2   PRO 
_struct_mon_prot_cis.pdbx_label_seq_id_2    79 
_struct_mon_prot_cis.pdbx_label_asym_id_2   A 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    B 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    PRO 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     770 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    A 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       1.86 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 6 ? 
AA2 ? 2 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
AA5 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel      
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA1 5 6 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA5 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ILE A 13  ? LEU A 14  ? ILE A 706  LEU A 707  
AA1 2 LEU A 87  ? LEU A 92  ? LEU A 777  LEU A 782  
AA1 3 VAL A 96  ? GLN A 101 ? VAL A 786  GLN A 791  
AA1 4 ILE A 47  ? GLU A 53  ? ILE A 740  GLU A 746  
AA1 5 GLY A 31  ? TRP A 38  ? GLY A 724  TRP A 731  
AA1 6 PHE A 19  ? GLY A 28  ? PHE A 712  GLY A 721  
AA2 1 LEU A 143 ? VAL A 144 ? LEU A 833  VAL A 834  
AA2 2 LYS A 170 ? LEU A 171 ? LYS A 860  LEU A 861  
AA3 1 VAL A 153 ? THR A 157 ? VAL A 843  THR A 847  
AA3 2 HIS A 160 ? ILE A 163 ? HIS A 850  ILE A 853  
AA4 1 TYR A 179 ? HIS A 180 ? TYR A 869  HIS A 870  
AA4 2 ILE A 200 ? TYR A 201 ? ILE A 890  TYR A 891  
AA5 1 VAL A 186 ? PRO A 187 ? VAL A 876  PRO A 877  
AA5 2 TYR A 326 ? LEU A 327 ? TYR A 1016 LEU A 1017 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N LEU A 14  ? N LEU A 707 O ILE A 90  ? O ILE A 780  
AA1 2 3 N CYS A 91  ? N CYS A 781 O GLN A 97  ? O GLN A 787  
AA1 3 4 O THR A 100 ? O THR A 790 N ALA A 50  ? N ALA A 743  
AA1 4 5 O ILE A 47  ? O ILE A 740 N TRP A 38  ? N TRP A 731  
AA1 5 6 O VAL A 33  ? O VAL A 726 N LEU A 25  ? N LEU A 718  
AA2 1 2 N VAL A 144 ? N VAL A 834 O LYS A 170 ? O LYS A 860  
AA3 1 2 N LEU A 154 ? N LEU A 844 O LYS A 162 ? O LYS A 852  
AA4 1 2 N TYR A 179 ? N TYR A 869 O TYR A 201 ? O TYR A 891  
AA5 1 2 N VAL A 186 ? N VAL A 876 O LEU A 327 ? O LEU A 1017 
# 
_pdbx_entry_details.entry_id                   9FQP 
_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   N 
# 
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 THR 892 ? ? HG   A SER 895 ? ? 1.54 
2 1 OE2 A GLU 746 ? ? HE21 A GLN 787 ? ? 1.55 
# 
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 THR A 783 ? ? -94.50  -150.71 
2 1 HIS A 805 ? ? -95.86  45.81   
3 1 ASP A 837 ? ? -148.69 43.10   
4 1 ASP A 855 ? ? 66.55   84.70   
5 1 PHE A 856 ? ? -99.61  41.50   
6 1 GLU A 865 ? ? -106.42 51.63   
7 1 GLU A 872 ? ? -93.90  -137.09 
# 
loop_
_pdbx_refine_tls.id 
_pdbx_refine_tls.pdbx_refine_id 
_pdbx_refine_tls.details 
_pdbx_refine_tls.method 
_pdbx_refine_tls.origin_x 
_pdbx_refine_tls.origin_y 
_pdbx_refine_tls.origin_z 
_pdbx_refine_tls.T[1][1] 
_pdbx_refine_tls.T[1][1]_esd 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][2]_esd 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[1][3]_esd 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[2][2]_esd 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.T[2][3]_esd 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[3][3]_esd 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[1][1]_esd 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][2]_esd 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[1][3]_esd 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[2][2]_esd 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.L[2][3]_esd 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[3][3]_esd 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[1][1]_esd 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][2]_esd 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[1][3]_esd 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[2][1]_esd 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[2][2]_esd 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][3]_esd 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][1]_esd 
_pdbx_refine_tls.S[3][2] 
_pdbx_refine_tls.S[3][2]_esd 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[3][3]_esd 
1 'X-RAY DIFFRACTION' ? ? 1.9342   14.2853 -19.6093 -0.0419 ? 0.0295  ? -0.0046 ? -0.1105 ? 0.0594 ? -0.0156 ? 1.0752 ? 0.1312  ? 
0.2284 ? 1.5365 ? -1.3667 ? 6.1524 ? -0.13  ? 0.3964 ? -0.4142 ? 0.3964 ? -0.0224 ? -0.0623 ? -0.4142 ? -0.0623 ? 0.1524 ? 
2 'X-RAY DIFFRACTION' ? ? -18.0822 3.6295  -23.2218 0.242   ? -0.0525 ? -0.002  ? 0.304   ? 0.0338 ? 0.2155  ? 0.408  ? -0.0916 ? 
0.054  ? 0.3371 ? -0.0745 ? 0.0001 ? 0.0014 ? 0.0199 ? -0.0075 ? 0.0199 ? -0.0041 ? -0.0052 ? -0.0075 ? -0.0052 ? 0.0028 ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.beg_PDB_ins_code 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.end_PDB_ins_code 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1 'X-RAY DIFFRACTION' 1 ? ? A 701  ? ? ? A 990  ? ? '{ A|701 - A|990 A|2001 }' 
2 'X-RAY DIFFRACTION' 1 ? ? A 2001 ? ? ? A 2001 ? ? '{ A|701 - A|990 A|2001 }' 
3 'X-RAY DIFFRACTION' 2 ? ? A 1018 ? ? ? A 1020 ? ? '{ A|1018 - A|1020 }'      
# 
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 694  ? A MET 1   
2  1 Y 1 A SER 695  ? A SER 2   
3  1 Y 1 A GLY 696  ? A GLY 3   
4  1 Y 1 A GLU 697  ? A GLU 4   
5  1 Y 1 A ALA 698  ? A ALA 5   
6  1 Y 1 A PRO 699  ? A PRO 6   
7  1 Y 1 A ASN 700  ? A ASN 7   
8  1 Y 1 A ARG 748  ? A ARG 55  
9  1 Y 1 A GLU 749  ? A GLU 56  
10 1 Y 1 A ALA 750  ? A ALA 57  
11 1 Y 1 A THR 751  ? A THR 58  
12 1 Y 1 A SER 752  ? A SER 59  
13 1 Y 1 A PRO 753  ? A PRO 60  
14 1 Y 1 A LYS 754  ? A LYS 61  
15 1 Y 1 A SER 991  ? A SER 301 
16 1 Y 1 A PRO 992  ? A PRO 302 
17 1 Y 1 A THR 993  ? A THR 303 
18 1 Y 1 A ASP 994  ? A ASP 304 
19 1 Y 1 A SER 995  ? A SER 305 
20 1 Y 1 A ASN 996  ? A ASN 306 
21 1 Y 1 A PHE 997  ? A PHE 307 
22 1 Y 1 A TYR 998  ? A TYR 308 
23 1 Y 1 A ARG 999  ? A ARG 309 
24 1 Y 1 A ALA 1000 ? A ALA 310 
25 1 Y 1 A LEU 1001 ? A LEU 311 
26 1 Y 1 A MET 1002 ? A MET 312 
27 1 Y 1 A ASP 1003 ? A ASP 313 
28 1 Y 1 A GLU 1004 ? A GLU 314 
29 1 Y 1 A GLU 1005 ? A GLU 315 
30 1 Y 1 A ASP 1006 ? A ASP 316 
31 1 Y 1 A MET 1007 ? A MET 317 
32 1 Y 1 A ASP 1008 ? A ASP 318 
33 1 Y 1 A ASP 1009 ? A ASP 319 
34 1 Y 1 A VAL 1010 ? A VAL 320 
35 1 Y 1 A VAL 1011 ? A VAL 321 
36 1 Y 1 A ASP 1012 ? A ASP 322 
37 1 Y 1 A ALA 1013 ? A ALA 323 
38 1 Y 1 A ASP 1014 ? A ASP 324 
39 1 Y 1 A GLN 1021 ? A GLN 331 
40 1 Y 1 A GLY 1022 ? A GLY 332 
41 1 Y 1 A HIS 1023 ? A HIS 333 
42 1 Y 1 A HIS 1024 ? A HIS 334 
43 1 Y 1 A HIS 1025 ? A HIS 335 
44 1 Y 1 A HIS 1026 ? A HIS 336 
45 1 Y 1 A HIS 1027 ? A HIS 337 
46 1 Y 1 A HIS 1028 ? A HIS 338 
# 
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 
A1IEZ N1   N  Y N 1   
A1IEZ N3   N  N N 2   
A1IEZ C4   C  N N 3   
A1IEZ C5   C  N N 4   
A1IEZ C6   C  Y N 5   
A1IEZ C7   C  Y N 6   
A1IEZ C8   C  Y N 7   
A1IEZ C10  C  Y N 8   
A1IEZ C13  C  Y N 9   
A1IEZ C15  C  Y N 10  
A1IEZ C17  C  Y N 11  
A1IEZ C20  C  Y N 12  
A1IEZ C21  C  N N 13  
A1IEZ CL   CL N N 14  
A1IEZ C19  C  Y N 15  
A1IEZ C18  C  Y N 16  
A1IEZ C16  C  Y N 17  
A1IEZ O2   O  N N 18  
A1IEZ C14  C  Y N 19  
A1IEZ O1   O  N N 20  
A1IEZ N    N  N N 21  
A1IEZ C9   C  Y N 22  
A1IEZ F    F  N N 23  
A1IEZ C12  C  Y N 24  
A1IEZ N2   N  Y N 25  
A1IEZ C11  C  Y N 26  
A1IEZ C3   C  N S 27  
A1IEZ C2   C  N N 28  
A1IEZ C1   C  N N 29  
A1IEZ O    O  N N 30  
A1IEZ C    C  N N 31  
A1IEZ H1   H  N N 32  
A1IEZ H15  H  N N 33  
A1IEZ H10  H  N N 34  
A1IEZ H9   H  N N 35  
A1IEZ H12  H  N N 36  
A1IEZ H17  H  N N 37  
A1IEZ H20  H  N N 38  
A1IEZ H21  H  N N 39  
A1IEZ H19  H  N N 40  
A1IEZ H18  H  N N 41  
A1IEZ H16  H  N N 42  
A1IEZ H11  H  N N 43  
A1IEZ H14  H  N N 44  
A1IEZ H13  H  N N 45  
A1IEZ H    H  N N 46  
A1IEZ H7   H  N N 47  
A1IEZ H8   H  N N 48  
A1IEZ H5   H  N N 49  
A1IEZ H6   H  N N 50  
A1IEZ H3   H  N N 51  
A1IEZ H4   H  N N 52  
A1IEZ H2   H  N N 53  
ALA   N    N  N N 54  
ALA   CA   C  N S 55  
ALA   C    C  N N 56  
ALA   O    O  N N 57  
ALA   CB   C  N N 58  
ALA   OXT  O  N N 59  
ALA   H    H  N N 60  
ALA   H2   H  N N 61  
ALA   HA   H  N N 62  
ALA   HB1  H  N N 63  
ALA   HB2  H  N N 64  
ALA   HB3  H  N N 65  
ALA   HXT  H  N N 66  
ARG   N    N  N N 67  
ARG   CA   C  N S 68  
ARG   C    C  N N 69  
ARG   O    O  N N 70  
ARG   CB   C  N N 71  
ARG   CG   C  N N 72  
ARG   CD   C  N N 73  
ARG   NE   N  N N 74  
ARG   CZ   C  N N 75  
ARG   NH1  N  N N 76  
ARG   NH2  N  N N 77  
ARG   OXT  O  N N 78  
ARG   H    H  N N 79  
ARG   H2   H  N N 80  
ARG   HA   H  N N 81  
ARG   HB2  H  N N 82  
ARG   HB3  H  N N 83  
ARG   HG2  H  N N 84  
ARG   HG3  H  N N 85  
ARG   HD2  H  N N 86  
ARG   HD3  H  N N 87  
ARG   HE   H  N N 88  
ARG   HH11 H  N N 89  
ARG   HH12 H  N N 90  
ARG   HH21 H  N N 91  
ARG   HH22 H  N N 92  
ARG   HXT  H  N N 93  
ASN   N    N  N N 94  
ASN   CA   C  N S 95  
ASN   C    C  N N 96  
ASN   O    O  N N 97  
ASN   CB   C  N N 98  
ASN   CG   C  N N 99  
ASN   OD1  O  N N 100 
ASN   ND2  N  N N 101 
ASN   OXT  O  N N 102 
ASN   H    H  N N 103 
ASN   H2   H  N N 104 
ASN   HA   H  N N 105 
ASN   HB2  H  N N 106 
ASN   HB3  H  N N 107 
ASN   HD21 H  N N 108 
ASN   HD22 H  N N 109 
ASN   HXT  H  N N 110 
ASP   N    N  N N 111 
ASP   CA   C  N S 112 
ASP   C    C  N N 113 
ASP   O    O  N N 114 
ASP   CB   C  N N 115 
ASP   CG   C  N N 116 
ASP   OD1  O  N N 117 
ASP   OD2  O  N N 118 
ASP   OXT  O  N N 119 
ASP   H    H  N N 120 
ASP   H2   H  N N 121 
ASP   HA   H  N N 122 
ASP   HB2  H  N N 123 
ASP   HB3  H  N N 124 
ASP   HD2  H  N N 125 
ASP   HXT  H  N N 126 
CYS   N    N  N N 127 
CYS   CA   C  N R 128 
CYS   C    C  N N 129 
CYS   O    O  N N 130 
CYS   CB   C  N N 131 
CYS   SG   S  N N 132 
CYS   OXT  O  N N 133 
CYS   H    H  N N 134 
CYS   H2   H  N N 135 
CYS   HA   H  N N 136 
CYS   HB2  H  N N 137 
CYS   HB3  H  N N 138 
CYS   HG   H  N N 139 
CYS   HXT  H  N N 140 
GLN   N    N  N N 141 
GLN   CA   C  N S 142 
GLN   C    C  N N 143 
GLN   O    O  N N 144 
GLN   CB   C  N N 145 
GLN   CG   C  N N 146 
GLN   CD   C  N N 147 
GLN   OE1  O  N N 148 
GLN   NE2  N  N N 149 
GLN   OXT  O  N N 150 
GLN   H    H  N N 151 
GLN   H2   H  N N 152 
GLN   HA   H  N N 153 
GLN   HB2  H  N N 154 
GLN   HB3  H  N N 155 
GLN   HG2  H  N N 156 
GLN   HG3  H  N N 157 
GLN   HE21 H  N N 158 
GLN   HE22 H  N N 159 
GLN   HXT  H  N N 160 
GLU   N    N  N N 161 
GLU   CA   C  N S 162 
GLU   C    C  N N 163 
GLU   O    O  N N 164 
GLU   CB   C  N N 165 
GLU   CG   C  N N 166 
GLU   CD   C  N N 167 
GLU   OE1  O  N N 168 
GLU   OE2  O  N N 169 
GLU   OXT  O  N N 170 
GLU   H    H  N N 171 
GLU   H2   H  N N 172 
GLU   HA   H  N N 173 
GLU   HB2  H  N N 174 
GLU   HB3  H  N N 175 
GLU   HG2  H  N N 176 
GLU   HG3  H  N N 177 
GLU   HE2  H  N N 178 
GLU   HXT  H  N N 179 
GLY   N    N  N N 180 
GLY   CA   C  N N 181 
GLY   C    C  N N 182 
GLY   O    O  N N 183 
GLY   OXT  O  N N 184 
GLY   H    H  N N 185 
GLY   H2   H  N N 186 
GLY   HA2  H  N N 187 
GLY   HA3  H  N N 188 
GLY   HXT  H  N N 189 
HIS   N    N  N N 190 
HIS   CA   C  N S 191 
HIS   C    C  N N 192 
HIS   O    O  N N 193 
HIS   CB   C  N N 194 
HIS   CG   C  Y N 195 
HIS   ND1  N  Y N 196 
HIS   CD2  C  Y N 197 
HIS   CE1  C  Y N 198 
HIS   NE2  N  Y N 199 
HIS   OXT  O  N N 200 
HIS   H    H  N N 201 
HIS   H2   H  N N 202 
HIS   HA   H  N N 203 
HIS   HB2  H  N N 204 
HIS   HB3  H  N N 205 
HIS   HD1  H  N N 206 
HIS   HD2  H  N N 207 
HIS   HE1  H  N N 208 
HIS   HE2  H  N N 209 
HIS   HXT  H  N N 210 
HOH   O    O  N N 211 
HOH   H1   H  N N 212 
HOH   H2   H  N N 213 
ILE   N    N  N N 214 
ILE   CA   C  N S 215 
ILE   C    C  N N 216 
ILE   O    O  N N 217 
ILE   CB   C  N S 218 
ILE   CG1  C  N N 219 
ILE   CG2  C  N N 220 
ILE   CD1  C  N N 221 
ILE   OXT  O  N N 222 
ILE   H    H  N N 223 
ILE   H2   H  N N 224 
ILE   HA   H  N N 225 
ILE   HB   H  N N 226 
ILE   HG12 H  N N 227 
ILE   HG13 H  N N 228 
ILE   HG21 H  N N 229 
ILE   HG22 H  N N 230 
ILE   HG23 H  N N 231 
ILE   HD11 H  N N 232 
ILE   HD12 H  N N 233 
ILE   HD13 H  N N 234 
ILE   HXT  H  N N 235 
LEU   N    N  N N 236 
LEU   CA   C  N S 237 
LEU   C    C  N N 238 
LEU   O    O  N N 239 
LEU   CB   C  N N 240 
LEU   CG   C  N N 241 
LEU   CD1  C  N N 242 
LEU   CD2  C  N N 243 
LEU   OXT  O  N N 244 
LEU   H    H  N N 245 
LEU   H2   H  N N 246 
LEU   HA   H  N N 247 
LEU   HB2  H  N N 248 
LEU   HB3  H  N N 249 
LEU   HG   H  N N 250 
LEU   HD11 H  N N 251 
LEU   HD12 H  N N 252 
LEU   HD13 H  N N 253 
LEU   HD21 H  N N 254 
LEU   HD22 H  N N 255 
LEU   HD23 H  N N 256 
LEU   HXT  H  N N 257 
LYS   N    N  N N 258 
LYS   CA   C  N S 259 
LYS   C    C  N N 260 
LYS   O    O  N N 261 
LYS   CB   C  N N 262 
LYS   CG   C  N N 263 
LYS   CD   C  N N 264 
LYS   CE   C  N N 265 
LYS   NZ   N  N N 266 
LYS   OXT  O  N N 267 
LYS   H    H  N N 268 
LYS   H2   H  N N 269 
LYS   HA   H  N N 270 
LYS   HB2  H  N N 271 
LYS   HB3  H  N N 272 
LYS   HG2  H  N N 273 
LYS   HG3  H  N N 274 
LYS   HD2  H  N N 275 
LYS   HD3  H  N N 276 
LYS   HE2  H  N N 277 
LYS   HE3  H  N N 278 
LYS   HZ1  H  N N 279 
LYS   HZ2  H  N N 280 
LYS   HZ3  H  N N 281 
LYS   HXT  H  N N 282 
MET   N    N  N N 283 
MET   CA   C  N S 284 
MET   C    C  N N 285 
MET   O    O  N N 286 
MET   CB   C  N N 287 
MET   CG   C  N N 288 
MET   SD   S  N N 289 
MET   CE   C  N N 290 
MET   OXT  O  N N 291 
MET   H    H  N N 292 
MET   H2   H  N N 293 
MET   HA   H  N N 294 
MET   HB2  H  N N 295 
MET   HB3  H  N N 296 
MET   HG2  H  N N 297 
MET   HG3  H  N N 298 
MET   HE1  H  N N 299 
MET   HE2  H  N N 300 
MET   HE3  H  N N 301 
MET   HXT  H  N N 302 
PHE   N    N  N N 303 
PHE   CA   C  N S 304 
PHE   C    C  N N 305 
PHE   O    O  N N 306 
PHE   CB   C  N N 307 
PHE   CG   C  Y N 308 
PHE   CD1  C  Y N 309 
PHE   CD2  C  Y N 310 
PHE   CE1  C  Y N 311 
PHE   CE2  C  Y N 312 
PHE   CZ   C  Y N 313 
PHE   OXT  O  N N 314 
PHE   H    H  N N 315 
PHE   H2   H  N N 316 
PHE   HA   H  N N 317 
PHE   HB2  H  N N 318 
PHE   HB3  H  N N 319 
PHE   HD1  H  N N 320 
PHE   HD2  H  N N 321 
PHE   HE1  H  N N 322 
PHE   HE2  H  N N 323 
PHE   HZ   H  N N 324 
PHE   HXT  H  N N 325 
PRO   N    N  N N 326 
PRO   CA   C  N S 327 
PRO   C    C  N N 328 
PRO   O    O  N N 329 
PRO   CB   C  N N 330 
PRO   CG   C  N N 331 
PRO   CD   C  N N 332 
PRO   OXT  O  N N 333 
PRO   H    H  N N 334 
PRO   HA   H  N N 335 
PRO   HB2  H  N N 336 
PRO   HB3  H  N N 337 
PRO   HG2  H  N N 338 
PRO   HG3  H  N N 339 
PRO   HD2  H  N N 340 
PRO   HD3  H  N N 341 
PRO   HXT  H  N N 342 
SER   N    N  N N 343 
SER   CA   C  N S 344 
SER   C    C  N N 345 
SER   O    O  N N 346 
SER   CB   C  N N 347 
SER   OG   O  N N 348 
SER   OXT  O  N N 349 
SER   H    H  N N 350 
SER   H2   H  N N 351 
SER   HA   H  N N 352 
SER   HB2  H  N N 353 
SER   HB3  H  N N 354 
SER   HG   H  N N 355 
SER   HXT  H  N N 356 
THR   N    N  N N 357 
THR   CA   C  N S 358 
THR   C    C  N N 359 
THR   O    O  N N 360 
THR   CB   C  N R 361 
THR   OG1  O  N N 362 
THR   CG2  C  N N 363 
THR   OXT  O  N N 364 
THR   H    H  N N 365 
THR   H2   H  N N 366 
THR   HA   H  N N 367 
THR   HB   H  N N 368 
THR   HG1  H  N N 369 
THR   HG21 H  N N 370 
THR   HG22 H  N N 371 
THR   HG23 H  N N 372 
THR   HXT  H  N N 373 
TRP   N    N  N N 374 
TRP   CA   C  N S 375 
TRP   C    C  N N 376 
TRP   O    O  N N 377 
TRP   CB   C  N N 378 
TRP   CG   C  Y N 379 
TRP   CD1  C  Y N 380 
TRP   CD2  C  Y N 381 
TRP   NE1  N  Y N 382 
TRP   CE2  C  Y N 383 
TRP   CE3  C  Y N 384 
TRP   CZ2  C  Y N 385 
TRP   CZ3  C  Y N 386 
TRP   CH2  C  Y N 387 
TRP   OXT  O  N N 388 
TRP   H    H  N N 389 
TRP   H2   H  N N 390 
TRP   HA   H  N N 391 
TRP   HB2  H  N N 392 
TRP   HB3  H  N N 393 
TRP   HD1  H  N N 394 
TRP   HE1  H  N N 395 
TRP   HE3  H  N N 396 
TRP   HZ2  H  N N 397 
TRP   HZ3  H  N N 398 
TRP   HH2  H  N N 399 
TRP   HXT  H  N N 400 
TYR   N    N  N N 401 
TYR   CA   C  N S 402 
TYR   C    C  N N 403 
TYR   O    O  N N 404 
TYR   CB   C  N N 405 
TYR   CG   C  Y N 406 
TYR   CD1  C  Y N 407 
TYR   CD2  C  Y N 408 
TYR   CE1  C  Y N 409 
TYR   CE2  C  Y N 410 
TYR   CZ   C  Y N 411 
TYR   OH   O  N N 412 
TYR   OXT  O  N N 413 
TYR   H    H  N N 414 
TYR   H2   H  N N 415 
TYR   HA   H  N N 416 
TYR   HB2  H  N N 417 
TYR   HB3  H  N N 418 
TYR   HD1  H  N N 419 
TYR   HD2  H  N N 420 
TYR   HE1  H  N N 421 
TYR   HE2  H  N N 422 
TYR   HH   H  N N 423 
TYR   HXT  H  N N 424 
VAL   N    N  N N 425 
VAL   CA   C  N S 426 
VAL   C    C  N N 427 
VAL   O    O  N N 428 
VAL   CB   C  N N 429 
VAL   CG1  C  N N 430 
VAL   CG2  C  N N 431 
VAL   OXT  O  N N 432 
VAL   H    H  N N 433 
VAL   H2   H  N N 434 
VAL   HA   H  N N 435 
VAL   HB   H  N N 436 
VAL   HG11 H  N N 437 
VAL   HG12 H  N N 438 
VAL   HG13 H  N N 439 
VAL   HG21 H  N N 440 
VAL   HG22 H  N N 441 
VAL   HG23 H  N N 442 
VAL   HXT  H  N N 443 
# 
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 
A1IEZ C   O    sing N N 1   
A1IEZ O   C1   sing N N 2   
A1IEZ C1  C2   sing N N 3   
A1IEZ C2  C3   sing N N 4   
A1IEZ C3  C4   sing N N 5   
A1IEZ C4  N    sing N N 6   
A1IEZ N   C5   sing N N 7   
A1IEZ O1  C5   doub N N 8   
A1IEZ C5  C6   sing N N 9   
A1IEZ C6  C7   doub Y N 10  
A1IEZ C3  C7   sing N N 11  
A1IEZ C7  N1   sing Y N 12  
A1IEZ N1  C8   sing Y N 13  
A1IEZ C9  C8   sing N N 14  
A1IEZ C9  C10  doub Y N 15  
A1IEZ C10 C11  sing Y N 16  
A1IEZ C11 N2   doub Y N 17  
A1IEZ N2  C12  sing Y N 18  
A1IEZ C12 C13  doub Y N 19  
A1IEZ C13 C9   sing Y N 20  
A1IEZ F   C13  sing N N 21  
A1IEZ C8  C14  doub Y N 22  
A1IEZ C6  C14  sing Y N 23  
A1IEZ C14 N3   sing N N 24  
A1IEZ N3  C15  sing N N 25  
A1IEZ C15 C16  doub Y N 26  
A1IEZ C16 C17  sing Y N 27  
A1IEZ C17 C18  doub Y N 28  
A1IEZ C18 C19  sing Y N 29  
A1IEZ C20 C19  doub Y N 30  
A1IEZ C15 C20  sing Y N 31  
A1IEZ O2  C20  sing N N 32  
A1IEZ C21 O2   sing N N 33  
A1IEZ C19 CL   sing N N 34  
A1IEZ N1  H1   sing N N 35  
A1IEZ N3  H15  sing N N 36  
A1IEZ C4  H10  sing N N 37  
A1IEZ C4  H9   sing N N 38  
A1IEZ C10 H12  sing N N 39  
A1IEZ C17 H17  sing N N 40  
A1IEZ C21 H20  sing N N 41  
A1IEZ C21 H21  sing N N 42  
A1IEZ C21 H19  sing N N 43  
A1IEZ C18 H18  sing N N 44  
A1IEZ C16 H16  sing N N 45  
A1IEZ N   H11  sing N N 46  
A1IEZ C12 H14  sing N N 47  
A1IEZ C11 H13  sing N N 48  
A1IEZ C3  H    sing N N 49  
A1IEZ C2  H7   sing N N 50  
A1IEZ C2  H8   sing N N 51  
A1IEZ C1  H5   sing N N 52  
A1IEZ C1  H6   sing N N 53  
A1IEZ C   H3   sing N N 54  
A1IEZ C   H4   sing N N 55  
A1IEZ C   H2   sing N N 56  
ALA   N   CA   sing N N 57  
ALA   N   H    sing N N 58  
ALA   N   H2   sing N N 59  
ALA   CA  C    sing N N 60  
ALA   CA  CB   sing N N 61  
ALA   CA  HA   sing N N 62  
ALA   C   O    doub N N 63  
ALA   C   OXT  sing N N 64  
ALA   CB  HB1  sing N N 65  
ALA   CB  HB2  sing N N 66  
ALA   CB  HB3  sing N N 67  
ALA   OXT HXT  sing N N 68  
ARG   N   CA   sing N N 69  
ARG   N   H    sing N N 70  
ARG   N   H2   sing N N 71  
ARG   CA  C    sing N N 72  
ARG   CA  CB   sing N N 73  
ARG   CA  HA   sing N N 74  
ARG   C   O    doub N N 75  
ARG   C   OXT  sing N N 76  
ARG   CB  CG   sing N N 77  
ARG   CB  HB2  sing N N 78  
ARG   CB  HB3  sing N N 79  
ARG   CG  CD   sing N N 80  
ARG   CG  HG2  sing N N 81  
ARG   CG  HG3  sing N N 82  
ARG   CD  NE   sing N N 83  
ARG   CD  HD2  sing N N 84  
ARG   CD  HD3  sing N N 85  
ARG   NE  CZ   sing N N 86  
ARG   NE  HE   sing N N 87  
ARG   CZ  NH1  sing N N 88  
ARG   CZ  NH2  doub N N 89  
ARG   NH1 HH11 sing N N 90  
ARG   NH1 HH12 sing N N 91  
ARG   NH2 HH21 sing N N 92  
ARG   NH2 HH22 sing N N 93  
ARG   OXT HXT  sing N N 94  
ASN   N   CA   sing N N 95  
ASN   N   H    sing N N 96  
ASN   N   H2   sing N N 97  
ASN   CA  C    sing N N 98  
ASN   CA  CB   sing N N 99  
ASN   CA  HA   sing N N 100 
ASN   C   O    doub N N 101 
ASN   C   OXT  sing N N 102 
ASN   CB  CG   sing N N 103 
ASN   CB  HB2  sing N N 104 
ASN   CB  HB3  sing N N 105 
ASN   CG  OD1  doub N N 106 
ASN   CG  ND2  sing N N 107 
ASN   ND2 HD21 sing N N 108 
ASN   ND2 HD22 sing N N 109 
ASN   OXT HXT  sing N N 110 
ASP   N   CA   sing N N 111 
ASP   N   H    sing N N 112 
ASP   N   H2   sing N N 113 
ASP   CA  C    sing N N 114 
ASP   CA  CB   sing N N 115 
ASP   CA  HA   sing N N 116 
ASP   C   O    doub N N 117 
ASP   C   OXT  sing N N 118 
ASP   CB  CG   sing N N 119 
ASP   CB  HB2  sing N N 120 
ASP   CB  HB3  sing N N 121 
ASP   CG  OD1  doub N N 122 
ASP   CG  OD2  sing N N 123 
ASP   OD2 HD2  sing N N 124 
ASP   OXT HXT  sing N N 125 
CYS   N   CA   sing N N 126 
CYS   N   H    sing N N 127 
CYS   N   H2   sing N N 128 
CYS   CA  C    sing N N 129 
CYS   CA  CB   sing N N 130 
CYS   CA  HA   sing N N 131 
CYS   C   O    doub N N 132 
CYS   C   OXT  sing N N 133 
CYS   CB  SG   sing N N 134 
CYS   CB  HB2  sing N N 135 
CYS   CB  HB3  sing N N 136 
CYS   SG  HG   sing N N 137 
CYS   OXT HXT  sing N N 138 
GLN   N   CA   sing N N 139 
GLN   N   H    sing N N 140 
GLN   N   H2   sing N N 141 
GLN   CA  C    sing N N 142 
GLN   CA  CB   sing N N 143 
GLN   CA  HA   sing N N 144 
GLN   C   O    doub N N 145 
GLN   C   OXT  sing N N 146 
GLN   CB  CG   sing N N 147 
GLN   CB  HB2  sing N N 148 
GLN   CB  HB3  sing N N 149 
GLN   CG  CD   sing N N 150 
GLN   CG  HG2  sing N N 151 
GLN   CG  HG3  sing N N 152 
GLN   CD  OE1  doub N N 153 
GLN   CD  NE2  sing N N 154 
GLN   NE2 HE21 sing N N 155 
GLN   NE2 HE22 sing N N 156 
GLN   OXT HXT  sing N N 157 
GLU   N   CA   sing N N 158 
GLU   N   H    sing N N 159 
GLU   N   H2   sing N N 160 
GLU   CA  C    sing N N 161 
GLU   CA  CB   sing N N 162 
GLU   CA  HA   sing N N 163 
GLU   C   O    doub N N 164 
GLU   C   OXT  sing N N 165 
GLU   CB  CG   sing N N 166 
GLU   CB  HB2  sing N N 167 
GLU   CB  HB3  sing N N 168 
GLU   CG  CD   sing N N 169 
GLU   CG  HG2  sing N N 170 
GLU   CG  HG3  sing N N 171 
GLU   CD  OE1  doub N N 172 
GLU   CD  OE2  sing N N 173 
GLU   OE2 HE2  sing N N 174 
GLU   OXT HXT  sing N N 175 
GLY   N   CA   sing N N 176 
GLY   N   H    sing N N 177 
GLY   N   H2   sing N N 178 
GLY   CA  C    sing N N 179 
GLY   CA  HA2  sing N N 180 
GLY   CA  HA3  sing N N 181 
GLY   C   O    doub N N 182 
GLY   C   OXT  sing N N 183 
GLY   OXT HXT  sing N N 184 
HIS   N   CA   sing N N 185 
HIS   N   H    sing N N 186 
HIS   N   H2   sing N N 187 
HIS   CA  C    sing N N 188 
HIS   CA  CB   sing N N 189 
HIS   CA  HA   sing N N 190 
HIS   C   O    doub N N 191 
HIS   C   OXT  sing N N 192 
HIS   CB  CG   sing N N 193 
HIS   CB  HB2  sing N N 194 
HIS   CB  HB3  sing N N 195 
HIS   CG  ND1  sing Y N 196 
HIS   CG  CD2  doub Y N 197 
HIS   ND1 CE1  doub Y N 198 
HIS   ND1 HD1  sing N N 199 
HIS   CD2 NE2  sing Y N 200 
HIS   CD2 HD2  sing N N 201 
HIS   CE1 NE2  sing Y N 202 
HIS   CE1 HE1  sing N N 203 
HIS   NE2 HE2  sing N N 204 
HIS   OXT HXT  sing N N 205 
HOH   O   H1   sing N N 206 
HOH   O   H2   sing N N 207 
ILE   N   CA   sing N N 208 
ILE   N   H    sing N N 209 
ILE   N   H2   sing N N 210 
ILE   CA  C    sing N N 211 
ILE   CA  CB   sing N N 212 
ILE   CA  HA   sing N N 213 
ILE   C   O    doub N N 214 
ILE   C   OXT  sing N N 215 
ILE   CB  CG1  sing N N 216 
ILE   CB  CG2  sing N N 217 
ILE   CB  HB   sing N N 218 
ILE   CG1 CD1  sing N N 219 
ILE   CG1 HG12 sing N N 220 
ILE   CG1 HG13 sing N N 221 
ILE   CG2 HG21 sing N N 222 
ILE   CG2 HG22 sing N N 223 
ILE   CG2 HG23 sing N N 224 
ILE   CD1 HD11 sing N N 225 
ILE   CD1 HD12 sing N N 226 
ILE   CD1 HD13 sing N N 227 
ILE   OXT HXT  sing N N 228 
LEU   N   CA   sing N N 229 
LEU   N   H    sing N N 230 
LEU   N   H2   sing N N 231 
LEU   CA  C    sing N N 232 
LEU   CA  CB   sing N N 233 
LEU   CA  HA   sing N N 234 
LEU   C   O    doub N N 235 
LEU   C   OXT  sing N N 236 
LEU   CB  CG   sing N N 237 
LEU   CB  HB2  sing N N 238 
LEU   CB  HB3  sing N N 239 
LEU   CG  CD1  sing N N 240 
LEU   CG  CD2  sing N N 241 
LEU   CG  HG   sing N N 242 
LEU   CD1 HD11 sing N N 243 
LEU   CD1 HD12 sing N N 244 
LEU   CD1 HD13 sing N N 245 
LEU   CD2 HD21 sing N N 246 
LEU   CD2 HD22 sing N N 247 
LEU   CD2 HD23 sing N N 248 
LEU   OXT HXT  sing N N 249 
LYS   N   CA   sing N N 250 
LYS   N   H    sing N N 251 
LYS   N   H2   sing N N 252 
LYS   CA  C    sing N N 253 
LYS   CA  CB   sing N N 254 
LYS   CA  HA   sing N N 255 
LYS   C   O    doub N N 256 
LYS   C   OXT  sing N N 257 
LYS   CB  CG   sing N N 258 
LYS   CB  HB2  sing N N 259 
LYS   CB  HB3  sing N N 260 
LYS   CG  CD   sing N N 261 
LYS   CG  HG2  sing N N 262 
LYS   CG  HG3  sing N N 263 
LYS   CD  CE   sing N N 264 
LYS   CD  HD2  sing N N 265 
LYS   CD  HD3  sing N N 266 
LYS   CE  NZ   sing N N 267 
LYS   CE  HE2  sing N N 268 
LYS   CE  HE3  sing N N 269 
LYS   NZ  HZ1  sing N N 270 
LYS   NZ  HZ2  sing N N 271 
LYS   NZ  HZ3  sing N N 272 
LYS   OXT HXT  sing N N 273 
MET   N   CA   sing N N 274 
MET   N   H    sing N N 275 
MET   N   H2   sing N N 276 
MET   CA  C    sing N N 277 
MET   CA  CB   sing N N 278 
MET   CA  HA   sing N N 279 
MET   C   O    doub N N 280 
MET   C   OXT  sing N N 281 
MET   CB  CG   sing N N 282 
MET   CB  HB2  sing N N 283 
MET   CB  HB3  sing N N 284 
MET   CG  SD   sing N N 285 
MET   CG  HG2  sing N N 286 
MET   CG  HG3  sing N N 287 
MET   SD  CE   sing N N 288 
MET   CE  HE1  sing N N 289 
MET   CE  HE2  sing N N 290 
MET   CE  HE3  sing N N 291 
MET   OXT HXT  sing N N 292 
PHE   N   CA   sing N N 293 
PHE   N   H    sing N N 294 
PHE   N   H2   sing N N 295 
PHE   CA  C    sing N N 296 
PHE   CA  CB   sing N N 297 
PHE   CA  HA   sing N N 298 
PHE   C   O    doub N N 299 
PHE   C   OXT  sing N N 300 
PHE   CB  CG   sing N N 301 
PHE   CB  HB2  sing N N 302 
PHE   CB  HB3  sing N N 303 
PHE   CG  CD1  doub Y N 304 
PHE   CG  CD2  sing Y N 305 
PHE   CD1 CE1  sing Y N 306 
PHE   CD1 HD1  sing N N 307 
PHE   CD2 CE2  doub Y N 308 
PHE   CD2 HD2  sing N N 309 
PHE   CE1 CZ   doub Y N 310 
PHE   CE1 HE1  sing N N 311 
PHE   CE2 CZ   sing Y N 312 
PHE   CE2 HE2  sing N N 313 
PHE   CZ  HZ   sing N N 314 
PHE   OXT HXT  sing N N 315 
PRO   N   CA   sing N N 316 
PRO   N   CD   sing N N 317 
PRO   N   H    sing N N 318 
PRO   CA  C    sing N N 319 
PRO   CA  CB   sing N N 320 
PRO   CA  HA   sing N N 321 
PRO   C   O    doub N N 322 
PRO   C   OXT  sing N N 323 
PRO   CB  CG   sing N N 324 
PRO   CB  HB2  sing N N 325 
PRO   CB  HB3  sing N N 326 
PRO   CG  CD   sing N N 327 
PRO   CG  HG2  sing N N 328 
PRO   CG  HG3  sing N N 329 
PRO   CD  HD2  sing N N 330 
PRO   CD  HD3  sing N N 331 
PRO   OXT HXT  sing N N 332 
SER   N   CA   sing N N 333 
SER   N   H    sing N N 334 
SER   N   H2   sing N N 335 
SER   CA  C    sing N N 336 
SER   CA  CB   sing N N 337 
SER   CA  HA   sing N N 338 
SER   C   O    doub N N 339 
SER   C   OXT  sing N N 340 
SER   CB  OG   sing N N 341 
SER   CB  HB2  sing N N 342 
SER   CB  HB3  sing N N 343 
SER   OG  HG   sing N N 344 
SER   OXT HXT  sing N N 345 
THR   N   CA   sing N N 346 
THR   N   H    sing N N 347 
THR   N   H2   sing N N 348 
THR   CA  C    sing N N 349 
THR   CA  CB   sing N N 350 
THR   CA  HA   sing N N 351 
THR   C   O    doub N N 352 
THR   C   OXT  sing N N 353 
THR   CB  OG1  sing N N 354 
THR   CB  CG2  sing N N 355 
THR   CB  HB   sing N N 356 
THR   OG1 HG1  sing N N 357 
THR   CG2 HG21 sing N N 358 
THR   CG2 HG22 sing N N 359 
THR   CG2 HG23 sing N N 360 
THR   OXT HXT  sing N N 361 
TRP   N   CA   sing N N 362 
TRP   N   H    sing N N 363 
TRP   N   H2   sing N N 364 
TRP   CA  C    sing N N 365 
TRP   CA  CB   sing N N 366 
TRP   CA  HA   sing N N 367 
TRP   C   O    doub N N 368 
TRP   C   OXT  sing N N 369 
TRP   CB  CG   sing N N 370 
TRP   CB  HB2  sing N N 371 
TRP   CB  HB3  sing N N 372 
TRP   CG  CD1  doub Y N 373 
TRP   CG  CD2  sing Y N 374 
TRP   CD1 NE1  sing Y N 375 
TRP   CD1 HD1  sing N N 376 
TRP   CD2 CE2  doub Y N 377 
TRP   CD2 CE3  sing Y N 378 
TRP   NE1 CE2  sing Y N 379 
TRP   NE1 HE1  sing N N 380 
TRP   CE2 CZ2  sing Y N 381 
TRP   CE3 CZ3  doub Y N 382 
TRP   CE3 HE3  sing N N 383 
TRP   CZ2 CH2  doub Y N 384 
TRP   CZ2 HZ2  sing N N 385 
TRP   CZ3 CH2  sing Y N 386 
TRP   CZ3 HZ3  sing N N 387 
TRP   CH2 HH2  sing N N 388 
TRP   OXT HXT  sing N N 389 
TYR   N   CA   sing N N 390 
TYR   N   H    sing N N 391 
TYR   N   H2   sing N N 392 
TYR   CA  C    sing N N 393 
TYR   CA  CB   sing N N 394 
TYR   CA  HA   sing N N 395 
TYR   C   O    doub N N 396 
TYR   C   OXT  sing N N 397 
TYR   CB  CG   sing N N 398 
TYR   CB  HB2  sing N N 399 
TYR   CB  HB3  sing N N 400 
TYR   CG  CD1  doub Y N 401 
TYR   CG  CD2  sing Y N 402 
TYR   CD1 CE1  sing Y N 403 
TYR   CD1 HD1  sing N N 404 
TYR   CD2 CE2  doub Y N 405 
TYR   CD2 HD2  sing N N 406 
TYR   CE1 CZ   doub Y N 407 
TYR   CE1 HE1  sing N N 408 
TYR   CE2 CZ   sing Y N 409 
TYR   CE2 HE2  sing N N 410 
TYR   CZ  OH   sing N N 411 
TYR   OH  HH   sing N N 412 
TYR   OXT HXT  sing N N 413 
VAL   N   CA   sing N N 414 
VAL   N   H    sing N N 415 
VAL   N   H2   sing N N 416 
VAL   CA  C    sing N N 417 
VAL   CA  CB   sing N N 418 
VAL   CA  HA   sing N N 419 
VAL   C   O    doub N N 420 
VAL   C   OXT  sing N N 421 
VAL   CB  CG1  sing N N 422 
VAL   CB  CG2  sing N N 423 
VAL   CB  HB   sing N N 424 
VAL   CG1 HG11 sing N N 425 
VAL   CG1 HG12 sing N N 426 
VAL   CG1 HG13 sing N N 427 
VAL   CG2 HG21 sing N N 428 
VAL   CG2 HG22 sing N N 429 
VAL   CG2 HG23 sing N N 430 
VAL   OXT HXT  sing N N 431 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      Other 
_pdbx_initial_refinement_model.accession_code   ? 
_pdbx_initial_refinement_model.details          'Unpublished crystal structure' 
# 
_atom_sites.entry_id                    9FQP 
_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]   0.024532 
_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]   0.009327 
_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]   0.005702 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C  
CL 
F  
H  
N  
O  
S  
# 
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_site.pdbx_tls_group_id 
ATOM   1    N  N    . GLN   A 1 8   ? 13.487  -3.563  -8.987  1   76.21  ? 701  GLN   A N    1 1 
ATOM   2    C  CA   . GLN   A 1 8   ? 12.455  -3.918  -8.016  1   76.67  ? 701  GLN   A CA   1 1 
ATOM   3    C  C    . GLN   A 1 8   ? 11.8    -2.664  -7.423  1   76.62  ? 701  GLN   A C    1 1 
ATOM   4    O  O    . GLN   A 1 8   ? 12.488  -1.687  -7.133  1   76.67  ? 701  GLN   A O    1 1 
ATOM   5    C  CB   . GLN   A 1 8   ? 13.024  -4.828  -6.91   1   78.77  ? 701  GLN   A CB   1 1 
ATOM   6    C  CG   . GLN   A 1 8   ? 14.352  -4.356  -6.315  1   83.18  ? 701  GLN   A CG   1 1 
ATOM   7    C  CD   . GLN   A 1 8   ? 14.873  -5.298  -5.254  1   89.02  ? 701  GLN   A CD   1 1 
ATOM   8    O  OE1  . GLN   A 1 8   ? 14.807  -6.526  -5.393  1   90.99  ? 701  GLN   A OE1  1 1 
ATOM   9    N  NE2  . GLN   A 1 8   ? 15.406  -4.761  -4.163  1   90.09  ? 701  GLN   A NE2  1 1 
ATOM   10   H  HA   . GLN   A 1 8   ? 11.684  -4.482  -8.537  0   95.85  ? 701  GLN   A HA   1 1 
ATOM   11   H  HB2  . GLN   A 1 8   ? 12.299  -4.88   -6.099  0   100.12 ? 701  GLN   A HB2  1 1 
ATOM   12   H  HB3  . GLN   A 1 8   ? 13.173  -5.821  -7.332  0   102.62 ? 701  GLN   A HB3  1 1 
ATOM   13   H  HG2  . GLN   A 1 8   ? 15.108  -4.306  -7.096  0   107.07 ? 701  GLN   A HG2  1 1 
ATOM   14   H  HG3  . GLN   A 1 8   ? 14.205  -3.371  -5.873  0   104.69 ? 701  GLN   A HG3  1 1 
ATOM   15   H  HE21 . GLN   A 1 8   ? 15.461  -3.754  -4.05   0   114.71 ? 701  GLN   A HE21 1 1 
ATOM   16   H  HE22 . GLN   A 1 8   ? 15.766  -5.368  -3.434  0   118.28 ? 701  GLN   A HE22 1 1 
ATOM   17   N  N    . ALA   A 1 9   ? 10.465  -2.689  -7.271  1   76.23  ? 702  ALA   A N    1 1 
ATOM   18   C  CA   . ALA   A 1 9   ? 9.691   -1.56   -6.75   1   76.46  ? 702  ALA   A CA   1 1 
ATOM   19   C  C    . ALA   A 1 9   ? 9.643   -1.546  -5.216  1   76.46  ? 702  ALA   A C    1 1 
ATOM   20   O  O    . ALA   A 1 9   ? 9.175   -2.511  -4.616  1   76.8   ? 702  ALA   A O    1 1 
ATOM   21   C  CB   . ALA   A 1 9   ? 8.276   -1.611  -7.303  1   76.58  ? 702  ALA   A CB   1 1 
ATOM   22   H  H    . ALA   A 1 9   ? 9.889   -3.49   -7.507  0   92.17  ? 702  ALA   A H    1 1 
ATOM   23   H  HA   . ALA   A 1 9   ? 10.133  -0.627  -7.096  0   88.72  ? 702  ALA   A HA   1 1 
ATOM   24   H  HB1  . ALA   A 1 9   ? 7.695   -0.806  -6.856  0   87     ? 702  ALA   A HB1  1 1 
ATOM   25   H  HB2  . ALA   A 1 9   ? 8.313   -1.484  -8.385  0   87.87  ? 702  ALA   A HB2  1 1 
ATOM   26   H  HB3  . ALA   A 1 9   ? 7.826   -2.571  -7.056  0   89.48  ? 702  ALA   A HB3  1 1 
ATOM   27   N  N    . LEU   A 1 10  ? 10.109  -0.446  -4.589  1   75.98  ? 703  LEU   A N    1 1 
ATOM   28   C  CA   . LEU   A 1 10  ? 10.105  -0.271  -3.134  1   76.01  ? 703  LEU   A CA   1 1 
ATOM   29   C  C    . LEU   A 1 10  ? 9.398   1.042   -2.78   1   76.3   ? 703  LEU   A C    1 1 
ATOM   30   O  O    . LEU   A 1 10  ? 9.706   2.065   -3.387  1   76.89  ? 703  LEU   A O    1 1 
ATOM   31   C  CB   . LEU   A 1 10  ? 11.55   -0.223  -2.599  1   76     ? 703  LEU   A CB   1 1 
ATOM   32   C  CG   . LEU   A 1 10  ? 12.484  -1.445  -2.925  1   77.32  ? 703  LEU   A CG   1 1 
ATOM   33   C  CD1  . LEU   A 1 10  ? 13.628  -1.048  -3.856  1   77.95  ? 703  LEU   A CD1  1 1 
ATOM   34   C  CD2  . LEU   A 1 10  ? 13.083  -2.052  -1.663  1   77.8   ? 703  LEU   A CD2  1 1 
ATOM   35   H  H    . LEU   A 1 10  ? 10.513  0.35    -5.072  0   88.48  ? 703  LEU   A H    1 1 
ATOM   36   H  HA   . LEU   A 1 10  ? 9.584   -1.09   -2.641  0   90.83  ? 703  LEU   A HA   1 1 
ATOM   37   H  HB2  . LEU   A 1 10  ? 12.002  0.683   -3.001  0   91.3   ? 703  LEU   A HB2  1 1 
ATOM   38   H  HB3  . LEU   A 1 10  ? 11.482  -0.109  -1.518  0   92.49  ? 703  LEU   A HB3  1 1 
ATOM   39   H  HG   . LEU   A 1 10  ? 11.931  -2.239  -3.424  0   95.35  ? 703  LEU   A HG   1 1 
ATOM   40   H  HD11 . LEU   A 1 10  ? 14.295  -1.9    -3.982  0   98.63  ? 703  LEU   A HD11 1 1 
ATOM   41   H  HD12 . LEU   A 1 10  ? 13.214  -0.753  -4.819  0   95.15  ? 703  LEU   A HD12 1 1 
ATOM   42   H  HD13 . LEU   A 1 10  ? 14.169  -0.213  -3.413  0   97.07  ? 703  LEU   A HD13 1 1 
ATOM   43   H  HD21 . LEU   A 1 10  ? 13.646  -2.943  -1.934  0   100.19 ? 703  LEU   A HD21 1 1 
ATOM   44   H  HD22 . LEU   A 1 10  ? 13.744  -1.321  -1.199  0   98.66  ? 703  LEU   A HD22 1 1 
ATOM   45   H  HD23 . LEU   A 1 10  ? 12.278  -2.315  -0.979  0   98.05  ? 703  LEU   A HD23 1 1 
ATOM   46   N  N    . LEU   A 1 11  ? 8.469   1.024   -1.799  1   75.81  ? 704  LEU   A N    1 1 
ATOM   47   C  CA   . LEU   A 1 11  ? 7.747   2.23    -1.368  1   75.88  ? 704  LEU   A CA   1 1 
ATOM   48   C  C    . LEU   A 1 11  ? 8.193   2.652   0.02    1   75.95  ? 704  LEU   A C    1 1 
ATOM   49   O  O    . LEU   A 1 11  ? 8.275   1.808   0.906   1   76.28  ? 704  LEU   A O    1 1 
ATOM   50   C  CB   . LEU   A 1 11  ? 6.226   1.991   -1.315  1   76.19  ? 704  LEU   A CB   1 1 
ATOM   51   C  CG   . LEU   A 1 11  ? 5.51    1.504   -2.572  1   78.24  ? 704  LEU   A CG   1 1 
ATOM   52   C  CD1  . LEU   A 1 11  ? 4.019   1.373   -2.308  1   78.99  ? 704  LEU   A CD1  1 1 
ATOM   53   C  CD2  . LEU   A 1 11  ? 5.718   2.456   -3.732  1   79.1   ? 704  LEU   A CD2  1 1 
ATOM   54   H  H    . LEU   A 1 11  ? 8.201   0.192   -1.283  0   89.13  ? 704  LEU   A H    1 1 
ATOM   55   H  HA   . LEU   A 1 11  ? 7.95    3.06    -2.043  0   85.74  ? 704  LEU   A HA   1 1 
ATOM   56   H  HB2  . LEU   A 1 11  ? 6.029   1.257   -0.534  0   87.74  ? 704  LEU   A HB2  1 1 
ATOM   57   H  HB3  . LEU   A 1 11  ? 5.754   2.933   -1.039  0   86.02  ? 704  LEU   A HB3  1 1 
ATOM   58   H  HG   . LEU   A 1 11  ? 5.899   0.528   -2.859  0   88.34  ? 704  LEU   A HG   1 1 
ATOM   59   H  HD11 . LEU   A 1 11  ? 3.548   0.891   -3.164  0   87.38  ? 704  LEU   A HD11 1 1 
ATOM   60   H  HD12 . LEU   A 1 11  ? 3.86    0.781   -1.408  0   89.18  ? 704  LEU   A HD12 1 1 
ATOM   61   H  HD13 . LEU   A 1 11  ? 3.6     2.369   -2.173  0   87.38  ? 704  LEU   A HD13 1 1 
ATOM   62   H  HD21 . LEU   A 1 11  ? 5.024   2.219   -4.537  0   86.23  ? 704  LEU   A HD21 1 1 
ATOM   63   H  HD22 . LEU   A 1 11  ? 5.553   3.474   -3.381  0   86.31  ? 704  LEU   A HD22 1 1 
ATOM   64   H  HD23 . LEU   A 1 11  ? 6.739   2.348   -4.093  0   87.38  ? 704  LEU   A HD23 1 1 
ATOM   65   N  N    . ARG   A 1 12  ? 8.421   3.958   0.23    1   75.61  ? 705  ARG   A N    1 1 
ATOM   66   C  CA   . ARG   A 1 12  ? 8.811   4.491   1.536   1   75.74  ? 705  ARG   A CA   1 1 
ATOM   67   C  C    . ARG   A 1 12  ? 7.566   4.965   2.279   1   75.81  ? 705  ARG   A C    1 1 
ATOM   68   O  O    . ARG   A 1 12  ? 7.016   6.005   1.922   1   75.81  ? 705  ARG   A O    1 1 
ATOM   69   C  CB   . ARG   A 1 12  ? 9.804   5.662   1.376   1   77     ? 705  ARG   A CB   1 1 
ATOM   70   C  CG   . ARG   A 1 12  ? 11.201  5.194   0.962   1   79.81  ? 705  ARG   A CG   1 1 
ATOM   71   C  CD   . ARG   A 1 12  ? 12.313  6.249   0.86    1   82.58  ? 705  ARG   A CD   1 1 
ATOM   72   N  NE   . ARG   A 1 12  ? 12.145  7.483   1.641   1   84.54  ? 705  ARG   A NE   1 1 
ATOM   73   C  CZ   . ARG   A 1 12  ? 12.187  7.583   2.972   1   85.57  ? 705  ARG   A CZ   1 1 
ATOM   74   N  NH1  . ARG   A 1 12  ? 12.315  6.495   3.727   1   84.75  ? 705  ARG   A NH1  1 1 
ATOM   75   N  NH2  . ARG   A 1 12  ? 12.059  8.767   3.559   1   85.14  ? 705  ARG   A NH2  1 1 
ATOM   76   H  H    . ARG   A 1 12  ? 8.332   4.672   -0.485  0   85.84  ? 705  ARG   A H    1 1 
ATOM   77   H  HA   . ARG   A 1 12  ? 9.292   3.721   2.137   0   89.59  ? 705  ARG   A HA   1 1 
ATOM   78   H  HB2  . ARG   A 1 12  ? 9.438   6.355   0.62    0   88.39  ? 705  ARG   A HB2  1 1 
ATOM   79   H  HB3  . ARG   A 1 12  ? 9.888   6.172   2.335   0   90.43  ? 705  ARG   A HB3  1 1 
ATOM   80   H  HG2  . ARG   A 1 12  ? 11.535  4.445   1.678   0   94.96  ? 705  ARG   A HG2  1 1 
ATOM   81   H  HG3  . ARG   A 1 12  ? 11.119  4.733   -0.022  0   92.91  ? 705  ARG   A HG3  1 1 
ATOM   82   H  HD2  . ARG   A 1 12  ? 13.246  5.789   1.185   0   99.12  ? 705  ARG   A HD2  1 1 
ATOM   83   H  HD3  . ARG   A 1 12  ? 12.408  6.541   -0.185  0   96.71  ? 705  ARG   A HD3  1 1 
ATOM   84   H  HE   . ARG   A 1 12  ? 12.067  8.345   1.111   0   99.09  ? 705  ARG   A HE   1 1 
ATOM   85   H  HH11 . ARG   A 1 12  ? 12.405  5.566   3.331   0   101.97 ? 705  ARG   A HH11 1 1 
ATOM   86   H  HH12 . ARG   A 1 12  ? 12.314  6.587   4.738   0   103.19 ? 705  ARG   A HH12 1 1 
ATOM   87   H  HH21 . ARG   A 1 12  ? 11.957  9.607   2.998   0   101.62 ? 705  ARG   A HH21 1 1 
ATOM   88   H  HH22 . ARG   A 1 12  ? 12.062  8.843   4.571   0   103.25 ? 705  ARG   A HH22 1 1 
ATOM   89   N  N    . ILE   A 1 13  ? 7.117   4.215   3.306   1   75.55  ? 706  ILE   A N    1 1 
ATOM   90   C  CA   . ILE   A 1 13  ? 5.928   4.612   4.067   1   75.86  ? 706  ILE   A CA   1 1 
ATOM   91   C  C    . ILE   A 1 13  ? 6.321   5.801   4.935   1   75.69  ? 706  ILE   A C    1 1 
ATOM   92   O  O    . ILE   A 1 13  ? 7.191   5.668   5.795   1   76.01  ? 706  ILE   A O    1 1 
ATOM   93   C  CB   . ILE   A 1 13  ? 5.316   3.476   4.941   1   76.48  ? 706  ILE   A CB   1 1 
ATOM   94   C  CG1  . ILE   A 1 13  ? 5.055   2.156   4.153   1   77.65  ? 706  ILE   A CG1  1 1 
ATOM   95   C  CG2  . ILE   A 1 13  ? 4.043   3.976   5.642   1   76.94  ? 706  ILE   A CG2  1 1 
ATOM   96   C  CD1  . ILE   A 1 13  ? 3.965   2.17    3.087   1   79.05  ? 706  ILE   A CD1  1 1 
ATOM   97   H  H    . ILE   A 1 13  ? 7.575   3.372   3.638   0   89.74  ? 706  ILE   A H    1 1 
ATOM   98   H  HA   . ILE   A 1 13  ? 5.158   4.937   3.37    0   87.94  ? 706  ILE   A HA   1 1 
ATOM   99   H  HB   . ILE   A 1 13  ? 6.04    3.245   5.721   0   92.1   ? 706  ILE   A HB   1 1 
ATOM   100  H  HG12 . ILE   A 1 13  ? 5.978   1.846   3.664   0   91.53  ? 706  ILE   A HG12 1 1 
ATOM   101  H  HG13 . ILE   A 1 13  ? 4.77    1.392   4.875   0   93.11  ? 706  ILE   A HG13 1 1 
ATOM   102  H  HG21 . ILE   A 1 13  ? 3.436   3.122   5.938   0   92.43  ? 706  ILE   A HG21 1 1 
ATOM   103  H  HG22 . ILE   A 1 13  ? 4.327   4.529   6.537   0   91.91  ? 706  ILE   A HG22 1 1 
ATOM   104  H  HG23 . ILE   A 1 13  ? 3.476   4.622   4.973   0   90.37  ? 706  ILE   A HG23 1 1 
ATOM   105  H  HD11 . ILE   A 1 13  ? 4.078   1.279   2.471   0   92.27  ? 706  ILE   A HD11 1 1 
ATOM   106  H  HD12 . ILE   A 1 13  ? 2.984   2.154   3.561   0   92.66  ? 706  ILE   A HD12 1 1 
ATOM   107  H  HD13 . ILE   A 1 13  ? 4.07    3.055   2.463   0   90.91  ? 706  ILE   A HD13 1 1 
ATOM   108  N  N    . LEU   A 1 14  ? 5.702   6.963   4.694   1   75.38  ? 707  LEU   A N    1 1 
ATOM   109  C  CA   . LEU   A 1 14  ? 5.998   8.187   5.429   1   75.25  ? 707  LEU   A CA   1 1 
ATOM   110  C  C    . LEU   A 1 14  ? 4.862   8.492   6.404   1   75.39  ? 707  LEU   A C    1 1 
ATOM   111  O  O    . LEU   A 1 14  ? 3.692   8.331   6.062   1   75.49  ? 707  LEU   A O    1 1 
ATOM   112  C  CB   . LEU   A 1 14  ? 6.227   9.35    4.442   1   75.59  ? 707  LEU   A CB   1 1 
ATOM   113  C  CG   . LEU   A 1 14  ? 7.276   9.107   3.33    1   77.07  ? 707  LEU   A CG   1 1 
ATOM   114  C  CD1  . LEU   A 1 14  ? 7.265   10.229  2.317   1   77.77  ? 707  LEU   A CD1  1 1 
ATOM   115  C  CD2  . LEU   A 1 14  ? 8.676   8.959   3.901   1   77.73  ? 707  LEU   A CD2  1 1 
ATOM   116  H  H    . LEU   A 1 14  ? 4.98    7.09    3.992   0   87.61  ? 707  LEU   A H    1 1 
ATOM   117  H  HA   . LEU   A 1 14  ? 6.904   8.062   6.019   0   90.62  ? 707  LEU   A HA   1 1 
ATOM   118  H  HB2  . LEU   A 1 14  ? 5.282   9.576   3.951   0   88.01  ? 707  LEU   A HB2  1 1 
ATOM   119  H  HB3  . LEU   A 1 14  ? 6.557   10.218  5.011   0   89.9   ? 707  LEU   A HB3  1 1 
ATOM   120  H  HG   . LEU   A 1 14  ? 7.038   8.19    2.792   0   88.84  ? 707  LEU   A HG   1 1 
ATOM   121  H  HD11 . LEU   A 1 14  ? 8.075   10.085  1.603   0   88.82  ? 707  LEU   A HD11 1 1 
ATOM   122  H  HD12 . LEU   A 1 14  ? 6.312   10.214  1.791   0   88.25  ? 707  LEU   A HD12 1 1 
ATOM   123  H  HD13 . LEU   A 1 14  ? 7.39    11.177  2.837   0   90.16  ? 707  LEU   A HD13 1 1 
ATOM   124  H  HD21 . LEU   A 1 14  ? 9.4     8.94    3.088   0   91.4   ? 707  LEU   A HD21 1 1 
ATOM   125  H  HD22 . LEU   A 1 14  ? 8.881   9.803   4.558   0   92.72  ? 707  LEU   A HD22 1 1 
ATOM   126  H  HD23 . LEU   A 1 14  ? 8.752   8.027   4.46    0   92.55  ? 707  LEU   A HD23 1 1 
ATOM   127  N  N    . LYS   A 1 15  ? 5.212   8.904   7.631   1   74.83  ? 708  LYS   A N    1 1 
ATOM   128  C  CA   . LYS   A 1 15  ? 4.233   9.186   8.687   1   75.02  ? 708  LYS   A CA   1 1 
ATOM   129  C  C    . LYS   A 1 15  ? 3.524   10.512  8.425   1   75.06  ? 708  LYS   A C    1 1 
ATOM   130  O  O    . LYS   A 1 15  ? 4.133   11.426  7.871   1   75.37  ? 708  LYS   A O    1 1 
ATOM   131  C  CB   . LYS   A 1 15  ? 4.921   9.271   10.066  1   76.52  ? 708  LYS   A CB   1 1 
ATOM   132  C  CG   . LYS   A 1 15  ? 5.737   8.043   10.482  1   80.12  ? 708  LYS   A CG   1 1 
ATOM   133  C  CD   . LYS   A 1 15  ? 6.424   8.249   11.842  1   83.93  ? 708  LYS   A CD   1 1 
ATOM   134  C  CE   . LYS   A 1 15  ? 7.724   7.476   11.969  1   87.25  ? 708  LYS   A CE   1 1 
ATOM   135  N  NZ   . LYS   A 1 15  ? 8.462   7.757   13.239  1   89.34  ? 708  LYS   A NZ   1 1 
ATOM   136  H  H    . LYS   A 1 15  ? 6.171   9.101   7.899   0   92.36  ? 708  LYS   A H    1 1 
ATOM   137  H  HA   . LYS   A 1 15  ? 3.488   8.393   8.721   0   92.59  ? 708  LYS   A HA   1 1 
ATOM   138  H  HB2  . LYS   A 1 15  ? 5.592   10.129  10.056  0   97.06  ? 708  LYS   A HB2  1 1 
ATOM   139  H  HB3  . LYS   A 1 15  ? 4.151   9.419   10.823  0   97.35  ? 708  LYS   A HB3  1 1 
ATOM   140  H  HG2  . LYS   A 1 15  ? 5.075   7.182   10.561  0   100.3  ? 708  LYS   A HG2  1 1 
ATOM   141  H  HG3  . LYS   A 1 15  ? 6.507   7.858   9.735   0   99.88  ? 708  LYS   A HG3  1 1 
ATOM   142  H  HD2  . LYS   A 1 15  ? 6.653   9.305   11.977  0   107.24 ? 708  LYS   A HD2  1 1 
ATOM   143  H  HD3  . LYS   A 1 15  ? 5.755   7.91    12.631  0   107.44 ? 708  LYS   A HD3  1 1 
ATOM   144  H  HE2  . LYS   A 1 15  ? 7.501   6.41    11.942  0   110.59 ? 708  LYS   A HE2  1 1 
ATOM   145  H  HE3  . LYS   A 1 15  ? 8.38    7.739   11.141  0   110.02 ? 708  LYS   A HE3  1 1 
ATOM   146  H  HZ1  . LYS   A 1 15  ? 9.445   7.904   13.033  0   115.69 ? 708  LYS   A HZ1  1 1 
ATOM   147  H  HZ2  . LYS   A 1 15  ? 8.103   8.58    13.713  0   115.77 ? 708  LYS   A HZ2  1 1 
ATOM   148  H  HZ3  . LYS   A 1 15  ? 8.382   6.96    13.862  0   116.07 ? 708  LYS   A HZ3  1 1 
ATOM   149  N  N    . GLU   A 1 16  ? 2.26    10.642  8.866   1   74.78  ? 709  GLU   A N    1 1 
ATOM   150  C  CA   . GLU   A 1 16  ? 1.515   11.897  8.699   1   74.97  ? 709  GLU   A CA   1 1 
ATOM   151  C  C    . GLU   A 1 16  ? 2.127   13.053  9.518   1   74.93  ? 709  GLU   A C    1 1 
ATOM   152  O  O    . GLU   A 1 16  ? 1.956   14.212  9.144   1   75.09  ? 709  GLU   A O    1 1 
ATOM   153  C  CB   . GLU   A 1 16  ? 0.014   11.715  9.011   1   77.22  ? 709  GLU   A CB   1 1 
ATOM   154  C  CG   . GLU   A 1 16  ? -0.374  11.687  10.484  1   82.41  ? 709  GLU   A CG   1 1 
ATOM   155  C  CD   . GLU   A 1 16  ? -1.854  11.479  10.747  1   88.73  ? 709  GLU   A CD   1 1 
ATOM   156  O  OE1  . GLU   A 1 16  ? -2.21   11.181  11.91   1   89.76  ? 709  GLU   A OE1  1 1 
ATOM   157  O  OE2  . GLU   A 1 16  ? -2.659  11.622  9.798   1   90.7   ? 709  GLU   A OE2  1 1 
ATOM   158  H  H    . GLU   A 1 16  ? 1.742   9.902   9.329   0   93.67  ? 709  GLU   A H    1 1 
ATOM   159  H  HA   . GLU   A 1 16  ? 1.579   12.187  7.652   0   92.56  ? 709  GLU   A HA   1 1 
ATOM   160  H  HB2  . GLU   A 1 16  ? -0.532  12.53   8.538   0   96.81  ? 709  GLU   A HB2  1 1 
ATOM   161  H  HB3  . GLU   A 1 16  ? -0.297  10.763  8.583   0   95.81  ? 709  GLU   A HB3  1 1 
ATOM   162  H  HG2  . GLU   A 1 16  ? 0.163   10.874  10.971  0   104.35 ? 709  GLU   A HG2  1 1 
ATOM   163  H  HG3  . GLU   A 1 16  ? -0.113  12.635  10.952  0   105.45 ? 709  GLU   A HG3  1 1 
ATOM   164  N  N    . THR   A 1 17  ? 2.857   12.74   10.609  1   74.58  ? 710  THR   A N    1 1 
ATOM   165  C  CA   . THR   A 1 17  ? 3.53    13.746  11.434  1   74.76  ? 710  THR   A CA   1 1 
ATOM   166  C  C    . THR   A 1 17  ? 4.72    14.404  10.697  1   74.73  ? 710  THR   A C    1 1 
ATOM   167  O  O    . THR   A 1 17  ? 5.141   15.489  11.09   1   74.87  ? 710  THR   A O    1 1 
ATOM   168  C  CB   . THR   A 1 17  ? 3.991   13.121  12.767  1   75.98  ? 710  THR   A CB   1 1 
ATOM   169  O  OG1  . THR   A 1 17  ? 4.708   11.912  12.497  1   77.02  ? 710  THR   A OG1  1 1 
ATOM   170  C  CG2  . THR   A 1 17  ? 2.827   12.829  13.719  1   76.24  ? 710  THR   A CG2  1 1 
ATOM   171  H  H    . THR   A 1 17  ? 3.005   11.793  10.941  0   96.61  ? 710  THR   A H    1 1 
ATOM   172  H  HA   . THR   A 1 17  ? 2.821   14.542  11.66   0   99.97  ? 710  THR   A HA   1 1 
ATOM   173  H  HB   . THR   A 1 17  ? 4.661   13.819  13.267  0   103.41 ? 710  THR   A HB   1 1 
ATOM   174  H  HG1  . THR   A 1 17  ? 4.983   11.481  13.349  0   102.87 ? 710  THR   A HG1  1 1 
ATOM   175  H  HG21 . THR   A 1 17  ? 3.202   12.403  14.649  0   104.58 ? 710  THR   A HG21 1 1 
ATOM   176  H  HG22 . THR   A 1 17  ? 2.289   13.75   13.943  0   104.52 ? 710  THR   A HG22 1 1 
ATOM   177  H  HG23 . THR   A 1 17  ? 2.139   12.122  13.258  0   102.11 ? 710  THR   A HG23 1 1 
ATOM   178  N  N    . GLU   A 1 18  ? 5.256   13.765  9.64    1   74.5   ? 711  GLU   A N    1 1 
ATOM   179  C  CA   . GLU   A 1 18  ? 6.356   14.328  8.853   1   74.7   ? 711  GLU   A CA   1 1 
ATOM   180  C  C    . GLU   A 1 18  ? 5.872   15.451  7.907   1   74.84  ? 711  GLU   A C    1 1 
ATOM   181  O  O    . GLU   A 1 18  ? 6.685   16.279  7.501   1   74.82  ? 711  GLU   A O    1 1 
ATOM   182  C  CB   . GLU   A 1 18  ? 7.052   13.229  8.028   1   76.81  ? 711  GLU   A CB   1 1 
ATOM   183  C  CG   . GLU   A 1 18  ? 7.818   12.213  8.855   1   81.14  ? 711  GLU   A CG   1 1 
ATOM   184  C  CD   . GLU   A 1 18  ? 8.361   11.054  8.044   1   86.63  ? 711  GLU   A CD   1 1 
ATOM   185  O  OE1  . GLU   A 1 18  ? 8.982   11.305  6.986   1   87.66  ? 711  GLU   A OE1  1 1 
ATOM   186  O  OE2  . GLU   A 1 18  ? 8.164   9.891   8.464   1   88.44  ? 711  GLU   A OE2  1 1 
ATOM   187  H  H    . GLU   A 1 18  ? 4.947   12.86   9.3     0   95.12  ? 711  GLU   A H    1 1 
ATOM   188  H  HA   . GLU   A 1 18  ? 7.101   14.751  9.525   0   98.02  ? 711  GLU   A HA   1 1 
ATOM   189  H  HB2  . GLU   A 1 18  ? 6.308   12.693  7.441   0   95.16  ? 711  GLU   A HB2  1 1 
ATOM   190  H  HB3  . GLU   A 1 18  ? 7.767   13.706  7.36    0   96.44  ? 711  GLU   A HB3  1 1 
ATOM   191  H  HG2  . GLU   A 1 18  ? 8.663   12.712  9.327   0   103.51 ? 711  GLU   A HG2  1 1 
ATOM   192  H  HG3  . GLU   A 1 18  ? 7.159   11.8    9.617   0   102.46 ? 711  GLU   A HG3  1 1 
ATOM   193  N  N    . PHE   A 1 19  ? 4.573   15.465  7.537   1   74.62  ? 712  PHE   A N    1 1 
ATOM   194  C  CA   . PHE   A 1 19  ? 4.007   16.473  6.639   1   75.1   ? 712  PHE   A CA   1 1 
ATOM   195  C  C    . PHE   A 1 19  ? 3.29    17.569  7.423   1   74.74  ? 712  PHE   A C    1 1 
ATOM   196  O  O    . PHE   A 1 19  ? 2.543   17.263  8.35    1   74.93  ? 712  PHE   A O    1 1 
ATOM   197  C  CB   . PHE   A 1 19  ? 3.014   15.814  5.67    1   75.28  ? 712  PHE   A CB   1 1 
ATOM   198  C  CG   . PHE   A 1 19  ? 3.623   14.69   4.872   1   76.25  ? 712  PHE   A CG   1 1 
ATOM   199  C  CD1  . PHE   A 1 19  ? 3.396   13.37   5.219   1   77.05  ? 712  PHE   A CD1  1 1 
ATOM   200  C  CD2  . PHE   A 1 19  ? 4.464   14.954  3.808   1   77.08  ? 712  PHE   A CD2  1 1 
ATOM   201  C  CE1  . PHE   A 1 19  ? 3.988   12.339  4.507   1   77.84  ? 712  PHE   A CE1  1 1 
ATOM   202  C  CE2  . PHE   A 1 19  ? 5.042   13.921  3.089   1   77.86  ? 712  PHE   A CE2  1 1 
ATOM   203  C  CZ   . PHE   A 1 19  ? 4.804   12.621  3.446   1   77.65  ? 712  PHE   A CZ   1 1 
ATOM   204  H  H    . PHE   A 1 19  ? 3.883   14.78   7.825   0   94.34  ? 712  PHE   A H    1 1 
ATOM   205  H  HA   . PHE   A 1 19  ? 4.793   16.928  6.039   0   94.61  ? 712  PHE   A HA   1 1 
ATOM   206  H  HB2  . PHE   A 1 19  ? 2.176   15.414  6.239   0   93.3   ? 712  PHE   A HB2  1 1 
ATOM   207  H  HB3  . PHE   A 1 19  ? 2.657   16.566  4.967   0   92.67  ? 712  PHE   A HB3  1 1 
ATOM   208  H  HD1  . PHE   A 1 19  ? 2.758   13.138  6.056   0   93.01  ? 712  PHE   A HD1  1 1 
ATOM   209  H  HD2  . PHE   A 1 19  ? 4.665   15.974  3.527   0   92.21  ? 712  PHE   A HD2  1 1 
ATOM   210  H  HE1  . PHE   A 1 19  ? 3.795   11.314  4.778   0   91.3   ? 712  PHE   A HE1  1 1 
ATOM   211  H  HE2  . PHE   A 1 19  ? 5.694   14.147  2.264   0   90.27  ? 712  PHE   A HE2  1 1 
ATOM   212  H  HZ   . PHE   A 1 19  ? 5.257   11.819  2.886   0   89.38  ? 712  PHE   A HZ   1 1 
ATOM   213  N  N    . LYS   A 1 20  ? 3.513   18.843  7.048   1   74.24  ? 713  LYS   A N    1 1 
ATOM   214  C  CA   . LYS   A 1 20  ? 2.885   20.004  7.689   1   74.18  ? 713  LYS   A CA   1 1 
ATOM   215  C  C    . LYS   A 1 20  ? 2.48    21.051  6.63    1   74.26  ? 713  LYS   A C    1 1 
ATOM   216  O  O    . LYS   A 1 20  ? 2.987   21.027  5.506   1   74.37  ? 713  LYS   A O    1 1 
ATOM   217  C  CB   . LYS   A 1 20  ? 3.828   20.643  8.739   1   75.52  ? 713  LYS   A CB   1 1 
ATOM   218  C  CG   . LYS   A 1 20  ? 4.289   19.714  9.873   1   79.01  ? 713  LYS   A CG   1 1 
ATOM   219  C  CD   . LYS   A 1 20  ? 3.209   19.456  10.942  1   82.81  ? 713  LYS   A CD   1 1 
ATOM   220  C  CE   . LYS   A 1 20  ? 3.545   18.266  11.817  1   86.2   ? 713  LYS   A CE   1 1 
ATOM   221  N  NZ   . LYS   A 1 20  ? 2.35    17.642  12.457  1   88.55  ? 713  LYS   A NZ   1 1 
ATOM   222  H  H    . LYS   A 1 20  ? 4.133   19.105  6.288   0   96.16  ? 713  LYS   A H    1 1 
ATOM   223  H  HA   . LYS   A 1 20  ? 1.967   19.703  8.19    0   99.94  ? 713  LYS   A HA   1 1 
ATOM   224  H  HB2  . LYS   A 1 20  ? 4.721   21.002  8.229   0   103.1  ? 713  LYS   A HB2  1 1 
ATOM   225  H  HB3  . LYS   A 1 20  ? 3.311   21.482  9.201   0   105.47 ? 713  LYS   A HB3  1 1 
ATOM   226  H  HG2  . LYS   A 1 20  ? 4.59    18.758  9.448   0   106    ? 713  LYS   A HG2  1 1 
ATOM   227  H  HG3  . LYS   A 1 20  ? 5.144   20.172  10.369  0   109.71 ? 713  LYS   A HG3  1 1 
ATOM   228  H  HD2  . LYS   A 1 20  ? 3.138   20.331  11.586  0   114.65 ? 713  LYS   A HD2  1 1 
ATOM   229  H  HD3  . LYS   A 1 20  ? 2.248   19.273  10.464  0   110.95 ? 713  LYS   A HD3  1 1 
ATOM   230  H  HE2  . LYS   A 1 20  ? 4.039   17.499  11.223  0   113.97 ? 713  LYS   A HE2  1 1 
ATOM   231  H  HE3  . LYS   A 1 20  ? 4.208   18.6    12.613  0   117.73 ? 713  LYS   A HE3  1 1 
ATOM   232  H  HZ1  . LYS   A 1 20  ? 2.153   18.099  13.342  0   120.17 ? 713  LYS   A HZ1  1 1 
ATOM   233  H  HZ2  . LYS   A 1 20  ? 1.53    17.72   11.863  0   117.78 ? 713  LYS   A HZ2  1 1 
ATOM   234  H  HZ3  . LYS   A 1 20  ? 2.528   16.657  12.627  0   116.67 ? 713  LYS   A HZ3  1 1 
ATOM   235  N  N    . LYS   A 1 21  ? 1.554   21.96   7.006   1   74     ? 714  LYS   A N    1 1 
ATOM   236  C  CA   . LYS   A 1 21  ? 1.024   23.03   6.154   1   74.21  ? 714  LYS   A CA   1 1 
ATOM   237  C  C    . LYS   A 1 21  ? 0.389   22.471  4.876   1   73.76  ? 714  LYS   A C    1 1 
ATOM   238  O  O    . LYS   A 1 21  ? 0.738   22.887  3.771   1   73.84  ? 714  LYS   A O    1 1 
ATOM   239  C  CB   . LYS   A 1 21  ? 2.103   24.085  5.834   1   76.54  ? 714  LYS   A CB   1 1 
ATOM   240  C  CG   . LYS   A 1 21  ? 2.774   24.666  7.071   1   81.12  ? 714  LYS   A CG   1 1 
ATOM   241  C  CD   . LYS   A 1 21  ? 3.593   25.91   6.748   1   85.99  ? 714  LYS   A CD   1 1 
ATOM   242  C  CE   . LYS   A 1 21  ? 4.545   26.254  7.867   1   90.31  ? 714  LYS   A CE   1 1 
ATOM   243  N  NZ   . LYS   A 1 21  ? 5.34    27.475  7.571   1   93     ? 714  LYS   A NZ   1 1 
ATOM   244  H  H    . LYS   A 1 21  ? 1.137   21.965  7.932   0   103.47 ? 714  LYS   A H    1 1 
ATOM   245  H  HA   . LYS   A 1 21  ? 0.235   23.539  6.706   0   104.53 ? 714  LYS   A HA   1 1 
ATOM   246  H  HB2  . LYS   A 1 21  ? 2.874   23.625  5.218   0   104.27 ? 714  LYS   A HB2  1 1 
ATOM   247  H  HB3  . LYS   A 1 21  ? 1.638   24.909  5.295   0   106.87 ? 714  LYS   A HB3  1 1 
ATOM   248  H  HG2  . LYS   A 1 21  ? 2.01    24.943  7.797   0   115.54 ? 714  LYS   A HG2  1 1 
ATOM   249  H  HG3  . LYS   A 1 21  ? 3.445   23.922  7.497   0   113.03 ? 714  LYS   A HG3  1 1 
ATOM   250  H  HD2  . LYS   A 1 21  ? 4.178   25.731  5.847   0   118.93 ? 714  LYS   A HD2  1 1 
ATOM   251  H  HD3  . LYS   A 1 21  ? 2.922   26.755  6.6     0   122.06 ? 714  LYS   A HD3  1 1 
ATOM   252  H  HE2  . LYS   A 1 21  ? 3.976   26.431  8.779   0   129.86 ? 714  LYS   A HE2  1 1 
ATOM   253  H  HE3  . LYS   A 1 21  ? 5.238   25.426  8.01    0   126.73 ? 714  LYS   A HE3  1 1 
ATOM   254  H  HZ1  . LYS   A 1 21  ? 6.061   27.597  8.275   0   133.86 ? 714  LYS   A HZ1  1 1 
ATOM   255  H  HZ2  . LYS   A 1 21  ? 5.777   27.392  6.659   0   131.19 ? 714  LYS   A HZ2  1 1 
ATOM   256  H  HZ3  . LYS   A 1 21  ? 4.736   28.291  7.576   0   135.29 ? 714  LYS   A HZ3  1 1 
ATOM   257  N  N    . ILE   A 1 22  ? -0.56   21.539  5.035   1   73.1   ? 715  ILE   A N    1 1 
ATOM   258  C  CA   . ILE   A 1 22  ? -1.244  20.915  3.901   1   72.99  ? 715  ILE   A CA   1 1 
ATOM   259  C  C    . ILE   A 1 22  ? -2.348  21.867  3.386   1   72.65  ? 715  ILE   A C    1 1 
ATOM   260  O  O    . ILE   A 1 22  ? -3.283  22.177  4.124   1   72.8   ? 715  ILE   A O    1 1 
ATOM   261  C  CB   . ILE   A 1 22  ? -1.765  19.494  4.283   1   73.49  ? 715  ILE   A CB   1 1 
ATOM   262  C  CG1  . ILE   A 1 22  ? -0.568  18.54   4.567   1   74.38  ? 715  ILE   A CG1  1 1 
ATOM   263  C  CG2  . ILE   A 1 22  ? -2.643  18.912  3.167   1   73.99  ? 715  ILE   A CG2  1 1 
ATOM   264  C  CD1  . ILE   A 1 22  ? -0.89   17.291  5.402   1   75.57  ? 715  ILE   A CD1  1 1 
ATOM   265  H  H    . ILE   A 1 22  ? -0.884  21.215  5.941   0   98.69  ? 715  ILE   A H    1 1 
ATOM   266  H  HA   . ILE   A 1 22  ? -0.525  20.765  3.098   0   93.58  ? 715  ILE   A HA   1 1 
ATOM   267  H  HB   . ILE   A 1 22  ? -2.369  19.573  5.186   0   96.26  ? 715  ILE   A HB   1 1 
ATOM   268  H  HG12 . ILE   A 1 22  ? -0.171  18.195  3.613   0   92.33  ? 715  ILE   A HG12 1 1 
ATOM   269  H  HG13 . ILE   A 1 22  ? 0.212   19.081  5.101   0   95.43  ? 715  ILE   A HG13 1 1 
ATOM   270  H  HG21 . ILE   A 1 22  ? -2.956  17.903  3.432   0   92.55  ? 715  ILE   A HG21 1 1 
ATOM   271  H  HG22 . ILE   A 1 22  ? -3.532  19.523  3.022   0   94.32  ? 715  ILE   A HG22 1 1 
ATOM   272  H  HG23 . ILE   A 1 22  ? -2.051  18.88   2.254   0   91.5   ? 715  ILE   A HG23 1 1 
ATOM   273  H  HD11 . ILE   A 1 22  ? 0.044   16.814  5.696   0   94.13  ? 715  ILE   A HD11 1 1 
ATOM   274  H  HD12 . ILE   A 1 22  ? -1.451  17.589  6.287   0   96.67  ? 715  ILE   A HD12 1 1 
ATOM   275  H  HD13 . ILE   A 1 22  ? -1.48   16.599  4.804   0   93.67  ? 715  ILE   A HD13 1 1 
ATOM   276  N  N    . LYS   A 1 23  ? -2.211  22.352  2.131   1   72.06  ? 716  LYS   A N    1 1 
ATOM   277  C  CA   . LYS   A 1 23  ? -3.159  23.279  1.492   1   71.99  ? 716  LYS   A CA   1 1 
ATOM   278  C  C    . LYS   A 1 23  ? -3.658  22.664  0.178   1   71.75  ? 716  LYS   A C    1 1 
ATOM   279  O  O    . LYS   A 1 23  ? -2.866  22.079  -0.549  1   71.9   ? 716  LYS   A O    1 1 
ATOM   280  C  CB   . LYS   A 1 23  ? -2.49   24.644  1.199   1   73.63  ? 716  LYS   A CB   1 1 
ATOM   281  C  CG   . LYS   A 1 23  ? -1.587  25.207  2.308   1   77.37  ? 716  LYS   A CG   1 1 
ATOM   282  C  CD   . LYS   A 1 23  ? -2.36   25.762  3.517   1   81.8   ? 716  LYS   A CD   1 1 
ATOM   283  C  CE   . LYS   A 1 23  ? -1.571  25.731  4.81    1   85.77  ? 716  LYS   A CE   1 1 
ATOM   284  N  NZ   . LYS   A 1 23  ? -0.607  26.86   4.925   1   88.04  ? 716  LYS   A NZ   1 1 
ATOM   285  H  H    . LYS   A 1 23  ? -1.436  22.114  1.521   0   92.63  ? 716  LYS   A H    1 1 
ATOM   286  H  HA   . LYS   A 1 23  ? -4.021  23.457  2.134   0   97.46  ? 716  LYS   A HA   1 1 
ATOM   287  H  HB2  . LYS   A 1 23  ? -1.882  24.544  0.302   0   97.03  ? 716  LYS   A HB2  1 1 
ATOM   288  H  HB3  . LYS   A 1 23  ? -3.276  25.376  1.022   0   100.3  ? 716  LYS   A HB3  1 1 
ATOM   289  H  HG2  . LYS   A 1 23  ? -0.893  24.442  2.652   0   103.53 ? 716  LYS   A HG2  1 1 
ATOM   290  H  HG3  . LYS   A 1 23  ? -1.018  26.035  1.888   0   105.74 ? 716  LYS   A HG3  1 1 
ATOM   291  H  HD2  . LYS   A 1 23  ? -2.61   26.803  3.314   0   114.31 ? 716  LYS   A HD2  1 1 
ATOM   292  H  HD3  . LYS   A 1 23  ? -3.275  25.196  3.679   0   111.65 ? 716  LYS   A HD3  1 1 
ATOM   293  H  HE2  . LYS   A 1 23  ? -2.267  25.803  5.644   0   120.36 ? 716  LYS   A HE2  1 1 
ATOM   294  H  HE3  . LYS   A 1 23  ? -1.012  24.799  4.879   0   116.31 ? 716  LYS   A HE3  1 1 
ATOM   295  H  HZ1  . LYS   A 1 23  ? -0.123  26.807  5.816   0   122.01 ? 716  LYS   A HZ1  1 1 
ATOM   296  H  HZ2  . LYS   A 1 23  ? 0.082   26.824  4.18    0   120.19 ? 716  LYS   A HZ2  1 1 
ATOM   297  H  HZ3  . LYS   A 1 23  ? -1.103  27.745  4.875   0   124.48 ? 716  LYS   A HZ3  1 1 
ATOM   298  N  N    . VAL   A 1 24  ? -4.947  22.84   -0.155  1   71.19  ? 717  VAL   A N    1 1 
ATOM   299  C  CA   . VAL   A 1 24  ? -5.531  22.255  -1.37   1   71.14  ? 717  VAL   A CA   1 1 
ATOM   300  C  C    . VAL   A 1 24  ? -5.091  23.028  -2.622  1   70.89  ? 717  VAL   A C    1 1 
ATOM   301  O  O    . VAL   A 1 24  ? -5.29   24.24   -2.684  1   71.13  ? 717  VAL   A O    1 1 
ATOM   302  C  CB   . VAL   A 1 24  ? -7.084  22.192  -1.282  1   71.85  ? 717  VAL   A CB   1 1 
ATOM   303  C  CG1  . VAL   A 1 24  ? -7.692  21.655  -2.581  1   72.44  ? 717  VAL   A CG1  1 1 
ATOM   304  C  CG2  . VAL   A 1 24  ? -7.543  21.356  -0.088  1   72.32  ? 717  VAL   A CG2  1 1 
ATOM   305  H  H    . VAL   A 1 24  ? -5.587  23.423  0.375   0   95.72  ? 717  VAL   A H    1 1 
ATOM   306  H  HA   . VAL   A 1 24  ? -5.181  21.228  -1.464  0   89.6   ? 717  VAL   A HA   1 1 
ATOM   307  H  HB   . VAL   A 1 24  ? -7.462  23.203  -1.138  0   96.17  ? 717  VAL   A HB   1 1 
ATOM   308  H  HG11 . VAL   A 1 24  ? -8.722  21.348  -2.403  0   94.32  ? 717  VAL   A HG11 1 1 
ATOM   309  H  HG12 . VAL   A 1 24  ? -7.687  22.439  -3.335  0   92.51  ? 717  VAL   A HG12 1 1 
ATOM   310  H  HG13 . VAL   A 1 24  ? -7.105  20.804  -2.924  0   90.73  ? 717  VAL   A HG13 1 1 
ATOM   311  H  HG21 . VAL   A 1 24  ? -8.629  21.278  -0.1    0   96.58  ? 717  VAL   A HG21 1 1 
ATOM   312  H  HG22 . VAL   A 1 24  ? -7.098  20.364  -0.156  0   93.11  ? 717  VAL   A HG22 1 1 
ATOM   313  H  HG23 . VAL   A 1 24  ? -7.228  21.842  0.834   0   96.57  ? 717  VAL   A HG23 1 1 
ATOM   314  N  N    . LEU   A 1 25  ? -4.524  22.327  -3.626  1   70.27  ? 718  LEU   A N    1 1 
ATOM   315  C  CA   . LEU   A 1 25  ? -4.119  22.94   -4.895  1   70.24  ? 718  LEU   A CA   1 1 
ATOM   316  C  C    . LEU   A 1 25  ? -5.278  22.868  -5.904  1   70.02  ? 718  LEU   A C    1 1 
ATOM   317  O  O    . LEU   A 1 25  ? -5.59   23.87   -6.544  1   70.33  ? 718  LEU   A O    1 1 
ATOM   318  C  CB   . LEU   A 1 25  ? -2.87   22.255  -5.491  1   70.54  ? 718  LEU   A CB   1 1 
ATOM   319  C  CG   . LEU   A 1 25  ? -1.5    22.619  -4.888  1   72.27  ? 718  LEU   A CG   1 1 
ATOM   320  C  CD1  . LEU   A 1 25  ? -0.465  21.537  -5.211  1   72.95  ? 718  LEU   A CD1  1 1 
ATOM   321  C  CD2  . LEU   A 1 25  ? -1.008  23.984  -5.391  1   73.04  ? 718  LEU   A CD2  1 1 
ATOM   322  H  H    . LEU   A 1 25  ? -4.343  21.33   -3.582  0   85.55  ? 718  LEU   A H    1 1 
ATOM   323  H  HA   . LEU   A 1 25  ? -3.889  23.993  -4.739  0   87.89  ? 718  LEU   A HA   1 1 
ATOM   324  H  HB2  . LEU   A 1 25  ? -3.005  21.177  -5.403  0   82.6   ? 718  LEU   A HB2  1 1 
ATOM   325  H  HB3  . LEU   A 1 25  ? -2.828  22.514  -6.547  0   83.07  ? 718  LEU   A HB3  1 1 
ATOM   326  H  HG   . LEU   A 1 25  ? -1.597  22.678  -3.805  0   87.39  ? 718  LEU   A HG   1 1 
ATOM   327  H  HD11 . LEU   A 1 25  ? 0.546   21.927  -5.1    0   84.91  ? 718  LEU   A HD11 1 1 
ATOM   328  H  HD12 . LEU   A 1 25  ? -0.61   20.702  -4.527  0   83.67  ? 718  LEU   A HD12 1 1 
ATOM   329  H  HD13 . LEU   A 1 25  ? -0.616  21.203  -6.236  0   83.08  ? 718  LEU   A HD13 1 1 
ATOM   330  H  HD21 . LEU   A 1 25  ? -0.016  24.179  -4.986  0   88.65  ? 718  LEU   A HD21 1 1 
ATOM   331  H  HD22 . LEU   A 1 25  ? -0.965  23.97   -6.479  0   86.89  ? 718  LEU   A HD22 1 1 
ATOM   332  H  HD23 . LEU   A 1 25  ? -1.693  24.763  -5.058  0   90.12  ? 718  LEU   A HD23 1 1 
ATOM   333  N  N    . GLY   A 1 26  ? -5.897  21.695  -6.043  1   69.38  ? 719  GLY   A N    1 1 
ATOM   334  C  CA   . GLY   A 1 26  ? -7.013  21.51   -6.962  1   69.24  ? 719  GLY   A CA   1 1 
ATOM   335  C  C    . GLY   A 1 26  ? -7.715  20.175  -6.81   1   68.82  ? 719  GLY   A C    1 1 
ATOM   336  O  O    . GLY   A 1 26  ? -7.319  19.35   -5.985  1   68.89  ? 719  GLY   A O    1 1 
ATOM   337  H  H    . GLY   A 1 26  ? -5.643  20.847  -5.546  0   83.06  ? 719  GLY   A H    1 1 
ATOM   338  H  HA2  . GLY   A 1 26  ? -7.748  22.296  -6.798  0   85.92  ? 719  GLY   A HA2  1 1 
ATOM   339  H  HA3  . GLY   A 1 26  ? -6.652  21.59   -7.986  0   82.48  ? 719  GLY   A HA3  1 1 
ATOM   340  N  N    . SER   A 1 27  ? -8.771  19.955  -7.608  1   68.25  ? 720  SER   A N    1 1 
ATOM   341  C  CA   . SER   A 1 27  ? -9.552  18.716  -7.583  1   68.22  ? 720  SER   A CA   1 1 
ATOM   342  C  C    . SER   A 1 27  ? -10.194 18.433  -8.95   1   67.96  ? 720  SER   A C    1 1 
ATOM   343  O  O    . SER   A 1 27  ? -10.43  19.353  -9.731  1   68.12  ? 720  SER   A O    1 1 
ATOM   344  C  CB   . SER   A 1 27  ? -10.641 18.794  -6.514  1   69.51  ? 720  SER   A CB   1 1 
ATOM   345  O  OG   . SER   A 1 27  ? -10.137 18.602  -5.202  1   71.74  ? 720  SER   A OG   1 1 
ATOM   346  H  H    . SER   A 1 27  ? -9.11   20.627  -8.288  0   83.14  ? 720  SER   A H    1 1 
ATOM   347  H  HA   . SER   A 1 27  ? -8.896  17.875  -7.36   0   80.75  ? 720  SER   A HA   1 1 
ATOM   348  H  HB2  . SER   A 1 27  ? -11.101 19.78   -6.563  0   88.13  ? 720  SER   A HB2  1 1 
ATOM   349  H  HB3  . SER   A 1 27  ? -11.388 18.029  -6.718  0   86.63  ? 720  SER   A HB3  1 1 
ATOM   350  H  HG   . SER   A 1 27  ? -9.463  19.298  -4.986  0   87.59  ? 720  SER   A HG   1 1 
ATOM   351  N  N    . GLY   A 1 28  ? -10.476 17.163  -9.22   1   67.41  ? 721  GLY   A N    1 1 
ATOM   352  C  CA   . GLY   A 1 28  ? -11.087 16.748  -10.477 1   67.4   ? 721  GLY   A CA   1 1 
ATOM   353  C  C    . GLY   A 1 28  ? -11.146 15.24   -10.615 1   67.08  ? 721  GLY   A C    1 1 
ATOM   354  O  O    . GLY   A 1 28  ? -11.339 14.539  -9.62   1   67.11  ? 721  GLY   A O    1 1 
ATOM   355  H  H    . GLY   A 1 28  ? -10.296 16.393  -8.583  0   79.67  ? 721  GLY   A H    1 1 
ATOM   356  H  HA2  . GLY   A 1 28  ? -12.101 17.141  -10.535 0   81.56  ? 721  GLY   A HA2  1 1 
ATOM   357  H  HA3  . GLY   A 1 28  ? -10.511 17.152  -11.308 0   78.37  ? 721  GLY   A HA3  1 1 
ATOM   358  N  N    . ALA   A 1 29  ? -10.978 14.722  -11.844 1   66.62  ? 722  ALA   A N    1 1 
ATOM   359  C  CA   . ALA   A 1 29  ? -10.983 13.276  -12.085 1   66.62  ? 722  ALA   A CA   1 1 
ATOM   360  C  C    . ALA   A 1 29  ? -9.789  12.597  -11.399 1   66.3   ? 722  ALA   A C    1 1 
ATOM   361  O  O    . ALA   A 1 29  ? -9.913  11.463  -10.938 1   66.38  ? 722  ALA   A O    1 1 
ATOM   362  C  CB   . ALA   A 1 29  ? -10.953 12.993  -13.576 1   66.87  ? 722  ALA   A CB   1 1 
ATOM   363  H  H    . ALA   A 1 29  ? -10.839 15.275  -12.684 0   75.96  ? 722  ALA   A H    1 1 
ATOM   364  H  HA   . ALA   A 1 29  ? -11.898 12.85   -11.677 0   77.43  ? 722  ALA   A HA   1 1 
ATOM   365  H  HB1  . ALA   A 1 29  ? -10.957 11.914  -13.728 0   74.75  ? 722  ALA   A HB1  1 1 
ATOM   366  H  HB2  . ALA   A 1 29  ? -11.833 13.437  -14.039 0   76.32  ? 722  ALA   A HB2  1 1 
ATOM   367  H  HB3  . ALA   A 1 29  ? -10.048 13.424  -14.002 0   73.49  ? 722  ALA   A HB3  1 1 
ATOM   368  N  N    . PHE   A 1 30  ? -8.637  13.288  -11.338 1   65.69  ? 723  PHE   A N    1 1 
ATOM   369  C  CA   . PHE   A 1 30  ? -7.44   12.804  -10.644 1   65.63  ? 723  PHE   A CA   1 1 
ATOM   370  C  C    . PHE   A 1 30  ? -7.638  12.616  -9.124  1   65.25  ? 723  PHE   A C    1 1 
ATOM   371  O  O    . PHE   A 1 30  ? -6.858  11.897  -8.501  1   65.31  ? 723  PHE   A O    1 1 
ATOM   372  C  CB   . PHE   A 1 30  ? -6.245  13.751  -10.893 1   65.52  ? 723  PHE   A CB   1 1 
ATOM   373  C  CG   . PHE   A 1 30  ? -6.473  15.216  -10.579 1   65.96  ? 723  PHE   A CG   1 1 
ATOM   374  C  CD1  . PHE   A 1 30  ? -6.253  15.712  -9.307  1   66.52  ? 723  PHE   A CD1  1 1 
ATOM   375  C  CD2  . PHE   A 1 30  ? -6.857  16.102  -11.569 1   66.57  ? 723  PHE   A CD2  1 1 
ATOM   376  C  CE1  . PHE   A 1 30  ? -6.464  17.055  -9.022  1   67.08  ? 723  PHE   A CE1  1 1 
ATOM   377  C  CE2  . PHE   A 1 30  ? -7.043  17.448  -11.285 1   67.13  ? 723  PHE   A CE2  1 1 
ATOM   378  C  CZ   . PHE   A 1 30  ? -6.841  17.916  -10.016 1   66.84  ? 723  PHE   A CZ   1 1 
ATOM   379  H  H    . PHE   A 1 30  ? -8.496  14.17   -11.819 0   71.82  ? 723  PHE   A H    1 1 
ATOM   380  H  HA   . PHE   A 1 30  ? -7.175  11.832  -11.059 0   69.97  ? 723  PHE   A HA   1 1 
ATOM   381  H  HB2  . PHE   A 1 30  ? -5.41   13.415  -10.279 0   68.83  ? 723  PHE   A HB2  1 1 
ATOM   382  H  HB3  . PHE   A 1 30  ? -5.97   13.683  -11.944 0   68.35  ? 723  PHE   A HB3  1 1 
ATOM   383  H  HD1  . PHE   A 1 30  ? -5.957  15.041  -8.518  0   72.4   ? 723  PHE   A HD1  1 1 
ATOM   384  H  HD2  . PHE   A 1 30  ? -7.014  15.744  -12.572 0   71     ? 723  PHE   A HD2  1 1 
ATOM   385  H  HE1  . PHE   A 1 30  ? -6.303  17.424  -8.024  0   75.49  ? 723  PHE   A HE1  1 1 
ATOM   386  H  HE2  . PHE   A 1 30  ? -7.351  18.124  -12.065 0   73.94  ? 723  PHE   A HE2  1 1 
ATOM   387  H  HZ   . PHE   A 1 30  ? -6.995  18.959  -9.796  0   75.81  ? 723  PHE   A HZ   1 1 
ATOM   388  N  N    . GLY   A 1 31  ? -8.643  13.279  -8.549  1   64.79  ? 724  GLY   A N    1 1 
ATOM   389  C  CA   . GLY   A 1 31  ? -8.948  13.222  -7.127  1   64.83  ? 724  GLY   A CA   1 1 
ATOM   390  C  C    . GLY   A 1 31  ? -8.723  14.575  -6.488  1   64.64  ? 724  GLY   A C    1 1 
ATOM   391  O  O    . GLY   A 1 31  ? -9.348  15.549  -6.901  1   64.88  ? 724  GLY   A O    1 1 
ATOM   392  H  H    . GLY   A 1 31  ? -9.278  13.898  -9.042  0   73.72  ? 724  GLY   A H    1 1 
ATOM   393  H  HA2  . GLY   A 1 31  ? -9.996  12.958  -6.997  0   76.09  ? 724  GLY   A HA2  1 1 
ATOM   394  H  HA3  . GLY   A 1 31  ? -8.345  12.473  -6.617  0   73.9   ? 724  GLY   A HA3  1 1 
ATOM   395  N  N    . THR   A 1 32  ? -7.826  14.656  -5.492  1   64.17  ? 725  THR   A N    1 1 
ATOM   396  C  CA   . THR   A 1 32  ? -7.515  15.911  -4.806  1   64.29  ? 725  THR   A CA   1 1 
ATOM   397  C  C    . THR   A 1 32  ? -6.006  16.008  -4.587  1   64.25  ? 725  THR   A C    1 1 
ATOM   398  O  O    . THR   A 1 32  ? -5.431  15.133  -3.946  1   64.19  ? 725  THR   A O    1 1 
ATOM   399  C  CB   . THR   A 1 32  ? -8.267  15.986  -3.466  1   65.46  ? 725  THR   A CB   1 1 
ATOM   400  O  OG1  . THR   A 1 32  ? -9.659  15.76   -3.696  1   66.4   ? 725  THR   A OG1  1 1 
ATOM   401  C  CG2  . THR   A 1 32  ? -8.076  17.326  -2.762  1   65.79  ? 725  THR   A CG2  1 1 
ATOM   402  H  H    . THR   A 1 32  ? -7.297  13.867  -5.135  0   73.82  ? 725  THR   A H    1 1 
ATOM   403  H  HA   . THR   A 1 32  ? -7.824  16.764  -5.409  0   76.18  ? 725  THR   A HA   1 1 
ATOM   404  H  HB   . THR   A 1 32  ? -7.89   15.205  -2.807  0   78.87  ? 725  THR   A HB   1 1 
ATOM   405  H  HG1  . THR   A 1 32  ? -10.153 15.742  -2.834  0   83.54  ? 725  THR   A HG1  1 1 
ATOM   406  H  HG21 . THR   A 1 32  ? -8.74   17.391  -1.901  0   83.06  ? 725  THR   A HG21 1 1 
ATOM   407  H  HG22 . THR   A 1 32  ? -7.051  17.434  -2.41   0   80.33  ? 725  THR   A HG22 1 1 
ATOM   408  H  HG23 . THR   A 1 32  ? -8.304  18.143  -3.446  0   81.84  ? 725  THR   A HG23 1 1 
ATOM   409  N  N    . VAL   A 1 33  ? -5.37   17.07   -5.11   1   64.13  ? 726  VAL   A N    1 1 
ATOM   410  C  CA   . VAL   A 1 33  ? -3.931  17.29   -4.962  1   64.53  ? 726  VAL   A CA   1 1 
ATOM   411  C  C    . VAL   A 1 33  ? -3.706  18.441  -3.977  1   64.93  ? 726  VAL   A C    1 1 
ATOM   412  O  O    . VAL   A 1 33  ? -4.317  19.493  -4.122  1   65.02  ? 726  VAL   A O    1 1 
ATOM   413  C  CB   . VAL   A 1 33  ? -3.261  17.563  -6.335  1   65.14  ? 726  VAL   A CB   1 1 
ATOM   414  C  CG1  . VAL   A 1 33  ? -1.804  17.995  -6.168  1   65.64  ? 726  VAL   A CG1  1 1 
ATOM   415  C  CG2  . VAL   A 1 33  ? -3.359  16.336  -7.24   1   65.59  ? 726  VAL   A CG2  1 1 
ATOM   416  H  H    . VAL   A 1 33  ? -5.825  17.799  -5.65   0   74.59  ? 726  VAL   A H    1 1 
ATOM   417  H  HA   . VAL   A 1 33  ? -3.457  16.4    -4.552  0   72.7   ? 726  VAL   A HA   1 1 
ATOM   418  H  HB   . VAL   A 1 33  ? -3.791  18.378  -6.826  0   73.2   ? 726  VAL   A HB   1 1 
ATOM   419  H  HG11 . VAL   A 1 33  ? -1.281  17.893  -7.118  0   71.69  ? 726  VAL   A HG11 1 1 
ATOM   420  H  HG12 . VAL   A 1 33  ? -1.769  19.038  -5.858  0   74.1   ? 726  VAL   A HG12 1 1 
ATOM   421  H  HG13 . VAL   A 1 33  ? -1.333  17.365  -5.414  0   72.12  ? 726  VAL   A HG13 1 1 
ATOM   422  H  HG21 . VAL   A 1 33  ? -2.839  16.535  -8.175  0   70.21  ? 726  VAL   A HG21 1 1 
ATOM   423  H  HG22 . VAL   A 1 33  ? -2.903  15.486  -6.735  0   70.67  ? 726  VAL   A HG22 1 1 
ATOM   424  H  HG23 . VAL   A 1 33  ? -4.407  16.126  -7.447  0   71.67  ? 726  VAL   A HG23 1 1 
ATOM   425  N  N    . TYR   A 1 34  ? -2.854  18.222  -2.962  1   65.05  ? 727  TYR   A N    1 1 
ATOM   426  C  CA   . TYR   A 1 34  ? -2.49   19.208  -1.945  1   65.71  ? 727  TYR   A CA   1 1 
ATOM   427  C  C    . TYR   A 1 34  ? -0.974  19.526  -2.033  1   66.34  ? 727  TYR   A C    1 1 
ATOM   428  O  O    . TYR   A 1 34  ? -0.237  18.832  -2.729  1   66.45  ? 727  TYR   A O    1 1 
ATOM   429  C  CB   . TYR   A 1 34  ? -2.772  18.67   -0.52   1   65.71  ? 727  TYR   A CB   1 1 
ATOM   430  C  CG   . TYR   A 1 34  ? -4.114  18.018  -0.267  1   66.43  ? 727  TYR   A CG   1 1 
ATOM   431  C  CD1  . TYR   A 1 34  ? -5.108  18.687  0.433   1   67.42  ? 727  TYR   A CD1  1 1 
ATOM   432  C  CD2  . TYR   A 1 34  ? -4.311  16.67   -0.529  1   67.19  ? 727  TYR   A CD2  1 1 
ATOM   433  C  CE1  . TYR   A 1 34  ? -6.307  18.066  0.759   1   68.29  ? 727  TYR   A CE1  1 1 
ATOM   434  C  CE2  . TYR   A 1 34  ? -5.512  16.042  -0.226  1   68.08  ? 727  TYR   A CE2  1 1 
ATOM   435  C  CZ   . TYR   A 1 34  ? -6.505  16.74   0.434   1   69.03  ? 727  TYR   A CZ   1 1 
ATOM   436  O  OH   . TYR   A 1 34  ? -7.708  16.148  0.742   1   70.36  ? 727  TYR   A OH   1 1 
ATOM   437  H  H    . TYR   A 1 34  ? -2.386  17.334  -2.811  0   75.06  ? 727  TYR   A H    1 1 
ATOM   438  H  HA   . TYR   A 1 34  ? -3.046  20.134  -2.078  0   80.11  ? 727  TYR   A HA   1 1 
ATOM   439  H  HB2  . TYR   A 1 34  ? -1.995  17.957  -0.254  0   79     ? 727  TYR   A HB2  1 1 
ATOM   440  H  HB3  . TYR   A 1 34  ? -2.71   19.528  0.148   0   81.77  ? 727  TYR   A HB3  1 1 
ATOM   441  H  HD1  . TYR   A 1 34  ? -4.968  19.721  0.698   0   86.25  ? 727  TYR   A HD1  1 1 
ATOM   442  H  HD2  . TYR   A 1 34  ? -3.54   16.115  -1.036  0   78.9   ? 727  TYR   A HD2  1 1 
ATOM   443  H  HE1  . TYR   A 1 34  ? -7.085  18.621  1.255   0   88.72  ? 727  TYR   A HE1  1 1 
ATOM   444  H  HE2  . TYR   A 1 34  ? -5.653  15.007  -0.49   0   81.34  ? 727  TYR   A HE2  1 1 
ATOM   445  H  HH   . TYR   A 1 34  ? -7.717  15.196  0.461   0   87.17  ? 727  TYR   A HH   1 1 
ATOM   446  N  N    . LYS   A 1 35  ? -0.513  20.559  -1.294  1   66.63  ? 728  LYS   A N    1 1 
ATOM   447  C  CA   . LYS   A 1 35  ? 0.904   20.932  -1.176  1   67.29  ? 728  LYS   A CA   1 1 
ATOM   448  C  C    . LYS   A 1 35  ? 1.293   20.919  0.311   1   68.03  ? 728  LYS   A C    1 1 
ATOM   449  O  O    . LYS   A 1 35  ? 0.444   21.133  1.174   1   68.06  ? 728  LYS   A O    1 1 
ATOM   450  C  CB   . LYS   A 1 35  ? 1.203   22.307  -1.816  1   68.88  ? 728  LYS   A CB   1 1 
ATOM   451  C  CG   . LYS   A 1 35  ? 0.503   23.51   -1.185  1   72.63  ? 728  LYS   A CG   1 1 
ATOM   452  C  CD   . LYS   A 1 35  ? 0.97    24.813  -1.806  1   76.72  ? 728  LYS   A CD   1 1 
ATOM   453  C  CE   . LYS   A 1 35  ? 0.109   25.969  -1.366  1   80.34  ? 728  LYS   A CE   1 1 
ATOM   454  N  NZ   . LYS   A 1 35  ? 0.561   27.257  -1.958  1   82.6   ? 728  LYS   A NZ   1 1 
ATOM   455  H  H    . LYS   A 1 35  ? -1.126  21.153  -0.744  0   82.83  ? 728  LYS   A H    1 1 
ATOM   456  H  HA   . LYS   A 1 35  ? 1.529   20.196  -1.679  0   80.1   ? 728  LYS   A HA   1 1 
ATOM   457  H  HB2  . LYS   A 1 35  ? 2.275   22.488  -1.756  0   84.88  ? 728  LYS   A HB2  1 1 
ATOM   458  H  HB3  . LYS   A 1 35  ? 0.899   22.273  -2.86   0   83.32  ? 728  LYS   A HB3  1 1 
ATOM   459  H  HG2  . LYS   A 1 35  ? -0.571  23.425  -1.346  0   91.04  ? 728  LYS   A HG2  1 1 
ATOM   460  H  HG3  . LYS   A 1 35  ? 0.721   23.562  -0.12   0   92.45  ? 728  LYS   A HG3  1 1 
ATOM   461  H  HD2  . LYS   A 1 35  ? 1.994   25.011  -1.495  0   97.25  ? 728  LYS   A HD2  1 1 
ATOM   462  H  HD3  . LYS   A 1 35  ? 0.915   24.736  -2.891  0   95.32  ? 728  LYS   A HD3  1 1 
ATOM   463  H  HE2  . LYS   A 1 35  ? -0.916  25.79   -1.684  0   103.1  ? 728  LYS   A HE2  1 1 
ATOM   464  H  HE3  . LYS   A 1 35  ? 0.157   26.056  -0.281  0   104.98 ? 728  LYS   A HE3  1 1 
ATOM   465  H  HZ1  . LYS   A 1 35  ? -0.105  27.992  -1.74   0   108.7  ? 728  LYS   A HZ1  1 1 
ATOM   466  H  HZ2  . LYS   A 1 35  ? 1.466   27.512  -1.577  0   108.72 ? 728  LYS   A HZ2  1 1 
ATOM   467  H  HZ3  . LYS   A 1 35  ? 0.638   27.167  -2.966  0   105.44 ? 728  LYS   A HZ3  1 1 
ATOM   468  N  N    . GLY   A 1 36  ? 2.561   20.656  0.602   1   68.35  ? 729  GLY   A N    1 1 
ATOM   469  C  CA   . GLY   A 1 36  ? 3.036   20.61   1.98    1   69.26  ? 729  GLY   A CA   1 1 
ATOM   470  C  C    . GLY   A 1 36  ? 4.541   20.667  2.109   1   70.04  ? 729  GLY   A C    1 1 
ATOM   471  O  O    . GLY   A 1 36  ? 5.246   20.907  1.126   1   70.02  ? 729  GLY   A O    1 1 
ATOM   472  H  H    . GLY   A 1 36  ? 3.281   20.467  -0.088  0   83.73  ? 729  GLY   A H    1 1 
ATOM   473  H  HA2  . GLY   A 1 36  ? 2.629   21.453  2.537   0   89.3   ? 729  GLY   A HA2  1 1 
ATOM   474  H  HA3  . GLY   A 1 36  ? 2.688   19.691  2.45    0   86.73  ? 729  GLY   A HA3  1 1 
ATOM   475  N  N    . LEU   A 1 37  ? 5.035   20.464  3.337   1   70.58  ? 730  LEU   A N    1 1 
ATOM   476  C  CA   . LEU   A 1 37  ? 6.46    20.484  3.652   1   71.67  ? 730  LEU   A CA   1 1 
ATOM   477  C  C    . LEU   A 1 37  ? 6.816   19.182  4.347   1   72.72  ? 730  LEU   A C    1 1 
ATOM   478  O  O    . LEU   A 1 37  ? 6.4     18.966  5.482   1   72.95  ? 730  LEU   A O    1 1 
ATOM   479  C  CB   . LEU   A 1 37  ? 6.787   21.669  4.581   1   71.9   ? 730  LEU   A CB   1 1 
ATOM   480  C  CG   . LEU   A 1 37  ? 6.579   23.079  4.002   1   73.39  ? 730  LEU   A CG   1 1 
ATOM   481  C  CD1  . LEU   A 1 37  ? 6.473   24.115  5.113   1   73.92  ? 730  LEU   A CD1  1 1 
ATOM   482  C  CD2  . LEU   A 1 37  ? 7.703   23.468  3.045   1   74.07  ? 730  LEU   A CD2  1 1 
ATOM   483  H  H    . LEU   A 1 37  ? 4.454   20.278  4.148   0   91.3   ? 730  LEU   A H    1 1 
ATOM   484  H  HA   . LEU   A 1 37  ? 7.062   20.566  2.749   0   91.92  ? 730  LEU   A HA   1 1 
ATOM   485  H  HB2  . LEU   A 1 37  ? 6.156   21.58   5.464   0   97.08  ? 730  LEU   A HB2  1 1 
ATOM   486  H  HB3  . LEU   A 1 37  ? 7.831   21.589  4.88    0   97.09  ? 730  LEU   A HB3  1 1 
ATOM   487  H  HG   . LEU   A 1 37  ? 5.646   23.104  3.441   0   97.84  ? 730  LEU   A HG   1 1 
ATOM   488  H  HD11 . LEU   A 1 37  ? 6.328   25.099  4.669   0   104.23 ? 730  LEU   A HD11 1 1 
ATOM   489  H  HD12 . LEU   A 1 37  ? 5.623   23.87   5.748   0   103.27 ? 730  LEU   A HD12 1 1 
ATOM   490  H  HD13 . LEU   A 1 37  ? 7.391   24.103  5.697   0   104.41 ? 730  LEU   A HD13 1 1 
ATOM   491  H  HD21 . LEU   A 1 37  ? 7.565   24.504  2.74    0   100.77 ? 730  LEU   A HD21 1 1 
ATOM   492  H  HD22 . LEU   A 1 37  ? 8.659   23.363  3.554   0   100.98 ? 730  LEU   A HD22 1 1 
ATOM   493  H  HD23 . LEU   A 1 37  ? 7.675   22.824  2.168   0   97.29  ? 730  LEU   A HD23 1 1 
ATOM   494  N  N    . TRP   A 1 38  ? 7.558   18.303  3.665   1   73.3   ? 731  TRP   A N    1 1 
ATOM   495  C  CA   . TRP   A 1 38  ? 7.964   17.022  4.234   1   74.37  ? 731  TRP   A CA   1 1 
ATOM   496  C  C    . TRP   A 1 38  ? 9.286   17.161  4.989   1   75.68  ? 731  TRP   A C    1 1 
ATOM   497  O  O    . TRP   A 1 38  ? 10.312  17.448  4.375   1   75.78  ? 731  TRP   A O    1 1 
ATOM   498  C  CB   . TRP   A 1 38  ? 8.089   15.956  3.132   1   74.16  ? 731  TRP   A CB   1 1 
ATOM   499  C  CG   . TRP   A 1 38  ? 8.641   14.645  3.612   1   74.42  ? 731  TRP   A CG   1 1 
ATOM   500  C  CD1  . TRP   A 1 38  ? 8.187   13.898  4.658   1   75.27  ? 731  TRP   A CD1  1 1 
ATOM   501  C  CD2  . TRP   A 1 38  ? 9.751   13.929  3.058   1   74.43  ? 731  TRP   A CD2  1 1 
ATOM   502  N  NE1  . TRP   A 1 38  ? 8.952   12.766  4.796   1   75.56  ? 731  TRP   A NE1  1 1 
ATOM   503  C  CE2  . TRP   A 1 38  ? 9.918   12.758  3.824   1   75.25  ? 731  TRP   A CE2  1 1 
ATOM   504  C  CE3  . TRP   A 1 38  ? 10.621  14.162  1.987   1   74.86  ? 731  TRP   A CE3  1 1 
ATOM   505  C  CZ2  . TRP   A 1 38  ? 10.924  11.832  3.558   1   75.81  ? 731  TRP   A CZ2  1 1 
ATOM   506  C  CZ3  . TRP   A 1 38  ? 11.613  13.24   1.724   1   75.69  ? 731  TRP   A CZ3  1 1 
ATOM   507  C  CH2  . TRP   A 1 38  ? 11.754  12.089  2.5     1   75.86  ? 731  TRP   A CH2  1 1 
ATOM   508  H  H    . TRP   A 1 38  ? 7.885   18.448  2.715   0   91.39  ? 731  TRP   A H    1 1 
ATOM   509  H  HA   . TRP   A 1 38  ? 7.203   16.666  4.927   0   93     ? 731  TRP   A HA   1 1 
ATOM   510  H  HB2  . TRP   A 1 38  ? 7.096   15.76   2.732   0   88.98  ? 731  TRP   A HB2  1 1 
ATOM   511  H  HB3  . TRP   A 1 38  ? 8.738   16.333  2.343   0   90.12  ? 731  TRP   A HB3  1 1 
ATOM   512  H  HD1  . TRP   A 1 38  ? 7.354   14.16   5.288   0   92.26  ? 731  TRP   A HD1  1 1 
ATOM   513  H  HE1  . TRP   A 1 38  ? 8.817   12.03   5.52    0   92.52  ? 731  TRP   A HE1  1 1 
ATOM   514  H  HE3  . TRP   A 1 38  ? 10.524  15.05   1.385   0   90.09  ? 731  TRP   A HE3  1 1 
ATOM   515  H  HZ2  . TRP   A 1 38  ? 11.033  10.941  4.153   0   92.65  ? 731  TRP   A HZ2  1 1 
ATOM   516  H  HZ3  . TRP   A 1 38  ? 12.292  13.413  0.906   0   91.28  ? 731  TRP   A HZ3  1 1 
ATOM   517  H  HH2  . TRP   A 1 38  ? 12.542  11.393  2.268   0   92.35  ? 731  TRP   A HH2  1 1 
ATOM   518  N  N    . ILE   A 1 39  ? 9.26    16.935  6.311   1   76.5   ? 732  ILE   A N    1 1 
ATOM   519  C  CA   . ILE   A 1 39  ? 10.454  16.972  7.15    1   77.83  ? 732  ILE   A CA   1 1 
ATOM   520  C  C    . ILE   A 1 39  ? 10.829  15.497  7.389   1   78.95  ? 732  ILE   A C    1 1 
ATOM   521  O  O    . ILE   A 1 39  ? 10.105  14.837  8.137   1   79.17  ? 732  ILE   A O    1 1 
ATOM   522  C  CB   . ILE   A 1 39  ? 10.186  17.728  8.489   1   78.49  ? 732  ILE   A CB   1 1 
ATOM   523  C  CG1  . ILE   A 1 39  ? 9.647   19.185  8.233   1   79.63  ? 732  ILE   A CG1  1 1 
ATOM   524  C  CG2  . ILE   A 1 39  ? 11.458  17.752  9.353   1   78.94  ? 732  ILE   A CG2  1 1 
ATOM   525  C  CD1  . ILE   A 1 39  ? 8.115   19.382  8.445   1   81.03  ? 732  ILE   A CD1  1 1 
ATOM   526  H  H    . ILE   A 1 39  ? 8.419   16.716  6.835   0   98.56  ? 732  ILE   A H    1 1 
ATOM   527  H  HA   . ILE   A 1 39  ? 11.262  17.505  6.653   0   103.02 ? 732  ILE   A HA   1 1 
ATOM   528  H  HB   . ILE   A 1 39  ? 9.438   17.164  9.046   0   105.06 ? 732  ILE   A HB   1 1 
ATOM   529  H  HG12 . ILE   A 1 39  ? 10.135  19.889  8.905   0   110.2  ? 732  ILE   A HG12 1 1 
ATOM   530  H  HG13 . ILE   A 1 39  ? 9.868   19.479  7.208   0   106.88 ? 732  ILE   A HG13 1 1 
ATOM   531  H  HG21 . ILE   A 1 39  ? 11.293  18.403  10.21   0   110.5  ? 732  ILE   A HG21 1 1 
ATOM   532  H  HG22 . ILE   A 1 39  ? 11.679  16.747  9.709   0   108.03 ? 732  ILE   A HG22 1 1 
ATOM   533  H  HG23 . ILE   A 1 39  ? 12.287  18.127  8.755   0   109.27 ? 732  ILE   A HG23 1 1 
ATOM   534  H  HD11 . ILE   A 1 39  ? 7.859   20.424  8.261   0   109.55 ? 732  ILE   A HD11 1 1 
ATOM   535  H  HD12 . ILE   A 1 39  ? 7.576   18.738  7.751   0   106.21 ? 732  ILE   A HD12 1 1 
ATOM   536  H  HD13 . ILE   A 1 39  ? 7.864   19.113  9.471   0   109.51 ? 732  ILE   A HD13 1 1 
ATOM   537  N  N    . PRO   A 1 40  ? 11.886  14.922  6.756   1   79.52  ? 733  PRO   A N    1 1 
ATOM   538  C  CA   . PRO   A 1 40  ? 12.191  13.5    7.018   1   80.05  ? 733  PRO   A CA   1 1 
ATOM   539  C  C    . PRO   A 1 40  ? 12.579  13.22   8.47    1   80.81  ? 733  PRO   A C    1 1 
ATOM   540  O  O    . PRO   A 1 40  ? 12.993  14.129  9.189   1   81     ? 733  PRO   A O    1 1 
ATOM   541  C  CB   . PRO   A 1 40  ? 13.337  13.178  6.048   1   80.66  ? 733  PRO   A CB   1 1 
ATOM   542  C  CG   . PRO   A 1 40  ? 13.431  14.333  5.117   1   80.96  ? 733  PRO   A CG   1 1 
ATOM   543  C  CD   . PRO   A 1 40  ? 12.86   15.515  5.817   1   79.18  ? 733  PRO   A CD   1 1 
ATOM   544  H  HA   . PRO   A 1 40  ? 11.334  12.88   6.758   0   101.49 ? 733  PRO   A HA   1 1 
ATOM   545  H  HB2  . PRO   A 1 40  ? 14.263  13.049  6.606   0   105.61 ? 733  PRO   A HB2  1 1 
ATOM   546  H  HB3  . PRO   A 1 40  ? 13.097  12.269  5.499   0   102.24 ? 733  PRO   A HB3  1 1 
ATOM   547  H  HG2  . PRO   A 1 40  ? 14.477  14.512  4.869   0   104.85 ? 733  PRO   A HG2  1 1 
ATOM   548  H  HG3  . PRO   A 1 40  ? 12.861  14.115  4.215   0   101.62 ? 733  PRO   A HG3  1 1 
ATOM   549  H  HD2  . PRO   A 1 40  ? 13.639  16.045  6.363   0   105.25 ? 733  PRO   A HD2  1 1 
ATOM   550  H  HD3  . PRO   A 1 40  ? 12.372  16.161  5.089   0   102.14 ? 733  PRO   A HD3  1 1 
ATOM   551  N  N    . GLU   A 1 41  ? 12.424  11.964  8.91    1   81.07  ? 734  GLU   A N    1 1 
ATOM   552  C  CA   . GLU   A 1 41  ? 12.751  11.583  10.285  1   81.83  ? 734  GLU   A CA   1 1 
ATOM   553  C  C    . GLU   A 1 41  ? 14.254  11.754  10.518  1   82.16  ? 734  GLU   A C    1 1 
ATOM   554  O  O    . GLU   A 1 41  ? 15.054  11.288  9.709   1   82.3   ? 734  GLU   A O    1 1 
ATOM   555  C  CB   . GLU   A 1 41  ? 12.322  10.132  10.578  1   84.32  ? 734  GLU   A CB   1 1 
ATOM   556  C  CG   . GLU   A 1 41  ? 10.817  9.934   10.708  1   89.38  ? 734  GLU   A CG   1 1 
ATOM   557  C  CD   . GLU   A 1 41  ? 10.167  10.531  11.943  1   95.41  ? 734  GLU   A CD   1 1 
ATOM   558  O  OE1  . GLU   A 1 41  ? 10.828  10.579  13.006  1   96.4   ? 734  GLU   A OE1  1 1 
ATOM   559  O  OE2  . GLU   A 1 41  ? 8.988   10.94   11.849  1   97.4   ? 734  GLU   A OE2  1 1 
ATOM   560  H  H    . GLU   A 1 41  ? 12.088  11.204  8.327   0   104.46 ? 734  GLU   A H    1 1 
ATOM   561  H  HA   . GLU   A 1 41  ? 12.216  12.245  10.965  0   109.65 ? 734  GLU   A HA   1 1 
ATOM   562  H  HB2  . GLU   A 1 41  ? 12.666  9.492   9.766   0   109.81 ? 734  GLU   A HB2  1 1 
ATOM   563  H  HB3  . GLU   A 1 41  ? 12.789  9.811   11.507  0   112.49 ? 734  GLU   A HB3  1 1 
ATOM   564  H  HG2  . GLU   A 1 41  ? 10.334  10.383  9.841   0   112.72 ? 734  GLU   A HG2  1 1 
ATOM   565  H  HG3  . GLU   A 1 41  ? 10.611  8.865   10.721  0   113.68 ? 734  GLU   A HG3  1 1 
ATOM   566  N  N    . GLY   A 1 42  ? 14.616  12.47   11.58   1   82.2   ? 735  GLY   A N    1 1 
ATOM   567  C  CA   . GLY   A 1 42  ? 16.009  12.759  11.9    1   82.62  ? 735  GLY   A CA   1 1 
ATOM   568  C  C    . GLY   A 1 42  ? 16.499  14.029  11.23   1   82.93  ? 735  GLY   A C    1 1 
ATOM   569  O  O    . GLY   A 1 42  ? 17.051  14.907  11.897  1   83.04  ? 735  GLY   A O    1 1 
ATOM   570  H  H    . GLY   A 1 42  ? 13.965  12.863  12.254  0   114.45 ? 735  GLY   A H    1 1 
ATOM   571  H  HA2  . GLY   A 1 42  ? 16.105  12.89   12.977  0   119.39 ? 735  GLY   A HA2  1 1 
ATOM   572  H  HA3  . GLY   A 1 42  ? 16.652  11.933  11.601  0   117.54 ? 735  GLY   A HA3  1 1 
ATOM   573  N  N    . GLU   A 1 43  ? 16.287  14.146  9.909   1   82.67  ? 736  GLU   A N    1 1 
ATOM   574  C  CA   . GLU   A 1 43  ? 16.699  15.331  9.147   1   83.23  ? 736  GLU   A CA   1 1 
ATOM   575  C  C    . GLU   A 1 43  ? 15.757  16.514  9.429   1   83.23  ? 736  GLU   A C    1 1 
ATOM   576  O  O    . GLU   A 1 43  ? 14.638  16.314  9.906   1   83.6   ? 736  GLU   A O    1 1 
ATOM   577  C  CB   . GLU   A 1 43  ? 16.711  15.04   7.632   1   85.52  ? 736  GLU   A CB   1 1 
ATOM   578  C  CG   . GLU   A 1 43  ? 17.732  14.002  7.196   1   90.64  ? 736  GLU   A CG   1 1 
ATOM   579  C  CD   . GLU   A 1 43  ? 17.748  13.696  5.709   1   96.73  ? 736  GLU   A CD   1 1 
ATOM   580  O  OE1  . GLU   A 1 43  ? 18.493  12.775  5.305   1   97.66  ? 736  GLU   A OE1  1 1 
ATOM   581  O  OE2  . GLU   A 1 43  ? 17.019  14.371  4.946   1   98.7   ? 736  GLU   A OE2  1 1 
ATOM   582  H  H    . GLU   A 1 43  ? 15.814  13.442  9.351   0   114.01 ? 736  GLU   A H    1 1 
ATOM   583  H  HA   . GLU   A 1 43  ? 17.708  15.62   9.439   0   119.86 ? 736  GLU   A HA   1 1 
ATOM   584  H  HB2  . GLU   A 1 43  ? 15.723  14.695  7.331   0   114.92 ? 736  GLU   A HB2  1 1 
ATOM   585  H  HB3  . GLU   A 1 43  ? 16.945  15.967  7.112   0   117.67 ? 736  GLU   A HB3  1 1 
ATOM   586  H  HG2  . GLU   A 1 43  ? 18.724  14.357  7.467   0   124.98 ? 736  GLU   A HG2  1 1 
ATOM   587  H  HG3  . GLU   A 1 43  ? 17.523  13.067  7.714   0   122.04 ? 736  GLU   A HG3  1 1 
ATOM   588  N  N    . LYS   A 1 44  ? 16.214  17.746  9.141   1   82.92  ? 737  LYS   A N    1 1 
ATOM   589  C  CA   . LYS   A 1 44  ? 15.417  18.959  9.343   1   82.99  ? 737  LYS   A CA   1 1 
ATOM   590  C  C    . LYS   A 1 44  ? 15.353  19.804  8.055   1   82.54  ? 737  LYS   A C    1 1 
ATOM   591  O  O    . LYS   A 1 44  ? 15.203  21.022  8.143   1   82.71  ? 737  LYS   A O    1 1 
ATOM   592  C  CB   . LYS   A 1 44  ? 15.999  19.797  10.499  1   85.29  ? 737  LYS   A CB   1 1 
ATOM   593  C  CG   . LYS   A 1 44  ? 16.221  19.015  11.803  1   89.82  ? 737  LYS   A CG   1 1 
ATOM   594  C  CD   . LYS   A 1 44  ? 17.028  19.81   12.836  1   95.14  ? 737  LYS   A CD   1 1 
ATOM   595  C  CE   . LYS   A 1 44  ? 18.525  19.671  12.623  1   99.68  ? 737  LYS   A CE   1 1 
ATOM   596  N  NZ   . LYS   A 1 44  ? 19.336  20.287  13.707  1   101.5  ? 737  LYS   A NZ   1 1 
ATOM   597  H  H    . LYS   A 1 44  ? 17.141  17.929  8.768   0   119.97 ? 737  LYS   A H    1 1 
ATOM   598  H  HA   . LYS   A 1 44  ? 14.393  18.705  9.61    0   118.1  ? 737  LYS   A HA   1 1 
ATOM   599  H  HB2  . LYS   A 1 44  ? 16.949  20.217  10.174  0   127.64 ? 737  LYS   A HB2  1 1 
ATOM   600  H  HB3  . LYS   A 1 44  ? 15.304  20.603  10.732  0   126.46 ? 737  LYS   A HB3  1 1 
ATOM   601  H  HG2  . LYS   A 1 44  ? 15.255  18.777  12.245  0   130.25 ? 737  LYS   A HG2  1 1 
ATOM   602  H  HG3  . LYS   A 1 44  ? 16.761  18.092  11.596  0   130.68 ? 737  LYS   A HG3  1 1 
ATOM   603  H  HD2  . LYS   A 1 44  ? 16.769  20.864  12.748  0   142.09 ? 737  LYS   A HD2  1 1 
ATOM   604  H  HD3  . LYS   A 1 44  ? 16.783  19.452  13.835  0   141.65 ? 737  LYS   A HD3  1 1 
ATOM   605  H  HE2  . LYS   A 1 44  ? 18.78   18.613  12.589  0   147.2  ? 737  LYS   A HE2  1 1 
ATOM   606  H  HE3  . LYS   A 1 44  ? 18.799  20.149  11.684  0   147.25 ? 737  LYS   A HE3  1 1 
ATOM   607  H  HZ1  . LYS   A 1 44  ? 20.251  20.533  13.345  0   155.8  ? 737  LYS   A HZ1  1 1 
ATOM   608  H  HZ2  . LYS   A 1 44  ? 18.883  21.12   14.067  0   154.74 ? 737  LYS   A HZ2  1 1 
ATOM   609  H  HZ3  . LYS   A 1 44  ? 19.458  19.625  14.466  0   155.23 ? 737  LYS   A HZ3  1 1 
ATOM   610  N  N    . VAL   A 1 45  ? 15.443  19.167  6.867   1   81.75  ? 738  VAL   A N    1 1 
ATOM   611  C  CA   . VAL   A 1 45  ? 15.372  19.872  5.585   1   81.53  ? 738  VAL   A CA   1 1 
ATOM   612  C  C    . VAL   A 1 45  ? 13.906  19.846  5.152   1   81.06  ? 738  VAL   A C    1 1 
ATOM   613  O  O    . VAL   A 1 45  ? 13.39   18.776  4.83    1   81.35  ? 738  VAL   A O    1 1 
ATOM   614  C  CB   . VAL   A 1 45  ? 16.302  19.232  4.517   1   82.29  ? 738  VAL   A CB   1 1 
ATOM   615  C  CG1  . VAL   A 1 45  ? 16.215  19.986  3.189   1   82.93  ? 738  VAL   A CG1  1 1 
ATOM   616  C  CG2  . VAL   A 1 45  ? 17.749  19.187  5.005   1   82.78  ? 738  VAL   A CG2  1 1 
ATOM   617  H  H    . VAL   A 1 45  ? 15.537  18.162  6.759   0   113.79 ? 738  VAL   A H    1 1 
ATOM   618  H  HA   . VAL   A 1 45  ? 15.689  20.907  5.699   0   116.07 ? 738  VAL   A HA   1 1 
ATOM   619  H  HB   . VAL   A 1 45  ? 15.982  18.207  4.337   0   111.36 ? 738  VAL   A HB   1 1 
ATOM   620  H  HG11 . VAL   A 1 45  ? 16.97   19.592  2.509   0   112.48 ? 738  VAL   A HG11 1 1 
ATOM   621  H  HG12 . VAL   A 1 45  ? 15.231  19.849  2.744   0   111.15 ? 738  VAL   A HG12 1 1 
ATOM   622  H  HG13 . VAL   A 1 45  ? 16.394  21.045  3.37    0   115.41 ? 738  VAL   A HG13 1 1 
ATOM   623  H  HG21 . VAL   A 1 45  ? 18.389  18.847  4.192   0   116.25 ? 738  VAL   A HG21 1 1 
ATOM   624  H  HG22 . VAL   A 1 45  ? 18.049  20.185  5.32    0   119.27 ? 738  VAL   A HG22 1 1 
ATOM   625  H  HG23 . VAL   A 1 45  ? 17.829  18.494  5.84    0   117.53 ? 738  VAL   A HG23 1 1 
ATOM   626  N  N    . LYS   A 1 46  ? 13.229  21.005  5.164   1   80.21  ? 739  LYS   A N    1 1 
ATOM   627  C  CA   . LYS   A 1 46  ? 11.815  21.077  4.791   1   79.84  ? 739  LYS   A CA   1 1 
ATOM   628  C  C    . LYS   A 1 46  ? 11.678  21.004  3.265   1   79.17  ? 739  LYS   A C    1 1 
ATOM   629  O  O    . LYS   A 1 46  ? 11.842  22.013  2.578   1   79.34  ? 739  LYS   A O    1 1 
ATOM   630  C  CB   . LYS   A 1 46  ? 11.162  22.359  5.347   1   81.64  ? 739  LYS   A CB   1 1 
ATOM   631  C  CG   . LYS   A 1 46  ? 11.202  22.457  6.876   1   85.73  ? 739  LYS   A CG   1 1 
ATOM   632  C  CD   . LYS   A 1 46  ? 10.018  23.213  7.493   1   90.31  ? 739  LYS   A CD   1 1 
ATOM   633  C  CE   . LYS   A 1 46  ? 10.037  24.708  7.262   1   94.1   ? 739  LYS   A CE   1 1 
ATOM   634  N  NZ   . LYS   A 1 46  ? 9.004   25.397  8.082   1   96.24  ? 739  LYS   A NZ   1 1 
ATOM   635  H  H    . LYS   A 1 46  ? 13.644  21.902  5.395   0   112.34 ? 739  LYS   A H    1 1 
ATOM   636  H  HA   . LYS   A 1 46  ? 11.281  20.234  5.227   0   106.53 ? 739  LYS   A HA   1 1 
ATOM   637  H  HB2  . LYS   A 1 46  ? 11.684  23.226  4.946   0   113.19 ? 739  LYS   A HB2  1 1 
ATOM   638  H  HB3  . LYS   A 1 46  ? 10.118  22.376  5.04    0   110.23 ? 739  LYS   A HB3  1 1 
ATOM   639  H  HG2  . LYS   A 1 46  ? 11.206  21.453  7.299   0   116.94 ? 739  LYS   A HG2  1 1 
ATOM   640  H  HG3  . LYS   A 1 46  ? 12.113  22.981  7.163   0   120.38 ? 739  LYS   A HG3  1 1 
ATOM   641  H  HD2  . LYS   A 1 46  ? 9.088   22.82   7.084   0   121.95 ? 739  LYS   A HD2  1 1 
ATOM   642  H  HD3  . LYS   A 1 46  ? 10.037  23.05   8.569   0   125.79 ? 739  LYS   A HD3  1 1 
ATOM   643  H  HE2  . LYS   A 1 46  ? 11.012  25.105  7.54    0   131.72 ? 739  LYS   A HE2  1 1 
ATOM   644  H  HE3  . LYS   A 1 46  ? 9.826   24.922  6.215   0   127.83 ? 739  LYS   A HE3  1 1 
ATOM   645  H  HZ1  . LYS   A 1 46  ? 9.039   26.398  7.92    0   135.96 ? 739  LYS   A HZ1  1 1 
ATOM   646  H  HZ2  . LYS   A 1 46  ? 8.082   25.054  7.832   0   132.01 ? 739  LYS   A HZ2  1 1 
ATOM   647  H  HZ3  . LYS   A 1 46  ? 9.166   25.217  9.068   0   134.71 ? 739  LYS   A HZ3  1 1 
ATOM   648  N  N    . ILE   A 1 47  ? 11.392  19.802  2.739   1   78.16  ? 740  ILE   A N    1 1 
ATOM   649  C  CA   . ILE   A 1 47  ? 11.28   19.574  1.295   1   77.72  ? 740  ILE   A CA   1 1 
ATOM   650  C  C    . ILE   A 1 47  ? 9.839   19.873  0.825   1   76.76  ? 740  ILE   A C    1 1 
ATOM   651  O  O    . ILE   A 1 47  ? 8.937   19.169  1.281   1   76.85  ? 740  ILE   A O    1 1 
ATOM   652  C  CB   . ILE   A 1 47  ? 11.691  18.11   0.953   1   78.37  ? 740  ILE   A CB   1 1 
ATOM   653  C  CG1  . ILE   A 1 47  ? 13.184  17.841  1.323   1   79.37  ? 740  ILE   A CG1  1 1 
ATOM   654  C  CG2  . ILE   A 1 47  ? 11.439  17.817  -0.539  1   78.93  ? 740  ILE   A CG2  1 1 
ATOM   655  C  CD1  . ILE   A 1 47  ? 13.508  16.403  1.734   1   80.69  ? 740  ILE   A CD1  1 1 
ATOM   656  H  H    . ILE   A 1 47  ? 11.209  18.974  3.296   0   100.39 ? 740  ILE   A H    1 1 
ATOM   657  H  HA   . ILE   A 1 47  ? 12.003  20.203  0.779   0   99.32  ? 740  ILE   A HA   1 1 
ATOM   658  H  HB   . ILE   A 1 47  ? 11.058  17.44   1.533   0   96.72  ? 740  ILE   A HB   1 1 
ATOM   659  H  HG12 . ILE   A 1 47  ? 13.812  18.082  0.466   0   100.4  ? 740  ILE   A HG12 1 1 
ATOM   660  H  HG13 . ILE   A 1 47  ? 13.474  18.468  2.163   0   102.4  ? 740  ILE   A HG13 1 1 
ATOM   661  H  HG21 . ILE   A 1 47  ? 11.998  16.93   -0.834  0   94.62  ? 740  ILE   A HG21 1 1 
ATOM   662  H  HG22 . ILE   A 1 47  ? 10.378  17.634  -0.7    0   94.31  ? 740  ILE   A HG22 1 1 
ATOM   663  H  HG23 . ILE   A 1 47  ? 11.765  18.673  -1.128  0   96.15  ? 740  ILE   A HG23 1 1 
ATOM   664  H  HD11 . ILE   A 1 47  ? 14.565  16.338  1.988   0   102.78 ? 740  ILE   A HD11 1 1 
ATOM   665  H  HD12 . ILE   A 1 47  ? 12.901  16.138  2.598   0   101.12 ? 740  ILE   A HD12 1 1 
ATOM   666  H  HD13 . ILE   A 1 47  ? 13.284  15.734  0.904   0   99.23  ? 740  ILE   A HD13 1 1 
ATOM   667  N  N    . PRO   A 1 48  ? 9.565   20.87   -0.059  1   75.71  ? 741  PRO   A N    1 1 
ATOM   668  C  CA   . PRO   A 1 48  ? 8.17    21.073  -0.505  1   75     ? 741  PRO   A CA   1 1 
ATOM   669  C  C    . PRO   A 1 48  ? 7.689   19.889  -1.349  1   74.02  ? 741  PRO   A C    1 1 
ATOM   670  O  O    . PRO   A 1 48  ? 8.389   19.486  -2.274  1   74.09  ? 741  PRO   A O    1 1 
ATOM   671  C  CB   . PRO   A 1 48  ? 8.223   22.377  -1.316  1   75.83  ? 741  PRO   A CB   1 1 
ATOM   672  C  CG   . PRO   A 1 48  ? 9.581   22.937  -1.122  1   76.45  ? 741  PRO   A CG   1 1 
ATOM   673  C  CD   . PRO   A 1 48  ? 10.478  21.822  -0.722  1   75.06  ? 741  PRO   A CD   1 1 
ATOM   674  H  HA   . PRO   A 1 48  ? 7.512   21.215  0.352   0   93.23  ? 741  PRO   A HA   1 1 
ATOM   675  H  HB2  . PRO   A 1 48  ? 8.055   22.162  -2.369  0   92.7   ? 741  PRO   A HB2  1 1 
ATOM   676  H  HB3  . PRO   A 1 48  ? 7.469   23.067  -0.94   0   95.41  ? 741  PRO   A HB3  1 1 
ATOM   677  H  HG2  . PRO   A 1 48  ? 9.925   23.377  -2.057  0   97.13  ? 741  PRO   A HG2  1 1 
ATOM   678  H  HG3  . PRO   A 1 48  ? 9.549   23.694  -0.339  0   99.4   ? 741  PRO   A HG3  1 1 
ATOM   679  H  HD2  . PRO   A 1 48  ? 10.937  21.369  -1.599  0   94.19  ? 741  PRO   A HD2  1 1 
ATOM   680  H  HD3  . PRO   A 1 48  ? 11.225  22.214  -0.033  0   97.53  ? 741  PRO   A HD3  1 1 
ATOM   681  N  N    . VAL   A 1 49  ? 6.52    19.308  -1.005  1   72.96  ? 742  VAL   A N    1 1 
ATOM   682  C  CA   . VAL   A 1 49  ? 5.973   18.118  -1.677  1   72.44  ? 742  VAL   A CA   1 1 
ATOM   683  C  C    . VAL   A 1 49  ? 4.485   18.286  -2.058  1   71.85  ? 742  VAL   A C    1 1 
ATOM   684  O  O    . VAL   A 1 49  ? 3.82    19.192  -1.56   1   71.81  ? 742  VAL   A O    1 1 
ATOM   685  C  CB   . VAL   A 1 49  ? 6.175   16.827  -0.812  1   73.05  ? 742  VAL   A CB   1 1 
ATOM   686  C  CG1  . VAL   A 1 49  ? 7.652   16.516  -0.595  1   73.64  ? 742  VAL   A CG1  1 1 
ATOM   687  C  CG2  . VAL   A 1 49  ? 5.43    16.903  0.521   1   73.43  ? 742  VAL   A CG2  1 1 
ATOM   688  H  H    . VAL   A 1 49  ? 5.913   19.673  -0.278  0   87.73  ? 742  VAL   A H    1 1 
ATOM   689  H  HA   . VAL   A 1 49  ? 6.506   17.952  -2.612  0   82.97  ? 742  VAL   A HA   1 1 
ATOM   690  H  HB   . VAL   A 1 49  ? 5.755   15.985  -1.36   0   82.71  ? 742  VAL   A HB   1 1 
ATOM   691  H  HG11 . VAL   A 1 49  ? 7.738   15.568  -0.068  0   85.58  ? 742  VAL   A HG11 1 1 
ATOM   692  H  HG12 . VAL   A 1 49  ? 8.145   16.45   -1.564  0   84.75  ? 742  VAL   A HG12 1 1 
ATOM   693  H  HG13 . VAL   A 1 49  ? 8.103   17.31   -0.001  0   87.27  ? 742  VAL   A HG13 1 1 
ATOM   694  H  HG21 . VAL   A 1 49  ? 5.546   15.948  1.031   0   85.77  ? 742  VAL   A HG21 1 1 
ATOM   695  H  HG22 . VAL   A 1 49  ? 5.859   17.699  1.128   0   87.55  ? 742  VAL   A HG22 1 1 
ATOM   696  H  HG23 . VAL   A 1 49  ? 4.371   17.09   0.354   0   85.43  ? 742  VAL   A HG23 1 1 
ATOM   697  N  N    . ALA   A 1 50  ? 3.971   17.398  -2.939  1   71.25  ? 743  ALA   A N    1 1 
ATOM   698  C  CA   . ALA   A 1 50  ? 2.565   17.353  -3.341  1   71.23  ? 743  ALA   A CA   1 1 
ATOM   699  C  C    . ALA   A 1 50  ? 1.961   16.009  -2.906  1   71.02  ? 743  ALA   A C    1 1 
ATOM   700  O  O    . ALA   A 1 50  ? 2.643   14.985  -2.957  1   71.05  ? 743  ALA   A O    1 1 
ATOM   701  C  CB   . ALA   A 1 50  ? 2.436   17.525  -4.839  1   71.33  ? 743  ALA   A CB   1 1 
ATOM   702  H  H    . ALA   A 1 50  ? 4.53    16.69   -3.405  0   78.98  ? 743  ALA   A H    1 1 
ATOM   703  H  HA   . ALA   A 1 50  ? 2.001   18.153  -2.864  0   80.62  ? 743  ALA   A HA   1 1 
ATOM   704  H  HB1  . ALA   A 1 50  ? 1.386   17.441  -5.116  0   77.82  ? 743  ALA   A HB1  1 1 
ATOM   705  H  HB2  . ALA   A 1 50  ? 2.813   18.509  -5.113  0   78.71  ? 743  ALA   A HB2  1 1 
ATOM   706  H  HB3  . ALA   A 1 50  ? 3.017   16.753  -5.34   0   76.92  ? 743  ALA   A HB3  1 1 
ATOM   707  N  N    . ILE   A 1 51  ? 0.687   16.018  -2.465  1   70.7   ? 744  ILE   A N    1 1 
ATOM   708  C  CA   . ILE   A 1 51  ? -0.01   14.835  -1.944  1   70.92  ? 744  ILE   A CA   1 1 
ATOM   709  C  C    . ILE   A 1 51  ? -1.296  14.588  -2.755  1   71.08  ? 744  ILE   A C    1 1 
ATOM   710  O  O    . ILE   A 1 51  ? -2.054  15.526  -2.929  1   71.08  ? 744  ILE   A O    1 1 
ATOM   711  C  CB   . ILE   A 1 51  ? -0.338  15.069  -0.435  1   71.42  ? 744  ILE   A CB   1 1 
ATOM   712  C  CG1  . ILE   A 1 51  ? 0.92    15.505  0.392   1   72.34  ? 744  ILE   A CG1  1 1 
ATOM   713  C  CG2  . ILE   A 1 51  ? -0.972  13.828  0.178   1   71.87  ? 744  ILE   A CG2  1 1 
ATOM   714  C  CD1  . ILE   A 1 51  ? 0.623   16.431  1.591   1   73.53  ? 744  ILE   A CD1  1 1 
ATOM   715  H  H    . ILE   A 1 51  ? 0.103   16.848  -2.466  0   79.57  ? 744  ILE   A H    1 1 
ATOM   716  H  HA   . ILE   A 1 51  ? 0.615   13.947  -2.02   0   78.01  ? 744  ILE   A HA   1 1 
ATOM   717  H  HB   . ILE   A 1 51  ? -1.078  15.866  -0.386  0   82.2   ? 744  ILE   A HB   1 1 
ATOM   718  H  HG12 . ILE   A 1 51  ? 1.403   14.615  0.792   0   82.7   ? 744  ILE   A HG12 1 1 
ATOM   719  H  HG13 . ILE   A 1 51  ? 1.631   16.032  -0.241  0   82.58  ? 744  ILE   A HG13 1 1 
ATOM   720  H  HG21 . ILE   A 1 51  ? -1.084  13.968  1.252   0   83.18  ? 744  ILE   A HG21 1 1 
ATOM   721  H  HG22 . ILE   A 1 51  ? -1.952  13.652  -0.262  0   81.51  ? 744  ILE   A HG22 1 1 
ATOM   722  H  HG23 . ILE   A 1 51  ? -0.314  12.982  -0.016  0   80.95  ? 744  ILE   A HG23 1 1 
ATOM   723  H  HD11 . ILE   A 1 51  ? 1.562   16.691  2.078   0   87.19  ? 744  ILE   A HD11 1 1 
ATOM   724  H  HD12 . ILE   A 1 51  ? 0.13    17.332  1.229   0   87.1   ? 744  ILE   A HD12 1 1 
ATOM   725  H  HD13 . ILE   A 1 51  ? -0.026  15.909  2.293   0   87.1   ? 744  ILE   A HD13 1 1 
ATOM   726  N  N    . LYS   A 1 52  ? -1.571  13.344  -3.212  1   71.17  ? 745  LYS   A N    1 1 
ATOM   727  C  CA   . LYS   A 1 52  ? -2.793  13.049  -3.985  1   71.74  ? 745  LYS   A CA   1 1 
ATOM   728  C  C    . LYS   A 1 52  ? -3.728  12.066  -3.252  1   72.3   ? 745  LYS   A C    1 1 
ATOM   729  O  O    . LYS   A 1 52  ? -3.261  11.199  -2.523  1   72.26  ? 745  LYS   A O    1 1 
ATOM   730  C  CB   . LYS   A 1 52  ? -2.437  12.506  -5.386  1   73.4   ? 745  LYS   A CB   1 1 
ATOM   731  C  CG   . LYS   A 1 52  ? -3.58   12.596  -6.408  1   77.33  ? 745  LYS   A CG   1 1 
ATOM   732  C  CD   . LYS   A 1 52  ? -3.122  12.557  -7.87   1   81.77  ? 745  LYS   A CD   1 1 
ATOM   733  C  CE   . LYS   A 1 52  ? -2.73   11.176  -8.339  1   85.47  ? 745  LYS   A CE   1 1 
ATOM   734  N  NZ   . LYS   A 1 52  ? -2.621  11.082  -9.82   1   87.83  ? 745  LYS   A NZ   1 1 
ATOM   735  H  H    . LYS   A 1 52  ? -0.976  12.535  -3.066  0   77.06  ? 745  LYS   A H    1 1 
ATOM   736  H  HA   . LYS   A 1 52  ? -3.356  13.972  -4.12   0   78.65  ? 745  LYS   A HA   1 1 
ATOM   737  H  HB2  . LYS   A 1 52  ? -1.589  13.071  -5.771  0   77.35  ? 745  LYS   A HB2  1 1 
ATOM   738  H  HB3  . LYS   A 1 52  ? -2.163  11.456  -5.289  0   77.56  ? 745  LYS   A HB3  1 1 
ATOM   739  H  HG2  . LYS   A 1 52  ? -4.26   11.761  -6.245  0   82.23  ? 745  LYS   A HG2  1 1 
ATOM   740  H  HG3  . LYS   A 1 52  ? -4.113  13.533  -6.261  0   82.69  ? 745  LYS   A HG3  1 1 
ATOM   741  H  HD2  . LYS   A 1 52  ? -3.943  12.909  -8.493  0   84.94  ? 745  LYS   A HD2  1 1 
ATOM   742  H  HD3  . LYS   A 1 52  ? -2.261  13.211  -7.996  0   84.35  ? 745  LYS   A HD3  1 1 
ATOM   743  H  HE2  . LYS   A 1 52  ? -1.749  10.94   -7.931  0   87.32  ? 745  LYS   A HE2  1 1 
ATOM   744  H  HE3  . LYS   A 1 52  ? -3.467  10.447  -8.006  0   88.25  ? 745  LYS   A HE3  1 1 
ATOM   745  H  HZ1  . LYS   A 1 52  ? -2.645  10.108  -10.104 0   88.94  ? 745  LYS   A HZ1  1 1 
ATOM   746  H  HZ2  . LYS   A 1 52  ? -3.385  11.577  -10.269 0   89.02  ? 745  LYS   A HZ2  1 1 
ATOM   747  H  HZ3  . LYS   A 1 52  ? -1.74   11.486  -10.124 0   88.17  ? 745  LYS   A HZ3  1 1 
ATOM   748  N  N    . GLU   A 1 53  ? -5.05   12.222  -3.457  1   72.67  ? 746  GLU   A N    1 1 
ATOM   749  C  CA   . GLU   A 1 53  ? -6.117  11.405  -2.861  1   73.51  ? 746  GLU   A CA   1 1 
ATOM   750  C  C    . GLU   A 1 53  ? -7.221  11.121  -3.914  1   74.17  ? 746  GLU   A C    1 1 
ATOM   751  O  O    . GLU   A 1 53  ? -7.193  11.709  -4.992  1   74.19  ? 746  GLU   A O    1 1 
ATOM   752  C  CB   . GLU   A 1 53  ? -6.745  12.174  -1.677  1   75.69  ? 746  GLU   A CB   1 1 
ATOM   753  C  CG   . GLU   A 1 53  ? -5.988  12.07   -0.368  1   80.05  ? 746  GLU   A CG   1 1 
ATOM   754  C  CD   . GLU   A 1 53  ? -6.64   12.801  0.791   1   85.47  ? 746  GLU   A CD   1 1 
ATOM   755  O  OE1  . GLU   A 1 53  ? -7.841  13.142  0.692   1   86.47  ? 746  GLU   A OE1  1 1 
ATOM   756  O  OE2  . GLU   A 1 53  ? -5.944  13.033  1.805   1   87.61  ? 746  GLU   A OE2  1 1 
ATOM   757  H  H    . GLU   A 1 53  ? -5.427  12.939  -4.068  0   80.79  ? 746  GLU   A H    1 1 
ATOM   758  H  HA   . GLU   A 1 53  ? -5.727  10.45   -2.509  0   82.68  ? 746  GLU   A HA   1 1 
ATOM   759  H  HB2  . GLU   A 1 53  ? -6.795  13.23   -1.941  0   87.49  ? 746  GLU   A HB2  1 1 
ATOM   760  H  HB3  . GLU   A 1 53  ? -7.75   11.792  -1.506  0   88.48  ? 746  GLU   A HB3  1 1 
ATOM   761  H  HG2  . GLU   A 1 53  ? -5.916  11.018  -0.094  0   92.03  ? 746  GLU   A HG2  1 1 
ATOM   762  H  HG3  . GLU   A 1 53  ? -4.991  12.485  -0.505  0   91.19  ? 746  GLU   A HG3  1 1 
ATOM   763  N  N    . LEU   A 1 54  ? -8.19   10.233  -3.602  1   74.51  ? 747  LEU   A N    1 1 
ATOM   764  C  CA   . LEU   A 1 54  ? -9.323  9.938   -4.487  1   75.32  ? 747  LEU   A CA   1 1 
ATOM   765  C  C    . LEU   A 1 54  ? -10.624 10.084  -3.703  1   75.81  ? 747  LEU   A C    1 1 
ATOM   766  O  O    . LEU   A 1 54  ? -10.892 9.292   -2.801  1   76.03  ? 747  LEU   A O    1 1 
ATOM   767  C  CB   . LEU   A 1 54  ? -9.228  8.516   -5.065  1   75.7   ? 747  LEU   A CB   1 1 
ATOM   768  C  CG   . LEU   A 1 54  ? -8.121  8.253   -6.095  1   77.38  ? 747  LEU   A CG   1 1 
ATOM   769  C  CD1  . LEU   A 1 54  ? -7.943  6.765   -6.329  1   78     ? 747  LEU   A CD1  1 1 
ATOM   770  C  CD2  . LEU   A 1 54  ? -8.411  8.937   -7.435  1   78.09  ? 747  LEU   A CD2  1 1 
ATOM   771  H  H    . LEU   A 1 54  ? -8.21   9.698   -2.739  0   86.23  ? 747  LEU   A H    1 1 
ATOM   772  H  HA   . LEU   A 1 54  ? -9.371  10.656  -5.303  0   86.41  ? 747  LEU   A HA   1 1 
ATOM   773  H  HB2  . LEU   A 1 54  ? -9.067  7.835   -4.231  0   87.52  ? 747  LEU   A HB2  1 1 
ATOM   774  H  HB3  . LEU   A 1 54  ? -10.178 8.277   -5.541  0   87.93  ? 747  LEU   A HB3  1 1 
ATOM   775  H  HG   . LEU   A 1 54  ? -7.183  8.653   -5.713  0   85.47  ? 747  LEU   A HG   1 1 
ATOM   776  H  HD11 . LEU   A 1 54  ? -7.058  6.607   -6.943  0   85.57  ? 747  LEU   A HD11 1 1 
ATOM   777  H  HD12 . LEU   A 1 54  ? -7.832  6.258   -5.372  0   87.56  ? 747  LEU   A HD12 1 1 
ATOM   778  H  HD13 . LEU   A 1 54  ? -8.823  6.385   -6.845  0   88.05  ? 747  LEU   A HD13 1 1 
ATOM   779  H  HD21 . LEU   A 1 54  ? -7.701  8.578   -8.179  0   84.76  ? 747  LEU   A HD21 1 1 
ATOM   780  H  HD22 . LEU   A 1 54  ? -9.427  8.698   -7.747  0   87.24  ? 747  LEU   A HD22 1 1 
ATOM   781  H  HD23 . LEU   A 1 54  ? -8.299  10.014  -7.324  0   86.35  ? 747  LEU   A HD23 1 1 
ATOM   782  N  N    . ALA   A 1 62  ? -11.452 1.996   -4.429  1   66.73  ? 755  ALA   A N    1 1 
ATOM   783  C  CA   . ALA   A 1 62  ? -10.772 3.289   -4.473  1   67.19  ? 755  ALA   A CA   1 1 
ATOM   784  C  C    . ALA   A 1 62  ? -9.301  3.161   -4.059  1   67.31  ? 755  ALA   A C    1 1 
ATOM   785  O  O    . ALA   A 1 62  ? -8.439  3.754   -4.705  1   67.47  ? 755  ALA   A O    1 1 
ATOM   786  C  CB   . ALA   A 1 62  ? -11.487 4.288   -3.576  1   67.41  ? 755  ALA   A CB   1 1 
ATOM   787  H  HA   . ALA   A 1 62  ? -10.803 3.67    -5.493  0   82.29  ? 755  ALA   A HA   1 1 
ATOM   788  H  HB1  . ALA   A 1 62  ? -10.963 5.241   -3.621  0   83.3   ? 755  ALA   A HB1  1 1 
ATOM   789  H  HB2  . ALA   A 1 62  ? -12.51  4.409   -3.93   0   86.13  ? 755  ALA   A HB2  1 1 
ATOM   790  H  HB3  . ALA   A 1 62  ? -11.489 3.911   -2.554  0   85.75  ? 755  ALA   A HB3  1 1 
ATOM   791  N  N    . ASN   A 1 63  ? -9.01   2.402   -2.984  1   67.11  ? 756  ASN   A N    1 1 
ATOM   792  C  CA   . ASN   A 1 63  ? -7.628  2.189   -2.533  1   67.26  ? 756  ASN   A CA   1 1 
ATOM   793  C  C    . ASN   A 1 63  ? -6.845  1.365   -3.564  1   66.95  ? 756  ASN   A C    1 1 
ATOM   794  O  O    . ASN   A 1 63  ? -5.659  1.614   -3.766  1   67.16  ? 756  ASN   A O    1 1 
ATOM   795  C  CB   . ASN   A 1 63  ? -7.594  1.493   -1.17   1   68.58  ? 756  ASN   A CB   1 1 
ATOM   796  C  CG   . ASN   A 1 63  ? -8.054  2.374   -0.029  1   71.95  ? 756  ASN   A CG   1 1 
ATOM   797  O  OD1  . ASN   A 1 63  ? -7.457  3.421   0.251   1   73.07  ? 756  ASN   A OD1  1 1 
ATOM   798  N  ND2  . ASN   A 1 63  ? -9.122  1.98    0.664   1   72.73  ? 756  ASN   A ND2  1 1 
ATOM   799  H  H    . ASN   A 1 63  ? -9.704  1.938   -2.408  0   84.17  ? 756  ASN   A H    1 1 
ATOM   800  H  HA   . ASN   A 1 63  ? -7.135  3.154   -2.428  0   80.04  ? 756  ASN   A HA   1 1 
ATOM   801  H  HB2  . ASN   A 1 63  ? -8.218  0.602   -1.211  0   85.74  ? 756  ASN   A HB2  1 1 
ATOM   802  H  HB3  . ASN   A 1 63  ? -6.566  1.202   -0.96   0   83.48  ? 756  ASN   A HB3  1 1 
ATOM   803  H  HD21 . ASN   A 1 63  ? -9.456  2.549   1.436   0   92.33  ? 756  ASN   A HD21 1 1 
ATOM   804  H  HD22 . ASN   A 1 63  ? -9.609  1.121   0.43    0   92.68  ? 756  ASN   A HD22 1 1 
ATOM   805  N  N    . LYS   A 1 64  ? -7.511  0.385   -4.205  1   66.21  ? 757  LYS   A N    1 1 
ATOM   806  C  CA   . LYS   A 1 64  ? -6.928  -0.451  -5.26   1   65.93  ? 757  LYS   A CA   1 1 
ATOM   807  C  C    . LYS   A 1 64  ? -6.353  0.408   -6.394  1   65.17  ? 757  LYS   A C    1 1 
ATOM   808  O  O    . LYS   A 1 64  ? -5.25   0.13    -6.855  1   65.1   ? 757  LYS   A O    1 1 
ATOM   809  C  CB   . LYS   A 1 64  ? -8.002  -1.43   -5.804  1   68.01  ? 757  LYS   A CB   1 1 
ATOM   810  C  CG   . LYS   A 1 64  ? -7.703  -2.162  -7.127  1   72.27  ? 757  LYS   A CG   1 1 
ATOM   811  C  CD   . LYS   A 1 64  ? -6.533  -3.149  -7.054  1   76.68  ? 757  LYS   A CD   1 1 
ATOM   812  C  CE   . LYS   A 1 64  ? -6.471  -4.072  -8.256  1   80.25  ? 757  LYS   A CE   1 1 
ATOM   813  N  NZ   . LYS   A 1 64  ? -5.633  -3.524  -9.355  1   82.64  ? 757  LYS   A NZ   1 1 
ATOM   814  H  H    . LYS   A 1 64  ? -8.462  0.12    -3.972  0   82.07  ? 757  LYS   A H    1 1 
ATOM   815  H  HA   . LYS   A 1 64  ? -6.114  -1.038  -4.837  0   79.84  ? 757  LYS   A HA   1 1 
ATOM   816  H  HB2  . LYS   A 1 64  ? -8.172  -2.194  -5.047  0   85.65  ? 757  LYS   A HB2  1 1 
ATOM   817  H  HB3  . LYS   A 1 64  ? -8.924  -0.872  -5.964  0   84.43  ? 757  LYS   A HB3  1 1 
ATOM   818  H  HG2  . LYS   A 1 64  ? -8.594  -2.733  -7.384  0   89.87  ? 757  LYS   A HG2  1 1 
ATOM   819  H  HG3  . LYS   A 1 64  ? -7.5    -1.45   -7.924  0   86.51  ? 757  LYS   A HG3  1 1 
ATOM   820  H  HD2  . LYS   A 1 64  ? -5.597  -2.594  -7.017  0   90.98  ? 757  LYS   A HD2  1 1 
ATOM   821  H  HD3  . LYS   A 1 64  ? -6.636  -3.764  -6.161  0   94.1   ? 757  LYS   A HD3  1 1 
ATOM   822  H  HE2  . LYS   A 1 64  ? -6.03   -5.018  -7.946  0   98.61  ? 757  LYS   A HE2  1 1 
ATOM   823  H  HE3  . LYS   A 1 64  ? -7.471  -4.245  -8.649  0   98.55  ? 757  LYS   A HE3  1 1 
ATOM   824  H  HZ1  . LYS   A 1 64  ? -5.679  -4.137  -10.162 0   98.43  ? 757  LYS   A HZ1  1 1 
ATOM   825  H  HZ2  . LYS   A 1 64  ? -5.961  -2.601  -9.623  0   96.19  ? 757  LYS   A HZ2  1 1 
ATOM   826  H  HZ3  . LYS   A 1 64  ? -4.667  -3.455  -9.051  0   96.94  ? 757  LYS   A HZ3  1 1 
ATOM   827  N  N    . GLU   A 1 65  ? -7.075  1.452   -6.825  1   64.29  ? 758  GLU   A N    1 1 
ATOM   828  C  CA   . GLU   A 1 65  ? -6.63   2.298   -7.932  1   63.67  ? 758  GLU   A CA   1 1 
ATOM   829  C  C    . GLU   A 1 65  ? -5.389  3.137   -7.599  1   62.25  ? 758  GLU   A C    1 1 
ATOM   830  O  O    . GLU   A 1 65  ? -4.472  3.2     -8.417  1   62.21  ? 758  GLU   A O    1 1 
ATOM   831  C  CB   . GLU   A 1 65  ? -7.766  3.218   -8.411  1   66.3   ? 758  GLU   A CB   1 1 
ATOM   832  C  CG   . GLU   A 1 65  ? -8.959  2.472   -8.988  1   71.36  ? 758  GLU   A CG   1 1 
ATOM   833  C  CD   . GLU   A 1 65  ? -10.041 3.347   -9.591  1   77.9   ? 758  GLU   A CD   1 1 
ATOM   834  O  OE1  . GLU   A 1 65  ? -9.812  4.569   -9.741  1   79.29  ? 758  GLU   A OE1  1 1 
ATOM   835  O  OE2  . GLU   A 1 65  ? -11.121 2.804   -9.916  1   80.59  ? 758  GLU   A OE2  1 1 
ATOM   836  H  H    . GLU   A 1 65  ? -7.95   1.749   -6.404  0   76.25  ? 758  GLU   A H    1 1 
ATOM   837  H  HA   . GLU   A 1 65  ? -6.377  1.649   -8.769  0   72.65  ? 758  GLU   A HA   1 1 
ATOM   838  H  HB2  . GLU   A 1 65  ? -8.116  3.816   -7.571  0   75.68  ? 758  GLU   A HB2  1 1 
ATOM   839  H  HB3  . GLU   A 1 65  ? -7.368  3.867   -9.189  0   74.25  ? 758  GLU   A HB3  1 1 
ATOM   840  H  HG2  . GLU   A 1 65  ? -8.608  1.796   -9.767  0   82.89  ? 758  GLU   A HG2  1 1 
ATOM   841  H  HG3  . GLU   A 1 65  ? -9.424  1.895   -8.19   0   84.13  ? 758  GLU   A HG3  1 1 
ATOM   842  N  N    . ILE   A 1 66  ? -5.361  3.795   -6.428  1   61.03  ? 759  ILE   A N    1 1 
ATOM   843  C  CA   . ILE   A 1 66  ? -4.219  4.64    -6.047  1   60.35  ? 759  ILE   A CA   1 1 
ATOM   844  C  C    . ILE   A 1 66  ? -2.948  3.798   -5.789  1   59.19  ? 759  ILE   A C    1 1 
ATOM   845  O  O    . ILE   A 1 66  ? -1.854  4.27    -6.097  1   59.16  ? 759  ILE   A O    1 1 
ATOM   846  C  CB   . ILE   A 1 66  ? -4.558  5.621   -4.865  1   60.96  ? 759  ILE   A CB   1 1 
ATOM   847  C  CG1  . ILE   A 1 66  ? -3.576  6.837   -4.822  1   62.02  ? 759  ILE   A CG1  1 1 
ATOM   848  C  CG2  . ILE   A 1 66  ? -4.61   4.909   -3.506  1   61.43  ? 759  ILE   A CG2  1 1 
ATOM   849  C  CD1  . ILE   A 1 66  ? -4.193  8.163   -4.288  1   63.33  ? 759  ILE   A CD1  1 1 
ATOM   850  H  H    . ILE   A 1 66  ? -6.118  3.778   -5.753  0   69.83  ? 759  ILE   A H    1 1 
ATOM   851  H  HA   . ILE   A 1 66  ? -3.996  5.26    -6.914  0   65.62  ? 759  ILE   A HA   1 1 
ATOM   852  H  HB   . ILE   A 1 66  ? -5.557  6.015   -5.047  0   68.47  ? 759  ILE   A HB   1 1 
ATOM   853  H  HG12 . ILE   A 1 66  ? -2.733  6.589   -4.178  0   67.76  ? 759  ILE   A HG12 1 1 
ATOM   854  H  HG13 . ILE   A 1 66  ? -3.205  7.043   -5.825  0   66.69  ? 759  ILE   A HG13 1 1 
ATOM   855  H  HG21 . ILE   A 1 66  ? -5.103  5.563   -2.789  0   70.29  ? 759  ILE   A HG21 1 1 
ATOM   856  H  HG22 . ILE   A 1 66  ? -5.172  3.983   -3.614  0   70.88  ? 759  ILE   A HG22 1 1 
ATOM   857  H  HG23 . ILE   A 1 66  ? -3.6    4.691   -3.163  0   69.45  ? 759  ILE   A HG23 1 1 
ATOM   858  H  HD11 . ILE   A 1 66  ? -3.436  8.945   -4.272  0   68.99  ? 759  ILE   A HD11 1 1 
ATOM   859  H  HD12 . ILE   A 1 66  ? -5.006  8.457   -4.95   0   69.8   ? 759  ILE   A HD12 1 1 
ATOM   860  H  HD13 . ILE   A 1 66  ? -4.576  8.002   -3.281  0   70.82  ? 759  ILE   A HD13 1 1 
ATOM   861  N  N    . LEU   A 1 67  ? -3.081  2.552   -5.29   1   58.04  ? 760  LEU   A N    1 1 
ATOM   862  C  CA   . LEU   A 1 67  ? -1.912  1.693   -5.068  1   57.46  ? 760  LEU   A CA   1 1 
ATOM   863  C  C    . LEU   A 1 67  ? -1.34   1.156   -6.379  1   56.35  ? 760  LEU   A C    1 1 
ATOM   864  O  O    . LEU   A 1 67  ? -0.132  0.941   -6.456  1   56.25  ? 760  LEU   A O    1 1 
ATOM   865  C  CB   . LEU   A 1 67  ? -2.236  0.543   -4.1    1   57.81  ? 760  LEU   A CB   1 1 
ATOM   866  C  CG   . LEU   A 1 67  ? -2.424  0.956   -2.619  1   59.29  ? 760  LEU   A CG   1 1 
ATOM   867  C  CD1  . LEU   A 1 67  ? -3.31   -0.016  -1.874  1   59.8   ? 760  LEU   A CD1  1 1 
ATOM   868  C  CD2  . LEU   A 1 67  ? -1.075  1.096   -1.899  1   59.93  ? 760  LEU   A CD2  1 1 
ATOM   869  H  H    . LEU   A 1 67  ? -3.963  2.125   -5.027  0   66.72  ? 760  LEU   A H    1 1 
ATOM   870  H  HA   . LEU   A 1 67  ? -1.125  2.295   -4.617  0   64.6   ? 760  LEU   A HA   1 1 
ATOM   871  H  HB2  . LEU   A 1 67  ? -3.139  0.052   -4.459  0   68.32  ? 760  LEU   A HB2  1 1 
ATOM   872  H  HB3  . LEU   A 1 67  ? -1.411  -0.167  -4.14   0   67.84  ? 760  LEU   A HB3  1 1 
ATOM   873  H  HG   . LEU   A 1 67  ? -2.921  1.924   -2.563  0   69.1   ? 760  LEU   A HG   1 1 
ATOM   874  H  HD11 . LEU   A 1 67  ? -3.724  0.52    -1.022  0   72.78  ? 760  LEU   A HD11 1 1 
ATOM   875  H  HD12 . LEU   A 1 67  ? -4.122  -0.349  -2.518  0   72.67  ? 760  LEU   A HD12 1 1 
ATOM   876  H  HD13 . LEU   A 1 67  ? -2.723  -0.87   -1.538  0   73.03  ? 760  LEU   A HD13 1 1 
ATOM   877  H  HD21 . LEU   A 1 67  ? -1.259  1.357   -0.858  0   70.65  ? 760  LEU   A HD21 1 1 
ATOM   878  H  HD22 . LEU   A 1 67  ? -0.543  0.147   -1.952  0   70.75  ? 760  LEU   A HD22 1 1 
ATOM   879  H  HD23 . LEU   A 1 67  ? -0.486  1.88    -2.374  0   68.77  ? 760  LEU   A HD23 1 1 
ATOM   880  N  N    . ASP   A 1 68  ? -2.177  0.977   -7.419  1   55.42  ? 761  ASP   A N    1 1 
ATOM   881  C  CA   . ASP   A 1 68  ? -1.688  0.579   -8.74   1   55.1   ? 761  ASP   A CA   1 1 
ATOM   882  C  C    . ASP   A 1 68  ? -0.789  1.691   -9.306  1   54.3   ? 761  ASP   A C    1 1 
ATOM   883  O  O    . ASP   A 1 68  ? 0.234   1.396   -9.92   1   54.44  ? 761  ASP   A O    1 1 
ATOM   884  C  CB   . ASP   A 1 68  ? -2.853  0.338   -9.717  1   56.91  ? 761  ASP   A CB   1 1 
ATOM   885  C  CG   . ASP   A 1 68  ? -3.669  -0.909  -9.453  1   61.65  ? 761  ASP   A CG   1 1 
ATOM   886  O  OD1  . ASP   A 1 68  ? -3.142  -1.839  -8.803  1   62.39  ? 761  ASP   A OD1  1 1 
ATOM   887  O  OD2  . ASP   A 1 68  ? -4.835  -0.957  -9.9    1   63.99  ? 761  ASP   A OD2  1 1 
ATOM   888  H  H    . ASP   A 1 68  ? -3.186  1.077   -7.374  0   63.13  ? 761  ASP   A H    1 1 
ATOM   889  H  HA   . ASP   A 1 68  ? -1.09   -0.327  -8.655  0   62.79  ? 761  ASP   A HA   1 1 
ATOM   890  H  HB2  . ASP   A 1 68  ? -3.529  1.191   -9.68   0   63.65  ? 761  ASP   A HB2  1 1 
ATOM   891  H  HB3  . ASP   A 1 68  ? -2.441  0.249   -10.721 0   63.6   ? 761  ASP   A HB3  1 1 
ATOM   892  N  N    . GLU   A 1 69  ? -1.179  2.964   -9.095  1   53.34  ? 762  GLU   A N    1 1 
ATOM   893  C  CA   . GLU   A 1 69  ? -0.411  4.129   -9.53   1   52.94  ? 762  GLU   A CA   1 1 
ATOM   894  C  C    . GLU   A 1 69  ? 0.944   4.163   -8.815  1   52.53  ? 762  GLU   A C    1 1 
ATOM   895  O  O    . GLU   A 1 69  ? 1.961   4.418   -9.455  1   52.43  ? 762  GLU   A O    1 1 
ATOM   896  C  CB   . GLU   A 1 69  ? -1.208  5.417   -9.257  1   54.56  ? 762  GLU   A CB   1 1 
ATOM   897  C  CG   . GLU   A 1 69  ? -0.597  6.67    -9.854  1   57.69  ? 762  GLU   A CG   1 1 
ATOM   898  C  CD   . GLU   A 1 69  ? -1.518  7.874   -9.884  1   61.68  ? 762  GLU   A CD   1 1 
ATOM   899  O  OE1  . GLU   A 1 69  ? -2.554  7.856   -9.182  1   62.45  ? 762  GLU   A OE1  1 1 
ATOM   900  O  OE2  . GLU   A 1 69  ? -1.203  8.835   -10.621 1   63.19  ? 762  GLU   A OE2  1 1 
ATOM   901  H  H    . GLU   A 1 69  ? -2.047  3.21    -8.629  0   57.79  ? 762  GLU   A H    1 1 
ATOM   902  H  HA   . GLU   A 1 69  ? -0.23   4.058   -10.602 0   55.03  ? 762  GLU   A HA   1 1 
ATOM   903  H  HB2  . GLU   A 1 69  ? -2.201  5.299   -9.69   0   57.06  ? 762  GLU   A HB2  1 1 
ATOM   904  H  HB3  . GLU   A 1 69  ? -1.286  5.562   -8.181  0   57.3   ? 762  GLU   A HB3  1 1 
ATOM   905  H  HG2  . GLU   A 1 69  ? 0.286   6.945   -9.28   0   58.64  ? 762  GLU   A HG2  1 1 
ATOM   906  H  HG3  . GLU   A 1 69  ? -0.321  6.452   -10.884 0   58.15  ? 762  GLU   A HG3  1 1 
ATOM   907  N  N    . ALA   A 1 70  ? 0.961   3.888   -7.501  1   52.25  ? 763  ALA   A N    1 1 
ATOM   908  C  CA   . ALA   A 1 70  ? 2.196   3.845   -6.719  1   52.53  ? 763  ALA   A CA   1 1 
ATOM   909  C  C    . ALA   A 1 70  ? 3.139   2.75    -7.238  1   52.75  ? 763  ALA   A C    1 1 
ATOM   910  O  O    . ALA   A 1 70  ? 4.331   3.006   -7.373  1   52.78  ? 763  ALA   A O    1 1 
ATOM   911  C  CB   . ALA   A 1 70  ? 1.878   3.603   -5.25   1   52.63  ? 763  ALA   A CB   1 1 
ATOM   912  H  H    . ALA   A 1 70  ? 0.132   3.71    -6.943  0   56.45  ? 763  ALA   A H    1 1 
ATOM   913  H  HA   . ALA   A 1 70  ? 2.702   4.804   -6.808  0   55.82  ? 763  ALA   A HA   1 1 
ATOM   914  H  HB1  . ALA   A 1 70  ? 2.811   3.563   -4.689  0   58.13  ? 763  ALA   A HB1  1 1 
ATOM   915  H  HB2  . ALA   A 1 70  ? 1.258   4.416   -4.878  0   57.48  ? 763  ALA   A HB2  1 1 
ATOM   916  H  HB3  . ALA   A 1 70  ? 1.347   2.657   -5.156  0   58.54  ? 763  ALA   A HB3  1 1 
ATOM   917  N  N    . TYR   A 1 71  ? 2.609   1.545   -7.535  1   52.81  ? 764  TYR   A N    1 1 
ATOM   918  C  CA   . TYR   A 1 71  ? 3.404   0.432   -8.069  1   53.4   ? 764  TYR   A CA   1 1 
ATOM   919  C  C    . TYR   A 1 71  ? 4.041   0.816   -9.408  1   53.21  ? 764  TYR   A C    1 1 
ATOM   920  O  O    . TYR   A 1 71  ? 5.23    0.58    -9.605  1   53.27  ? 764  TYR   A O    1 1 
ATOM   921  C  CB   . TYR   A 1 71  ? 2.537   -0.848  -8.196  1   53.97  ? 764  TYR   A CB   1 1 
ATOM   922  C  CG   . TYR   A 1 71  ? 3.049   -1.887  -9.178  1   55.39  ? 764  TYR   A CG   1 1 
ATOM   923  C  CD1  . TYR   A 1 71  ? 4.157   -2.667  -8.881  1   56.6   ? 764  TYR   A CD1  1 1 
ATOM   924  C  CD2  . TYR   A 1 71  ? 2.414   -2.095  -10.395 1   56.48  ? 764  TYR   A CD2  1 1 
ATOM   925  C  CE1  . TYR   A 1 71  ? 4.616   -3.636  -9.766  1   57.63  ? 764  TYR   A CE1  1 1 
ATOM   926  C  CE2  . TYR   A 1 71  ? 2.881   -3.04   -11.3   1   57.49  ? 764  TYR   A CE2  1 1 
ATOM   927  C  CZ   . TYR   A 1 71  ? 3.989   -3.805  -10.985 1   58.59  ? 764  TYR   A CZ   1 1 
ATOM   928  O  OH   . TYR   A 1 71  ? 4.458   -4.759  -11.861 1   60.22  ? 764  TYR   A OH   1 1 
ATOM   929  H  H    . TYR   A 1 71  ? 1.632   1.314   -7.392  0   58.56  ? 764  TYR   A H    1 1 
ATOM   930  H  HA   . TYR   A 1 71  ? 4.21    0.217   -7.368  0   60.66  ? 764  TYR   A HA   1 1 
ATOM   931  H  HB2  . TYR   A 1 71  ? 2.503   -1.319  -7.216  0   62.92  ? 764  TYR   A HB2  1 1 
ATOM   932  H  HB3  . TYR   A 1 71  ? 1.531   -0.575  -8.511  0   61.38  ? 764  TYR   A HB3  1 1 
ATOM   933  H  HD1  . TYR   A 1 71  ? 4.656   -2.538  -7.936  0   67.37  ? 764  TYR   A HD1  1 1 
ATOM   934  H  HD2  . TYR   A 1 71  ? 1.559   -1.496  -10.657 0   64.41  ? 764  TYR   A HD2  1 1 
ATOM   935  H  HE1  . TYR   A 1 71  ? 5.482   -4.226  -9.519  0   70.91  ? 764  TYR   A HE1  1 1 
ATOM   936  H  HE2  . TYR   A 1 71  ? 2.375   -3.172  -12.242 0   67.54  ? 764  TYR   A HE2  1 1 
ATOM   937  H  HH   . TYR   A 1 71  ? 4.061   -4.636  -12.763 0   72.6   ? 764  TYR   A HH   1 1 
ATOM   938  N  N    . VAL   A 1 72  ? 3.25    1.384   -10.323 1   52.82  ? 765  VAL   A N    1 1 
ATOM   939  C  CA   . VAL   A 1 72  ? 3.736   1.809   -11.638 1   53.01  ? 765  VAL   A CA   1 1 
ATOM   940  C  C    . VAL   A 1 72  ? 4.863   2.856   -11.488 1   52.75  ? 765  VAL   A C    1 1 
ATOM   941  O  O    . VAL   A 1 72  ? 5.898   2.734   -12.147 1   52.89  ? 765  VAL   A O    1 1 
ATOM   942  C  CB   . VAL   A 1 72  ? 2.551   2.316   -12.543 1   54.02  ? 765  VAL   A CB   1 1 
ATOM   943  C  CG1  . VAL   A 1 72  ? 3.034   3.26    -13.645 1   54.74  ? 765  VAL   A CG1  1 1 
ATOM   944  C  CG2  . VAL   A 1 72  ? 1.773   1.143   -13.151 1   54.62  ? 765  VAL   A CG2  1 1 
ATOM   945  H  H    . VAL   A 1 72  ? 2.259   1.549   -10.18  0   57.1   ? 765  VAL   A H    1 1 
ATOM   946  H  HA   . VAL   A 1 72  ? 4.191   0.936   -12.105 0   57.79  ? 765  VAL   A HA   1 1 
ATOM   947  H  HB   . VAL   A 1 72  ? 1.844   2.892   -11.946 0   56.66  ? 765  VAL   A HB   1 1 
ATOM   948  H  HG11 . VAL   A 1 72  ? 2.246   3.375   -14.387 0   55.76  ? 765  VAL   A HG11 1 1 
ATOM   949  H  HG12 . VAL   A 1 72  ? 3.249   4.236   -13.212 0   55.71  ? 765  VAL   A HG12 1 1 
ATOM   950  H  HG13 . VAL   A 1 72  ? 3.936   2.851   -14.099 0   56.56  ? 765  VAL   A HG13 1 1 
ATOM   951  H  HG21 . VAL   A 1 72  ? 0.916   1.525   -13.704 0   58.02  ? 765  VAL   A HG21 1 1 
ATOM   952  H  HG22 . VAL   A 1 72  ? 2.434   0.601   -13.826 0   59.04  ? 765  VAL   A HG22 1 1 
ATOM   953  H  HG23 . VAL   A 1 72  ? 1.437   0.486   -12.351 0   59.66  ? 765  VAL   A HG23 1 1 
ATOM   954  N  N    . MET   A 1 73  ? 4.667   3.873   -10.636 1   52.25  ? 766  MET   A N    1 1 
ATOM   955  C  CA   . MET   A 1 73  ? 5.677   4.92    -10.455 1   52.27  ? 766  MET   A CA   1 1 
ATOM   956  C  C    . MET   A 1 73  ? 6.948   4.382   -9.795  1   52.19  ? 766  MET   A C    1 1 
ATOM   957  O  O    . MET   A 1 73  ? 8.041   4.806   -10.162 1   52.31  ? 766  MET   A O    1 1 
ATOM   958  C  CB   . MET   A 1 73  ? 5.111   6.104   -9.652  1   52.67  ? 766  MET   A CB   1 1 
ATOM   959  C  CG   . MET   A 1 73  ? 4.081   6.914   -10.417 1   54.3   ? 766  MET   A CG   1 1 
ATOM   960  S  SD   . MET   A 1 73  ? 3.365   8.263   -9.46   1   56.83  ? 766  MET   A SD   1 1 
ATOM   961  C  CE   . MET   A 1 73  ? 4.626   9.511   -9.667  1   55.63  ? 766  MET   A CE   1 1 
ATOM   962  H  H    . MET   A 1 73  ? 3.842   3.978   -10.053 0   54.74  ? 766  MET   A H    1 1 
ATOM   963  H  HA   . MET   A 1 73  ? 5.955   5.294   -11.439 0   53.74  ? 766  MET   A HA   1 1 
ATOM   964  H  HB2  . MET   A 1 73  ? 4.643   5.732   -8.742  0   54.7   ? 766  MET   A HB2  1 1 
ATOM   965  H  HB3  . MET   A 1 73  ? 5.937   6.765   -9.395  0   54.35  ? 766  MET   A HB3  1 1 
ATOM   966  H  HG2  . MET   A 1 73  ? 4.557   7.345   -11.296 0   54.2   ? 766  MET   A HG2  1 1 
ATOM   967  H  HG3  . MET   A 1 73  ? 3.268   6.257   -10.723 0   54.69  ? 766  MET   A HG3  1 1 
ATOM   968  H  HE1  . MET   A 1 73  ? 4.296   10.428  -9.181  0   55.98  ? 766  MET   A HE1  1 1 
ATOM   969  H  HE2  . MET   A 1 73  ? 5.552   9.163   -9.213  0   56.46  ? 766  MET   A HE2  1 1 
ATOM   970  H  HE3  . MET   A 1 73  ? 4.776   9.689   -10.73  0   55.23  ? 766  MET   A HE3  1 1 
ATOM   971  N  N    . ALA   A 1 74  ? 6.817   3.444   -8.845  1   51.98  ? 767  ALA   A N    1 1 
ATOM   972  C  CA   . ALA   A 1 74  ? 7.972   2.851   -8.175  1   52.22  ? 767  ALA   A CA   1 1 
ATOM   973  C  C    . ALA   A 1 74  ? 8.734   1.874   -9.079  1   52.39  ? 767  ALA   A C    1 1 
ATOM   974  O  O    . ALA   A 1 74  ? 9.939   1.717   -8.911  1   52.31  ? 767  ALA   A O    1 1 
ATOM   975  C  CB   . ALA   A 1 74  ? 7.524   2.143   -6.915  1   52.4   ? 767  ALA   A CB   1 1 
ATOM   976  H  H    . ALA   A 1 74  ? 5.931   3.083   -8.507  0   56.45  ? 767  ALA   A H    1 1 
ATOM   977  H  HA   . ALA   A 1 74  ? 8.654   3.641   -7.869  0   58.25  ? 767  ALA   A HA   1 1 
ATOM   978  H  HB1  . ALA   A 1 74  ? 8.394   1.759   -6.385  0   60.77  ? 767  ALA   A HB1  1 1 
ATOM   979  H  HB2  . ALA   A 1 74  ? 6.993   2.87    -6.302  0   58.89  ? 767  ALA   A HB2  1 1 
ATOM   980  H  HB3  . ALA   A 1 74  ? 6.853   1.329   -7.185  0   59.68  ? 767  ALA   A HB3  1 1 
ATOM   981  N  N    . SER   A 1 75  ? 8.038   1.206   -10.015 1   52.5   ? 768  SER   A N    1 1 
ATOM   982  C  CA   . SER   A 1 75  ? 8.669   0.268   -10.945 1   53.2   ? 768  SER   A CA   1 1 
ATOM   983  C  C    . SER   A 1 75  ? 9.608   0.981   -11.922 1   53.74  ? 768  SER   A C    1 1 
ATOM   984  O  O    . SER   A 1 75  ? 10.67   0.448   -12.24  1   53.92  ? 768  SER   A O    1 1 
ATOM   985  C  CB   . SER   A 1 75  ? 7.609   -0.489  -11.739 1   54.45  ? 768  SER   A CB   1 1 
ATOM   986  O  OG   . SER   A 1 75  ? 6.65    -1.09   -10.885 1   56.65  ? 768  SER   A OG   1 1 
ATOM   987  H  H    . SER   A 1 75  ? 7.034   1.273   -10.144 0   58.65  ? 768  SER   A H    1 1 
ATOM   988  H  HA   . SER   A 1 75  ? 9.254   -0.456  -10.38  0   63.08  ? 768  SER   A HA   1 1 
ATOM   989  H  HB2  . SER   A 1 75  ? 7.103   0.207   -12.407 0   61.27  ? 768  SER   A HB2  1 1 
ATOM   990  H  HB3  . SER   A 1 75  ? 8.097   -1.269  -12.321 0   63.98  ? 768  SER   A HB3  1 1 
ATOM   991  H  HG   . SER   A 1 75  ? 5.917   -0.451  -10.683 0   64.1   ? 768  SER   A HG   1 1 
ATOM   992  N  N    . VAL   A 1 76  ? 9.219   2.182   -12.389 1   53.9   ? 769  VAL   A N    1 1 
ATOM   993  C  CA   . VAL   A 1 76  ? 10.012  2.97    -13.346 1   54.57  ? 769  VAL   A CA   1 1 
ATOM   994  C  C    . VAL   A 1 76  ? 10.855  4.075   -12.664 1   55.02  ? 769  VAL   A C    1 1 
ATOM   995  O  O    . VAL   A 1 76  ? 11.319  4.988   -13.348 1   55.25  ? 769  VAL   A O    1 1 
ATOM   996  C  CB   . VAL   A 1 76  ? 9.128   3.54    -14.501 1   55.35  ? 769  VAL   A CB   1 1 
ATOM   997  C  CG1  . VAL   A 1 76  ? 8.326   2.429   -15.17  1   55.95  ? 769  VAL   A CG1  1 1 
ATOM   998  C  CG2  . VAL   A 1 76  ? 8.2     4.669   -14.033 1   55.81  ? 769  VAL   A CG2  1 1 
ATOM   999  H  H    . VAL   A 1 76  ? 8.358   2.63    -12.096 0   58.91  ? 769  VAL   A H    1 1 
ATOM   1000 H  HA   . VAL   A 1 76  ? 10.726  2.308   -13.834 0   61.76  ? 769  VAL   A HA   1 1 
ATOM   1001 H  HB   . VAL   A 1 76  ? 9.785   3.959   -15.262 0   59.61  ? 769  VAL   A HB   1 1 
ATOM   1002 H  HG11 . VAL   A 1 76  ? 7.948   2.797   -16.123 0   59.31  ? 769  VAL   A HG11 1 1 
ATOM   1003 H  HG12 . VAL   A 1 76  ? 8.975   1.568   -15.331 0   61.73  ? 769  VAL   A HG12 1 1 
ATOM   1004 H  HG13 . VAL   A 1 76  ? 7.491   2.154   -14.527 0   60.52  ? 769  VAL   A HG13 1 1 
ATOM   1005 H  HG21 . VAL   A 1 76  ? 7.476   4.873   -14.821 0   57.37  ? 769  VAL   A HG21 1 1 
ATOM   1006 H  HG22 . VAL   A 1 76  ? 7.676   4.37    -13.126 0   58.34  ? 769  VAL   A HG22 1 1 
ATOM   1007 H  HG23 . VAL   A 1 76  ? 8.785   5.568   -13.845 0   58.34  ? 769  VAL   A HG23 1 1 
ATOM   1008 N  N    . ASP   A 1 77  ? 11.141  3.954   -11.357 1   54.99  ? 770  ASP   A N    1 1 
ATOM   1009 C  CA   . ASP   A 1 77  ? 11.901  4.964   -10.582 1   55.4   ? 770  ASP   A CA   1 1 
ATOM   1010 C  C    . ASP   A 1 77  ? 13.413  4.857   -10.785 1   55.41  ? 770  ASP   A C    1 1 
ATOM   1011 O  O    . ASP   A 1 77  ? 14.093  5.877   -10.716 1   55.7   ? 770  ASP   A O    1 1 
ATOM   1012 C  CB   . ASP   A 1 77  ? 11.458  4.717   -9.118  1   57.24  ? 770  ASP   A CB   1 1 
ATOM   1013 C  CG   . ASP   A 1 77  ? 11.794  5.986   -8.332  1   62.1   ? 770  ASP   A CG   1 1 
ATOM   1014 O  OD1  . ASP   A 1 77  ? 12.984  6.191   -8.013  1   62.91  ? 770  ASP   A OD1  1 1 
ATOM   1015 O  OD2  . ASP   A 1 77  ? 10.86   6.757   -8.028  1   64.59  ? 770  ASP   A OD2  1 1 
ATOM   1016 H  H    . ASP   A 1 77  ? 10.923  3.1     -10.853 0   62.27  ? 770  ASP   A H    1 1 
ATOM   1017 H  HA   . ASP   A 1 77  ? 11.586  5.95    -10.92  0   61.53  ? 770  ASP   A HA   1 1 
ATOM   1018 H  HB2  . ASP   A 1 77  ? 10.385  4.541   -9.093  0   63.74  ? 770  ASP   A HB2  1 1 
ATOM   1019 H  HB3  . ASP   A 1 77  ? 11.997  3.862   -8.711  0   66.19  ? 770  ASP   A HB3  1 1 
ATOM   1020 N  N    . ASN   A 1 78  A 13.943  3.641   -11.004 1   55.02  ? 770  ASN   A N    1 1 
ATOM   1021 C  CA   . ASN   A 1 78  A 15.357  3.336   -11.252 1   55.16  ? 770  ASN   A CA   1 1 
ATOM   1022 C  C    . ASN   A 1 78  A 15.5    2.943   -12.729 1   54.64  ? 770  ASN   A C    1 1 
ATOM   1023 O  O    . ASN   A 1 78  A 14.815  1.996   -13.113 1   54.91  ? 770  ASN   A O    1 1 
ATOM   1024 C  CB   . ASN   A 1 78  A 15.622  2.118   -10.336 1   56.78  ? 770  ASN   A CB   1 1 
ATOM   1025 C  CG   . ASN   A 1 78  A 15.753  2.658   -8.906  1   60.64  ? 770  ASN   A CG   1 1 
ATOM   1026 O  OD1  . ASN   A 1 78  A 16.855  2.987   -8.451  1   62.06  ? 770  ASN   A OD1  1 1 
ATOM   1027 N  ND2  . ASN   A 1 78  A 14.646  2.736   -8.173  1   61.4   ? 770  ASN   A ND2  1 1 
ATOM   1028 H  H    . ASN   A 1 78  A 13.37   2.804   -11.028 0   65.77  ? 770  ASN   A H    1 1 
ATOM   1029 H  HA   . ASN   A 1 78  A 16.002  4.177   -10.999 0   68.89  ? 770  ASN   A HA   1 1 
ATOM   1030 H  HB2  . ASN   A 1 78  A 14.814  1.391   -10.404 0   71.34  ? 770  ASN   A HB2  1 1 
ATOM   1031 H  HB3  . ASN   A 1 78  A 16.558  1.653   -10.64  0   73.96  ? 770  ASN   A HB3  1 1 
ATOM   1032 H  HD21 . ASN   A 1 78  A 14.693  3.089   -7.223  0   75.6   ? 770  ASN   A HD21 1 1 
ATOM   1033 H  HD22 . ASN   A 1 78  A 13.754  2.449   -8.563  0   74     ? 770  ASN   A HD22 1 1 
ATOM   1034 N  N    . PRO   A 1 79  B 16.315  3.612   -13.594 1   53.65  ? 770  PRO   A N    1 1 
ATOM   1035 C  CA   . PRO   A 1 79  B 17.215  4.758   -13.334 1   52.96  ? 770  PRO   A CA   1 1 
ATOM   1036 C  C    . PRO   A 1 79  B 16.519  6.08    -13.01  1   51.96  ? 770  PRO   A C    1 1 
ATOM   1037 O  O    . PRO   A 1 79  B 16.977  6.809   -12.133 1   52.02  ? 770  PRO   A O    1 1 
ATOM   1038 C  CB   . PRO   A 1 79  B 18.031  4.885   -14.637 1   53.84  ? 770  PRO   A CB   1 1 
ATOM   1039 C  CG   . PRO   A 1 79  B 17.733  3.665   -15.453 1   54.47  ? 770  PRO   A CG   1 1 
ATOM   1040 C  CD   . PRO   A 1 79  B 16.392  3.188   -15.007 1   53.03  ? 770  PRO   A CD   1 1 
ATOM   1041 H  HA   . PRO   A 1 79  B 17.902  4.516   -12.524 0   69.12  ? 770  PRO   A HA   1 1 
ATOM   1042 H  HB2  . PRO   A 1 79  B 17.724  5.782   -15.172 0   68.14  ? 770  PRO   A HB2  1 1 
ATOM   1043 H  HB3  . PRO   A 1 79  B 19.092  4.931   -14.396 0   71.69  ? 770  PRO   A HB3  1 1 
ATOM   1044 H  HG2  . PRO   A 1 79  B 17.711  3.93    -16.509 0   70.03  ? 770  PRO   A HG2  1 1 
ATOM   1045 H  HG3  . PRO   A 1 79  B 18.491  2.907   -15.265 0   72.78  ? 770  PRO   A HG3  1 1 
ATOM   1046 H  HD2  . PRO   A 1 79  B 15.602  3.661   -15.587 0   65.13  ? 770  PRO   A HD2  1 1 
ATOM   1047 H  HD3  . PRO   A 1 79  B 16.353  2.103   -15.097 0   68.06  ? 770  PRO   A HD3  1 1 
ATOM   1048 N  N    . GLY   A 1 80  C 15.433  6.381   -13.716 1   50.8   ? 770  GLY   A N    1 1 
ATOM   1049 C  CA   . GLY   A 1 80  C 14.64   7.595   -13.598 1   50.01  ? 770  GLY   A CA   1 1 
ATOM   1050 C  C    . GLY   A 1 80  C 14.98   8.586   -14.69  1   48.74  ? 770  GLY   A C    1 1 
ATOM   1051 O  O    . GLY   A 1 80  C 16.076  8.54    -15.257 1   48.8   ? 770  GLY   A O    1 1 
ATOM   1052 H  H    . GLY   A 1 80  C 15.058  5.769   -14.434 0   60.55  ? 770  GLY   A H    1 1 
ATOM   1053 H  HA2  . GLY   A 1 80  C 13.583  7.344   -13.682 0   56.83  ? 770  GLY   A HA2  1 1 
ATOM   1054 H  HA3  . GLY   A 1 80  C 14.802  8.07    -12.631 0   58.79  ? 770  GLY   A HA3  1 1 
ATOM   1055 N  N    . ASN   A 1 81  ? 14.039  9.486   -14.995 1   47.38  ? 771  ASN   A N    1 1 
ATOM   1056 C  CA   . ASN   A 1 81  ? 14.217  10.494  -16.039 1   46.55  ? 771  ASN   A CA   1 1 
ATOM   1057 C  C    . ASN   A 1 81  ? 13.904  11.895  -15.476 1   45.5   ? 771  ASN   A C    1 1 
ATOM   1058 O  O    . ASN   A 1 81  ? 12.948  12.006  -14.703 1   45.51  ? 771  ASN   A O    1 1 
ATOM   1059 C  CB   . ASN   A 1 81  ? 13.281  10.186  -17.207 1   47.33  ? 771  ASN   A CB   1 1 
ATOM   1060 C  CG   . ASN   A 1 81  ? 13.515  11.04   -18.423 1   49.74  ? 771  ASN   A CG   1 1 
ATOM   1061 O  OD1  . ASN   A 1 81  ? 12.863  12.067  -18.615 1   50.76  ? 771  ASN   A OD1  1 1 
ATOM   1062 N  ND2  . ASN   A 1 81  ? 14.459  10.652  -19.267 1   50.24  ? 771  ASN   A ND2  1 1 
ATOM   1063 H  H    . ASN   A 1 81  ? 13.138  9.543   -14.531 0   52.44  ? 771  ASN   A H    1 1 
ATOM   1064 H  HA   . ASN   A 1 81  ? 15.235  10.443  -16.419 0   54.02  ? 771  ASN   A HA   1 1 
ATOM   1065 H  HB2  . ASN   A 1 81  ? 13.41   9.143   -17.494 0   52.13  ? 771  ASN   A HB2  1 1 
ATOM   1066 H  HB3  . ASN   A 1 81  ? 12.254  10.35   -16.883 0   50.33  ? 771  ASN   A HB3  1 1 
ATOM   1067 H  HD21 . ASN   A 1 81  ? 14.646  11.204  -20.098 0   55.73  ? 771  ASN   A HD21 1 1 
ATOM   1068 H  HD22 . ASN   A 1 81  ? 15      9.812   -19.09  0   56.85  ? 771  ASN   A HD22 1 1 
ATOM   1069 N  N    . PRO   A 1 82  ? 14.634  12.983  -15.843 1   44.41  ? 772  PRO   A N    1 1 
ATOM   1070 C  CA   . PRO   A 1 82  ? 14.266  14.306  -15.306 1   43.82  ? 772  PRO   A CA   1 1 
ATOM   1071 C  C    . PRO   A 1 82  ? 12.89   14.818  -15.733 1   43.2   ? 772  PRO   A C    1 1 
ATOM   1072 O  O    . PRO   A 1 82  ? 12.362  15.705  -15.071 1   43.26  ? 772  PRO   A O    1 1 
ATOM   1073 C  CB   . PRO   A 1 82  ? 15.36   15.241  -15.836 1   44.53  ? 772  PRO   A CB   1 1 
ATOM   1074 C  CG   . PRO   A 1 82  ? 16.4    14.388  -16.406 1   45.04  ? 772  PRO   A CG   1 1 
ATOM   1075 C  CD   . PRO   A 1 82  ? 15.798  13.08   -16.747 1   43.68  ? 772  PRO   A CD   1 1 
ATOM   1076 H  HA   . PRO   A 1 82  ? 14.314  14.293  -14.218 0   50.59  ? 772  PRO   A HA   1 1 
ATOM   1077 H  HB2  . PRO   A 1 82  ? 14.94   15.892  -16.601 0   52.08  ? 772  PRO   A HB2  1 1 
ATOM   1078 H  HB3  . PRO   A 1 82  ? 15.761  15.83   -15.011 0   54.03  ? 772  PRO   A HB3  1 1 
ATOM   1079 H  HG2  . PRO   A 1 82  ? 16.796  14.86   -17.304 0   55.16  ? 772  PRO   A HG2  1 1 
ATOM   1080 H  HG3  . PRO   A 1 82  ? 17.192  14.256  -15.671 0   56.28  ? 772  PRO   A HG3  1 1 
ATOM   1081 H  HD2  . PRO   A 1 82  ? 15.479  13.067  -17.788 0   50.96  ? 772  PRO   A HD2  1 1 
ATOM   1082 H  HD3  . PRO   A 1 82  ? 16.539  12.308  -16.544 0   53.02  ? 772  PRO   A HD3  1 1 
ATOM   1083 N  N    . HIS   A 1 83  ? 12.318  14.291  -16.83  1   42.43  ? 773  HIS   A N    1 1 
ATOM   1084 C  CA   . HIS   A 1 83  ? 11.021  14.743  -17.338 1   42.26  ? 773  HIS   A CA   1 1 
ATOM   1085 C  C    . HIS   A 1 83  ? 9.885   13.759  -17.03  1   42.22  ? 773  HIS   A C    1 1 
ATOM   1086 O  O    . HIS   A 1 83  ? 8.889   13.737  -17.751 1   42.08  ? 773  HIS   A O    1 1 
ATOM   1087 C  CB   . HIS   A 1 83  ? 11.119  15.015  -18.85  1   42.62  ? 773  HIS   A CB   1 1 
ATOM   1088 C  CG   . HIS   A 1 83  ? 12.342  15.797  -19.224 1   43.9   ? 773  HIS   A CG   1 1 
ATOM   1089 N  ND1  . HIS   A 1 83  ? 12.552  17.077  -18.747 1   45.45  ? 773  HIS   A ND1  1 1 
ATOM   1090 C  CD2  . HIS   A 1 83  ? 13.42   15.42   -19.948 1   44.78  ? 773  HIS   A CD2  1 1 
ATOM   1091 C  CE1  . HIS   A 1 83  ? 13.737  17.445  -19.204 1   45.89  ? 773  HIS   A CE1  1 1 
ATOM   1092 N  NE2  . HIS   A 1 83  ? 14.291  16.484  -19.945 1   45.8   ? 773  HIS   A NE2  1 1 
ATOM   1093 H  H    . HIS   A 1 83  ? 12.724  13.553  -17.397 0   45.75  ? 773  HIS   A H    1 1 
ATOM   1094 H  HA   . HIS   A 1 83  ? 10.752  15.691  -16.875 0   44     ? 773  HIS   A HA   1 1 
ATOM   1095 H  HB2  . HIS   A 1 83  ? 11.151  14.064  -19.379 0   43.47  ? 773  HIS   A HB2  1 1 
ATOM   1096 H  HB3  . HIS   A 1 83  ? 10.247  15.587  -19.165 0   42.92  ? 773  HIS   A HB3  1 1 
ATOM   1097 H  HD1  . HIS   A 1 83  ? 11.925  17.625  -18.167 0   48.96  ? 773  HIS   A HD1  1 1 
ATOM   1098 H  HD2  . HIS   A 1 83  ? 13.569  14.471  -20.435 0   48.59  ? 773  HIS   A HD2  1 1 
ATOM   1099 H  HE1  . HIS   A 1 83  ? 14.196  18.399  -19.004 0   52.69  ? 773  HIS   A HE1  1 1 
ATOM   1100 N  N    . VAL   A 1 84  ? 10.015  12.979  -15.942 1   42.19  ? 774  VAL   A N    1 1 
ATOM   1101 C  CA   . VAL   A 1 84  ? 9.015   12.011  -15.482 1   42.66  ? 774  VAL   A CA   1 1 
ATOM   1102 C  C    . VAL   A 1 84  ? 8.921   12.183  -13.968 1   43.25  ? 774  VAL   A C    1 1 
ATOM   1103 O  O    . VAL   A 1 84  ? 9.952   12.121  -13.298 1   43.34  ? 774  VAL   A O    1 1 
ATOM   1104 C  CB   . VAL   A 1 84  ? 9.413   10.549  -15.836 1   43.26  ? 774  VAL   A CB   1 1 
ATOM   1105 C  CG1  . VAL   A 1 84  ? 8.472   9.541   -15.171 1   43.73  ? 774  VAL   A CG1  1 1 
ATOM   1106 C  CG2  . VAL   A 1 84  ? 9.456   10.33   -17.346 1   43.68  ? 774  VAL   A CG2  1 1 
ATOM   1107 H  H    . VAL   A 1 84  ? 10.826  12.999  -15.332 0   43.89  ? 774  VAL   A H    1 1 
ATOM   1108 H  HA   . VAL   A 1 84  ? 8.04    12.219  -15.92  0   41.49  ? 774  VAL   A HA   1 1 
ATOM   1109 H  HB   . VAL   A 1 84  ? 10.414  10.362  -15.449 0   44.54  ? 774  VAL   A HB   1 1 
ATOM   1110 H  HG11 . VAL   A 1 84  ? 8.587   8.569   -15.647 0   43.97  ? 774  VAL   A HG11 1 1 
ATOM   1111 H  HG12 . VAL   A 1 84  ? 8.73    9.446   -14.117 0   43.87  ? 774  VAL   A HG12 1 1 
ATOM   1112 H  HG13 . VAL   A 1 84  ? 7.446   9.891   -15.274 0   42.56  ? 774  VAL   A HG13 1 1 
ATOM   1113 H  HG21 . VAL   A 1 84  ? 9.733   9.297   -17.55  0   43.96  ? 774  VAL   A HG21 1 1 
ATOM   1114 H  HG22 . VAL   A 1 84  ? 8.471   10.539  -17.762 0   42.43  ? 774  VAL   A HG22 1 1 
ATOM   1115 H  HG23 . VAL   A 1 84  ? 10.194  10.999  -17.786 0   43.93  ? 774  VAL   A HG23 1 1 
ATOM   1116 N  N    . CYS   A 1 85  ? 7.716   12.413  -13.424 1   43.53  ? 775  CYS   A N    1 1 
ATOM   1117 C  CA   . CYS   A 1 85  ? 7.549   12.558  -11.977 1   44.44  ? 775  CYS   A CA   1 1 
ATOM   1118 C  C    . CYS   A 1 85  ? 7.88    11.246  -11.283 1   44.99  ? 775  CYS   A C    1 1 
ATOM   1119 O  O    . CYS   A 1 85  ? 7.456   10.185  -11.745 1   45.08  ? 775  CYS   A O    1 1 
ATOM   1120 C  CB   . CYS   A 1 85  ? 6.136   13.013  -11.624 1   45.45  ? 775  CYS   A CB   1 1 
ATOM   1121 S  SG   . CYS   A 1 85  ? 5.845   14.781  -11.865 1   49.52  ? 775  CYS   A SG   1 1 
ATOM   1122 H  H    . CYS   A 1 85  ? 6.857   12.505  -13.957 0   42.43  ? 775  CYS   A H    1 1 
ATOM   1123 H  HA   . CYS   A 1 85  ? 8.24    13.322  -11.624 0   45.65  ? 775  CYS   A HA   1 1 
ATOM   1124 H  HB2  . CYS   A 1 85  ? 5.412   12.465  -12.224 0   44.51  ? 775  CYS   A HB2  1 1 
ATOM   1125 H  HB3  . CYS   A 1 85  ? 5.966   12.801  -10.569 0   45.76  ? 775  CYS   A HB3  1 1 
ATOM   1126 H  HG   . CYS   A 1 85  ? 5.037   15.171  -10.873 0   50.17  ? 775  CYS   A HG   1 1 
ATOM   1127 N  N    . ARG   A 1 86  ? 8.609   11.319  -10.163 1   45.26  ? 776  ARG   A N    1 1 
ATOM   1128 C  CA   . ARG   A 1 86  ? 8.98    10.129  -9.402  1   46.04  ? 776  ARG   A CA   1 1 
ATOM   1129 C  C    . ARG   A 1 86  ? 8.351   10.169  -8.012  1   46.39  ? 776  ARG   A C    1 1 
ATOM   1130 O  O    . ARG   A 1 86  ? 8.265   11.228  -7.393  1   46.43  ? 776  ARG   A O    1 1 
ATOM   1131 C  CB   . ARG   A 1 86  ? 10.509  9.918   -9.364  1   47.62  ? 776  ARG   A CB   1 1 
ATOM   1132 C  CG   . ARG   A 1 86  ? 11.335  11.014  -8.678  1   51.2   ? 776  ARG   A CG   1 1 
ATOM   1133 C  CD   . ARG   A 1 86  ? 12.664  11.264  -9.38   1   54.74  ? 776  ARG   A CD   1 1 
ATOM   1134 N  NE   . ARG   A 1 86  ? 13.517  10.072  -9.381  1   57.85  ? 776  ARG   A NE   1 1 
ATOM   1135 C  CZ   . ARG   A 1 86  ? 14.563  9.869   -10.182 1   60.08  ? 776  ARG   A CZ   1 1 
ATOM   1136 N  NH1  . ARG   A 1 86  ? 15.267  8.746   -10.092 1   59.84  ? 776  ARG   A NH1  1 1 
ATOM   1137 N  NH2  . ARG   A 1 86  ? 14.908  10.783  -11.087 1   59.95  ? 776  ARG   A NH2  1 1 
ATOM   1138 H  H    . ARG   A 1 86  ? 8.916   12.192  -9.747  0   47.92  ? 776  ARG   A H    1 1 
ATOM   1139 H  HA   . ARG   A 1 86  ? 8.577   9.248   -9.898  0   48.32  ? 776  ARG   A HA   1 1 
ATOM   1140 H  HB2  . ARG   A 1 86  ? 10.707  8.991   -8.828  0   52.54  ? 776  ARG   A HB2  1 1 
ATOM   1141 H  HB3  . ARG   A 1 86  ? 10.848  9.812   -10.394 0   51.68  ? 776  ARG   A HB3  1 1 
ATOM   1142 H  HG2  . ARG   A 1 86  ? 10.777  11.949  -8.671  0   56.26  ? 776  ARG   A HG2  1 1 
ATOM   1143 H  HG3  . ARG   A 1 86  ? 11.55   10.705  -7.657  0   57.66  ? 776  ARG   A HG3  1 1 
ATOM   1144 H  HD2  . ARG   A 1 86  ? 12.445  11.551  -10.408 0   60.67  ? 776  ARG   A HD2  1 1 
ATOM   1145 H  HD3  . ARG   A 1 86  ? 13.195  12.066  -8.87   0   62.62  ? 776  ARG   A HD3  1 1 
ATOM   1146 H  HE   . ARG   A 1 86  ? 13.311  9.347   -8.7    0   65.79  ? 776  ARG   A HE   1 1 
ATOM   1147 H  HH11 . ARG   A 1 86  ? 15.019  8.04    -9.407  0   70.22  ? 776  ARG   A HH11 1 1 
ATOM   1148 H  HH12 . ARG   A 1 86  ? 16.063  8.589   -10.703 0   71.29  ? 776  ARG   A HH12 1 1 
ATOM   1149 H  HH21 . ARG   A 1 86  ? 14.418  11.662  -11.206 0   68.28  ? 776  ARG   A HH21 1 1 
ATOM   1150 H  HH22 . ARG   A 1 86  ? 15.707  10.601  -11.687 0   70.15  ? 776  ARG   A HH22 1 1 
ATOM   1151 N  N    . LEU   A 1 87  ? 7.853   9.017   -7.557  1   46.47  ? 777  LEU   A N    1 1 
ATOM   1152 C  CA   . LEU   A 1 87  ? 7.179   8.894   -6.27   1   47.05  ? 777  LEU   A CA   1 1 
ATOM   1153 C  C    . LEU   A 1 87  ? 8.194   8.841   -5.129  1   47.69  ? 777  LEU   A C    1 1 
ATOM   1154 O  O    . LEU   A 1 87  ? 9.027   7.937   -5.102  1   47.72  ? 777  LEU   A O    1 1 
ATOM   1155 C  CB   . LEU   A 1 87  ? 6.333   7.607   -6.277  1   47.15  ? 777  LEU   A CB   1 1 
ATOM   1156 C  CG   . LEU   A 1 87  ? 5.404   7.369   -5.07   1   48.61  ? 777  LEU   A CG   1 1 
ATOM   1157 C  CD1  . LEU   A 1 87  ? 4.087   8.111   -5.225  1   49.24  ? 777  LEU   A CD1  1 1 
ATOM   1158 C  CD2  . LEU   A 1 87  ? 5.108   5.891   -4.894  1   49.23  ? 777  LEU   A CD2  1 1 
ATOM   1159 H  H    . LEU   A 1 87  ? 7.917   8.138   -8.061  0   49.55  ? 777  LEU   A H    1 1 
ATOM   1160 H  HA   . LEU   A 1 87  ? 6.515   9.744   -6.123  0   50.39  ? 777  LEU   A HA   1 1 
ATOM   1161 H  HB2  . LEU   A 1 87  ? 5.717   7.622   -7.175  0   49.73  ? 777  LEU   A HB2  1 1 
ATOM   1162 H  HB3  . LEU   A 1 87  ? 7.023   6.767   -6.345  0   51.23  ? 777  LEU   A HB3  1 1 
ATOM   1163 H  HG   . LEU   A 1 87  ? 5.875   7.718   -4.153  0   53.38  ? 777  LEU   A HG   1 1 
ATOM   1164 H  HD11 . LEU   A 1 87  ? 3.464   7.899   -4.358  0   53.11  ? 777  LEU   A HD11 1 1 
ATOM   1165 H  HD12 . LEU   A 1 87  ? 4.277   9.181   -5.287  0   52.36  ? 777  LEU   A HD12 1 1 
ATOM   1166 H  HD13 . LEU   A 1 87  ? 3.59    7.768   -6.132  0   51.84  ? 777  LEU   A HD13 1 1 
ATOM   1167 H  HD21 . LEU   A 1 87  ? 4.408   5.759   -4.071  0   54.27  ? 777  LEU   A HD21 1 1 
ATOM   1168 H  HD22 . LEU   A 1 87  ? 4.68    5.506   -5.818  0   53.18  ? 777  LEU   A HD22 1 1 
ATOM   1169 H  HD23 . LEU   A 1 87  ? 6.038   5.37    -4.673  0   54.55  ? 777  LEU   A HD23 1 1 
ATOM   1170 N  N    . LEU   A 1 88  ? 8.128   9.8     -4.187  1   48.05  ? 778  LEU   A N    1 1 
ATOM   1171 C  CA   . LEU   A 1 88  ? 9.014   9.794   -3.019  1   49.02  ? 778  LEU   A CA   1 1 
ATOM   1172 C  C    . LEU   A 1 88  ? 8.572   8.68    -2.054  1   49.87  ? 778  LEU   A C    1 1 
ATOM   1173 O  O    . LEU   A 1 88  ? 9.409   7.953   -1.521  1   49.98  ? 778  LEU   A O    1 1 
ATOM   1174 C  CB   . LEU   A 1 88  ? 9.004   11.154  -2.289  1   49.37  ? 778  LEU   A CB   1 1 
ATOM   1175 C  CG   . LEU   A 1 88  ? 9.68    12.339  -3.003  1   51     ? 778  LEU   A CG   1 1 
ATOM   1176 C  CD1  . LEU   A 1 88  ? 9.24    13.662  -2.398  1   51.64  ? 778  LEU   A CD1  1 1 
ATOM   1177 C  CD2  . LEU   A 1 88  ? 11.204  12.245  -2.941  1   51.66  ? 778  LEU   A CD2  1 1 
ATOM   1178 H  H    . LEU   A 1 88  ? 7.474   10.576  -4.209  0   53.45  ? 778  LEU   A H    1 1 
ATOM   1179 H  HA   . LEU   A 1 88  ? 10.032  9.573   -3.336  0   57.12  ? 778  LEU   A HA   1 1 
ATOM   1180 H  HB2  . LEU   A 1 88  ? 7.966   11.425  -2.099  0   57.1   ? 778  LEU   A HB2  1 1 
ATOM   1181 H  HB3  . LEU   A 1 88  ? 9.512   11.023  -1.334  0   58.94  ? 778  LEU   A HB3  1 1 
ATOM   1182 H  HG   . LEU   A 1 88  ? 9.386   12.336  -4.051  0   58.33  ? 778  LEU   A HG   1 1 
ATOM   1183 H  HD11 . LEU   A 1 88  ? 9.735   14.478  -2.923  0   61.31  ? 778  LEU   A HD11 1 1 
ATOM   1184 H  HD12 . LEU   A 1 88  ? 8.16    13.759  -2.502  0   60.05  ? 778  LEU   A HD12 1 1 
ATOM   1185 H  HD13 . LEU   A 1 88  ? 9.514   13.677  -1.344  0   62.22  ? 778  LEU   A HD13 1 1 
ATOM   1186 H  HD21 . LEU   A 1 88  ? 11.633  13.15   -3.368  0   62.08  ? 778  LEU   A HD21 1 1 
ATOM   1187 H  HD22 . LEU   A 1 88  ? 11.513  12.144  -1.902  0   63.06  ? 778  LEU   A HD22 1 1 
ATOM   1188 H  HD23 . LEU   A 1 88  ? 11.54   11.382  -3.515  0   61.43  ? 778  LEU   A HD23 1 1 
ATOM   1189 N  N    . GLY   A 1 89  ? 7.263   8.557   -1.85   1   50.23  ? 779  GLY   A N    1 1 
ATOM   1190 C  CA   . GLY   A 1 89  ? 6.678   7.528   -1.005  1   51.11  ? 779  GLY   A CA   1 1 
ATOM   1191 C  C    . GLY   A 1 89  ? 5.171   7.664   -0.897  1   51.78  ? 779  GLY   A C    1 1 
ATOM   1192 O  O    . GLY   A 1 89  ? 4.557   8.417   -1.658  1   51.87  ? 779  GLY   A O    1 1 
ATOM   1193 H  H    . GLY   A 1 89  ? 6.565   9.183   -2.239  0   56.67  ? 779  GLY   A H    1 1 
ATOM   1194 H  HA2  . GLY   A 1 89  ? 6.909   6.546   -1.416  0   58.98  ? 779  GLY   A HA2  1 1 
ATOM   1195 H  HA3  . GLY   A 1 89  ? 7.104   7.594   -0.005  0   60.11  ? 779  GLY   A HA3  1 1 
ATOM   1196 N  N    . ILE   A 1 90  ? 4.556   6.92    0.037   1   52.19  ? 780  ILE   A N    1 1 
ATOM   1197 C  CA   . ILE   A 1 90  ? 3.109   6.985   0.285   1   53     ? 780  ILE   A CA   1 1 
ATOM   1198 C  C    . ILE   A 1 90  ? 2.834   7.246   1.774   1   53.58  ? 780  ILE   A C    1 1 
ATOM   1199 O  O    . ILE   A 1 90  ? 3.687   6.979   2.618   1   53.53  ? 780  ILE   A O    1 1 
ATOM   1200 C  CB   . ILE   A 1 90  ? 2.326   5.74    -0.25   1   53.76  ? 780  ILE   A CB   1 1 
ATOM   1201 C  CG1  . ILE   A 1 90  ? 2.633   4.456   0.557   1   54.89  ? 780  ILE   A CG1  1 1 
ATOM   1202 C  CG2  . ILE   A 1 90  ? 2.584   5.535   -1.747  1   54.23  ? 780  ILE   A CG2  1 1 
ATOM   1203 C  CD1  . ILE   A 1 90  ? 1.567   3.345   0.435   1   56.38  ? 780  ILE   A CD1  1 1 
ATOM   1204 H  H    . ILE   A 1 90  ? 5.047   6.275   0.648   0   61.15  ? 780  ILE   A H    1 1 
ATOM   1205 H  HA   . ILE   A 1 90  ? 2.695   7.844   -0.241  0   60.33  ? 780  ILE   A HA   1 1 
ATOM   1206 H  HB   . ILE   A 1 90  ? 1.264   5.95    -0.129  0   61.74  ? 780  ILE   A HB   1 1 
ATOM   1207 H  HG12 . ILE   A 1 90  ? 3.582   4.042   0.219   0   64.09  ? 780  ILE   A HG12 1 1 
ATOM   1208 H  HG13 . ILE   A 1 90  ? 2.696   4.698   1.616   0   64.93  ? 780  ILE   A HG13 1 1 
ATOM   1209 H  HG21 . ILE   A 1 90  ? 1.835   4.859   -2.157  0   60.98  ? 780  ILE   A HG21 1 1 
ATOM   1210 H  HG22 . ILE   A 1 90  ? 2.527   6.499   -2.25   0   60.06  ? 780  ILE   A HG22 1 1 
ATOM   1211 H  HG23 . ILE   A 1 90  ? 3.578   5.111   -1.88   0   60.91  ? 780  ILE   A HG23 1 1 
ATOM   1212 H  HD11 . ILE   A 1 90  ? 1.803   2.55    1.141   0   67.15  ? 780  ILE   A HD11 1 1 
ATOM   1213 H  HD12 . ILE   A 1 90  ? 0.59    3.767   0.665   0   66.28  ? 780  ILE   A HD12 1 1 
ATOM   1214 H  HD13 . ILE   A 1 90  ? 1.57    2.943   -0.578  0   65.36  ? 780  ILE   A HD13 1 1 
ATOM   1215 N  N    . CYS   A 1 91  ? 1.64    7.769   2.087   1   53.9   ? 781  CYS   A N    1 1 
ATOM   1216 C  CA   . CYS   A 1 91  ? 1.225   8.052   3.463   1   54.79  ? 781  CYS   A CA   1 1 
ATOM   1217 C  C    . CYS   A 1 91  ? -0.087  7.323   3.748   1   55.17  ? 781  CYS   A C    1 1 
ATOM   1218 O  O    . CYS   A 1 91  ? -0.976  7.31    2.896   1   55.24  ? 781  CYS   A O    1 1 
ATOM   1219 C  CB   . CYS   A 1 91  ? 1.085   9.555   3.687   1   55.69  ? 781  CYS   A CB   1 1 
ATOM   1220 S  SG   . CYS   A 1 91  ? 0.848   10.023  5.421   1   59.47  ? 781  CYS   A SG   1 1 
ATOM   1221 H  H    . CYS   A 1 91  ? 0.937   8.015   1.398   0   63.01  ? 781  CYS   A H    1 1 
ATOM   1222 H  HA   . CYS   A 1 91  ? 1.968   7.685   4.168   0   66.8   ? 781  CYS   A HA   1 1 
ATOM   1223 H  HB2  . CYS   A 1 91  ? 1.986   10.05   3.328   0   66.94  ? 781  CYS   A HB2  1 1 
ATOM   1224 H  HB3  . CYS   A 1 91  ? 0.22    9.914   3.132   0   66.94  ? 781  CYS   A HB3  1 1 
ATOM   1225 H  HG   . CYS   A 1 91  ? 1.91    9.62    6.127   0   74.04  ? 781  CYS   A HG   1 1 
ATOM   1226 N  N    . LEU   A 1 92  ? -0.209  6.719   4.942   1   55.4   ? 782  LEU   A N    1 1 
ATOM   1227 C  CA   . LEU   A 1 92  ? -1.4    5.963   5.328   1   55.94  ? 782  LEU   A CA   1 1 
ATOM   1228 C  C    . LEU   A 1 92  ? -2.234  6.681   6.394   1   56.54  ? 782  LEU   A C    1 1 
ATOM   1229 O  O    . LEU   A 1 92  ? -2.166  6.339   7.573   1   56.67  ? 782  LEU   A O    1 1 
ATOM   1230 C  CB   . LEU   A 1 92  ? -1.001  4.556   5.815   1   56.17  ? 782  LEU   A CB   1 1 
ATOM   1231 C  CG   . LEU   A 1 92  ? -0.126  3.701   4.876   1   57.59  ? 782  LEU   A CG   1 1 
ATOM   1232 C  CD1  . LEU   A 1 92  ? 0.336   2.447   5.579   1   58.02  ? 782  LEU   A CD1  1 1 
ATOM   1233 C  CD2  . LEU   A 1 92  ? -0.866  3.313   3.596   1   58.34  ? 782  LEU   A CD2  1 1 
ATOM   1234 H  H    . LEU   A 1 92  ? 0.502   6.737   5.666   0   69.44  ? 782  LEU   A H    1 1 
ATOM   1235 H  HA   . LEU   A 1 92  ? -2.059  5.837   4.47    0   69.71  ? 782  LEU   A HA   1 1 
ATOM   1236 H  HB2  . LEU   A 1 92  ? -0.441  4.662   6.743   0   72.26  ? 782  LEU   A HB2  1 1 
ATOM   1237 H  HB3  . LEU   A 1 92  ? -1.914  3.993   6.007   0   72.26  ? 782  LEU   A HB3  1 1 
ATOM   1238 H  HG   . LEU   A 1 92  ? 0.764   4.261   4.595   0   71     ? 782  LEU   A HG   1 1 
ATOM   1239 H  HD11 . LEU   A 1 92  ? 1.038   1.919   4.937   0   73.04  ? 782  LEU   A HD11 1 1 
ATOM   1240 H  HD12 . LEU   A 1 92  ? 0.819   2.728   6.514   0   74.22  ? 782  LEU   A HD12 1 1 
ATOM   1241 H  HD13 . LEU   A 1 92  ? -0.529  1.816   5.781   0   74.48  ? 782  LEU   A HD13 1 1 
ATOM   1242 H  HD21 . LEU   A 1 92  ? -0.285  2.565   3.057   0   71.08  ? 782  LEU   A HD21 1 1 
ATOM   1243 H  HD22 . LEU   A 1 92  ? -1.839  2.904   3.864   0   72.58  ? 782  LEU   A HD22 1 1 
ATOM   1244 H  HD23 . LEU   A 1 92  ? -0.99   4.191   2.964   0   70.72  ? 782  LEU   A HD23 1 1 
ATOM   1245 N  N    . THR   A 1 93  ? -3.06   7.648   5.957   1   56.65  ? 783  THR   A N    1 1 
ATOM   1246 C  CA   . THR   A 1 93  ? -3.998  8.388   6.818   1   57.24  ? 783  THR   A CA   1 1 
ATOM   1247 C  C    . THR   A 1 93  ? -5.376  7.625   6.697   1   57.3   ? 783  THR   A C    1 1 
ATOM   1248 O  O    . THR   A 1 93  ? -5.349  6.413   6.475   1   57.45  ? 783  THR   A O    1 1 
ATOM   1249 C  CB   . THR   A 1 93  ? -4.01   9.891   6.39    1   58.81  ? 783  THR   A CB   1 1 
ATOM   1250 O  OG1  . THR   A 1 93  ? -4.576  10.006  5.083   1   60.02  ? 783  THR   A OG1  1 1 
ATOM   1251 C  CG2  . THR   A 1 93  ? -2.645  10.535  6.428   1   59.31  ? 783  THR   A CG2  1 1 
ATOM   1252 H  H    . THR   A 1 93  ? -3.117  7.927   4.983   0   71.49  ? 783  THR   A H    1 1 
ATOM   1253 H  HA   . THR   A 1 93  ? -3.676  8.343   7.858   0   76.25  ? 783  THR   A HA   1 1 
ATOM   1254 H  HB   . THR   A 1 93  ? -4.641  10.435  7.092   0   78.04  ? 783  THR   A HB   1 1 
ATOM   1255 H  HG1  . THR   A 1 93  ? -3.933  9.69    4.396   0   75.84  ? 783  THR   A HG1  1 1 
ATOM   1256 H  HG21 . THR   A 1 93  ? -2.727  11.593  6.184   0   76.22  ? 783  THR   A HG21 1 1 
ATOM   1257 H  HG22 . THR   A 1 93  ? -2.23   10.432  7.428   0   77.26  ? 783  THR   A HG22 1 1 
ATOM   1258 H  HG23 . THR   A 1 93  ? -1.977  10.064  5.707   0   74.72  ? 783  THR   A HG23 1 1 
ATOM   1259 N  N    . SER   A 1 94  ? -6.563  8.282   6.84    1   57.05  ? 784  SER   A N    1 1 
ATOM   1260 C  CA   . SER   A 1 94  ? -7.851  7.613   6.62    1   57.14  ? 784  SER   A CA   1 1 
ATOM   1261 C  C    . SER   A 1 94  ? -7.922  7.015   5.185   1   56.88  ? 784  SER   A C    1 1 
ATOM   1262 O  O    . SER   A 1 94  ? -8.6    6.009   4.979   1   57.11  ? 784  SER   A O    1 1 
ATOM   1263 C  CB   . SER   A 1 94  ? -9.004  8.588   6.846   1   58.52  ? 784  SER   A CB   1 1 
ATOM   1264 O  OG   . SER   A 1 94  ? -8.803  9.803   6.142   1   60.84  ? 784  SER   A OG   1 1 
ATOM   1265 H  H    . SER   A 1 94  ? -6.666  9.251   7.127   0   78.02  ? 784  SER   A H    1 1 
ATOM   1266 H  HA   . SER   A 1 94  ? -7.955  6.796   7.333   0   79.73  ? 784  SER   A HA   1 1 
ATOM   1267 H  HB2  . SER   A 1 94  ? -9.929  8.129   6.501   0   82.92  ? 784  SER   A HB2  1 1 
ATOM   1268 H  HB3  . SER   A 1 94  ? -9.075  8.807   7.91    0   83.66  ? 784  SER   A HB3  1 1 
ATOM   1269 H  HG   . SER   A 1 94  ? -9.543  10.437  6.335   0   84.95  ? 784  SER   A HG   1 1 
ATOM   1270 N  N    . THR   A 1 95  ? -7.201  7.632   4.215   1   56.15  ? 785  THR   A N    1 1 
ATOM   1271 C  CA   . THR   A 1 95  ? -7.061  7.18    2.829   1   55.91  ? 785  THR   A CA   1 1 
ATOM   1272 C  C    . THR   A 1 95  ? -5.557  7.004   2.493   1   55.15  ? 785  THR   A C    1 1 
ATOM   1273 O  O    . THR   A 1 95  ? -4.695  7.55    3.186   1   55.27  ? 785  THR   A O    1 1 
ATOM   1274 C  CB   . THR   A 1 95  ? -7.68   8.217   1.881   1   57.29  ? 785  THR   A CB   1 1 
ATOM   1275 O  OG1  . THR   A 1 95  ? -7.049  9.48    2.105   1   58.23  ? 785  THR   A OG1  1 1 
ATOM   1276 C  CG2  . THR   A 1 95  ? -9.188  8.345   2.056   1   57.75  ? 785  THR   A CG2  1 1 
ATOM   1277 H  H    . THR   A 1 95  ? -6.701  8.502   4.362   0   73.57  ? 785  THR   A H    1 1 
ATOM   1278 H  HA   . THR   A 1 95  ? -7.561  6.225   2.674   0   72.63  ? 785  THR   A HA   1 1 
ATOM   1279 H  HB   . THR   A 1 95  ? -7.491  7.909   0.854   0   71.73  ? 785  THR   A HB   1 1 
ATOM   1280 H  HG1  . THR   A 1 95  ? -7.361  10.14   1.432   0   73.16  ? 785  THR   A HG1  1 1 
ATOM   1281 H  HG21 . THR   A 1 95  ? -9.588  9.032   1.312   0   75.5   ? 785  THR   A HG21 1 1 
ATOM   1282 H  HG22 . THR   A 1 95  ? -9.661  7.373   1.93    0   76.2   ? 785  THR   A HG22 1 1 
ATOM   1283 H  HG23 . THR   A 1 95  ? -9.422  8.729   3.048   0   77.16  ? 785  THR   A HG23 1 1 
ATOM   1284 N  N    . VAL   A 1 96  ? -5.247  6.271   1.412   1   54.17  ? 786  VAL   A N    1 1 
ATOM   1285 C  CA   . VAL   A 1 96  ? -3.859  6.071   0.979   1   53.54  ? 786  VAL   A CA   1 1 
ATOM   1286 C  C    . VAL   A 1 96  ? -3.497  7.275   0.106   1   52.74  ? 786  VAL   A C    1 1 
ATOM   1287 O  O    . VAL   A 1 96  ? -4.234  7.575   -0.832  1   52.8   ? 786  VAL   A O    1 1 
ATOM   1288 C  CB   . VAL   A 1 96  ? -3.682  4.737   0.211   1   54.18  ? 786  VAL   A CB   1 1 
ATOM   1289 C  CG1  . VAL   A 1 96  ? -2.256  4.594   -0.326  1   54.7   ? 786  VAL   A CG1  1 1 
ATOM   1290 C  CG2  . VAL   A 1 96  ? -4.048  3.547   1.094   1   54.58  ? 786  VAL   A CG2  1 1 
ATOM   1291 H  H    . VAL   A 1 96  ? -5.938  5.835   0.81    0   67.24  ? 786  VAL   A H    1 1 
ATOM   1292 H  HA   . VAL   A 1 96  ? -3.193  6.042   1.84    0   65.21  ? 786  VAL   A HA   1 1 
ATOM   1293 H  HB   . VAL   A 1 96  ? -4.357  4.735   -0.643  0   64.8   ? 786  VAL   A HB   1 1 
ATOM   1294 H  HG11 . VAL   A 1 96  ? -2.085  3.56    -0.625  0   64.25  ? 786  VAL   A HG11 1 1 
ATOM   1295 H  HG12 . VAL   A 1 96  ? -2.127  5.239   -1.194  0   63.16  ? 786  VAL   A HG12 1 1 
ATOM   1296 H  HG13 . VAL   A 1 96  ? -1.554  4.875   0.457   0   64.66  ? 786  VAL   A HG13 1 1 
ATOM   1297 H  HG21 . VAL   A 1 96  ? -3.868  2.628   0.538   0   67.15  ? 786  VAL   A HG21 1 1 
ATOM   1298 H  HG22 . VAL   A 1 96  ? -3.434  3.568   1.993   0   67.57  ? 786  VAL   A HG22 1 1 
ATOM   1299 H  HG23 . VAL   A 1 96  ? -5.103  3.604   1.361   0   68.31  ? 786  VAL   A HG23 1 1 
ATOM   1300 N  N    . GLN   A 1 97  ? -2.388  7.973   0.417   1   51.8   ? 787  GLN   A N    1 1 
ATOM   1301 C  CA   . GLN   A 1 97  ? -1.97   9.166   -0.328  1   51.4   ? 787  GLN   A CA   1 1 
ATOM   1302 C  C    . GLN   A 1 97  ? -0.609  8.977   -0.998  1   50.63  ? 787  GLN   A C    1 1 
ATOM   1303 O  O    . GLN   A 1 97  ? 0.263   8.344   -0.416  1   50.65  ? 787  GLN   A O    1 1 
ATOM   1304 C  CB   . GLN   A 1 97  ? -1.862  10.376  0.609   1   52.9   ? 787  GLN   A CB   1 1 
ATOM   1305 C  CG   . GLN   A 1 97  ? -2.989  10.554  1.62    1   56.07  ? 787  GLN   A CG   1 1 
ATOM   1306 C  CD   . GLN   A 1 97  ? -2.707  11.739  2.514   1   59.95  ? 787  GLN   A CD   1 1 
ATOM   1307 O  OE1  . GLN   A 1 97  ? -1.673  11.803  3.183   1   61.23  ? 787  GLN   A OE1  1 1 
ATOM   1308 N  NE2  . GLN   A 1 97  ? -3.602  12.714  2.55    1   60.69  ? 787  GLN   A NE2  1 1 
ATOM   1309 H  H    . GLN   A 1 97  ? -1.759  7.736   1.178   0   61.62  ? 787  GLN   A H    1 1 
ATOM   1310 H  HA   . GLN   A 1 97  ? -2.694  9.415   -1.102  0   59.46  ? 787  GLN   A HA   1 1 
ATOM   1311 H  HB2  . GLN   A 1 97  ? -0.922  10.302  1.152   0   62.45  ? 787  GLN   A HB2  1 1 
ATOM   1312 H  HB3  . GLN   A 1 97  ? -1.856  11.27   -0.013  0   61.84  ? 787  GLN   A HB3  1 1 
ATOM   1313 H  HG2  . GLN   A 1 97  ? -3.927  10.711  1.088   0   67.42  ? 787  GLN   A HG2  1 1 
ATOM   1314 H  HG3  . GLN   A 1 97  ? -3.061  9.676   2.26    0   67.87  ? 787  GLN   A HG3  1 1 
ATOM   1315 H  HE21 . GLN   A 1 97  ? -4.45   12.668  1.994   0   74.22  ? 787  GLN   A HE21 1 1 
ATOM   1316 H  HE22 . GLN   A 1 97  ? -3.436  13.522  3.142   0   75.3   ? 787  GLN   A HE22 1 1 
ATOM   1317 N  N    . LEU   A 1 98  ? -0.405  9.583   -2.184  1   49.77  ? 788  LEU   A N    1 1 
ATOM   1318 C  CA   . LEU   A 1 98  ? 0.876   9.522   -2.903  1   49.45  ? 788  LEU   A CA   1 1 
ATOM   1319 C  C    . LEU   A 1 98  ? 1.675   10.799  -2.63   1   48.96  ? 788  LEU   A C    1 1 
ATOM   1320 O  O    . LEU   A 1 98  ? 1.085   11.866  -2.496  1   48.88  ? 788  LEU   A O    1 1 
ATOM   1321 C  CB   . LEU   A 1 98  ? 0.661   9.373   -4.421  1   49.65  ? 788  LEU   A CB   1 1 
ATOM   1322 C  CG   . LEU   A 1 98  ? -0.24   8.237   -4.916  1   51.16  ? 788  LEU   A CG   1 1 
ATOM   1323 C  CD1  . LEU   A 1 98  ? -0.397  8.31    -6.411  1   51.73  ? 788  LEU   A CD1  1 1 
ATOM   1324 C  CD2  . LEU   A 1 98  ? 0.291   6.864   -4.529  1   51.86  ? 788  LEU   A CD2  1 1 
ATOM   1325 H  H    . LEU   A 1 98  ? -1.108  10.137  -2.663  0   55.56  ? 788  LEU   A H    1 1 
ATOM   1326 H  HA   . LEU   A 1 98  ? 1.472   8.68    -2.554  0   54.67  ? 788  LEU   A HA   1 1 
ATOM   1327 H  HB2  . LEU   A 1 98  ? 0.224   10.303  -4.782  0   53.12  ? 788  LEU   A HB2  1 1 
ATOM   1328 H  HB3  . LEU   A 1 98  ? 1.634   9.236   -4.89   0   52.86  ? 788  LEU   A HB3  1 1 
ATOM   1329 H  HG   . LEU   A 1 98  ? -1.227  8.346   -4.473  0   55.52  ? 788  LEU   A HG   1 1 
ATOM   1330 H  HD11 . LEU   A 1 98  ? -1.06   7.514   -6.747  0   54.48  ? 788  LEU   A HD11 1 1 
ATOM   1331 H  HD12 . LEU   A 1 98  ? -0.826  9.278   -6.662  0   54.12  ? 788  LEU   A HD12 1 1 
ATOM   1332 H  HD13 . LEU   A 1 98  ? 0.582   8.204   -6.877  0   53.71  ? 788  LEU   A HD13 1 1 
ATOM   1333 H  HD21 . LEU   A 1 98  ? -0.316  6.107   -5.024  0   56.18  ? 788  LEU   A HD21 1 1 
ATOM   1334 H  HD22 . LEU   A 1 98  ? 1.329   6.78    -4.848  0   55.52  ? 788  LEU   A HD22 1 1 
ATOM   1335 H  HD23 . LEU   A 1 98  ? 0.216   6.728   -3.452  0   56.83  ? 788  LEU   A HD23 1 1 
ATOM   1336 N  N    . ILE   A 1 99  ? 3.013   10.692  -2.546  1   48.47  ? 789  ILE   A N    1 1 
ATOM   1337 C  CA   . ILE   A 1 99  ? 3.895   11.827  -2.26   1   48.51  ? 789  ILE   A CA   1 1 
ATOM   1338 C  C    . ILE   A 1 99  ? 4.932   11.978  -3.389  1   48.43  ? 789  ILE   A C    1 1 
ATOM   1339 O  O    . ILE   A 1 99  ? 5.495   10.983  -3.843  1   48.43  ? 789  ILE   A O    1 1 
ATOM   1340 C  CB   . ILE   A 1 99  ? 4.601   11.641  -0.877  1   49.02  ? 789  ILE   A CB   1 1 
ATOM   1341 C  CG1  . ILE   A 1 99  ? 3.64    11.129  0.252   1   49.92  ? 789  ILE   A CG1  1 1 
ATOM   1342 C  CG2  . ILE   A 1 99  ? 5.335   12.918  -0.449  1   49.44  ? 789  ILE   A CG2  1 1 
ATOM   1343 C  CD1  . ILE   A 1 99  ? 2.456   12.04   0.68    1   51.15  ? 789  ILE   A CD1  1 1 
ATOM   1344 H  H    . ILE   A 1 99  ? 3.517   9.821   -2.679  0   53.61  ? 789  ILE   A H    1 1 
ATOM   1345 H  HA   . ILE   A 1 99  ? 3.316   12.749  -2.221  0   54.72  ? 789  ILE   A HA   1 1 
ATOM   1346 H  HB   . ILE   A 1 99  ? 5.361   10.873  -1.015  0   56.31  ? 789  ILE   A HB   1 1 
ATOM   1347 H  HG12 . ILE   A 1 99  ? 3.224   10.165  -0.034  0   57.52  ? 789  ILE   A HG12 1 1 
ATOM   1348 H  HG13 . ILE   A 1 99  ? 4.237   10.988  1.151   0   59.12  ? 789  ILE   A HG13 1 1 
ATOM   1349 H  HG21 . ILE   A 1 99  ? 5.644   12.807  0.589   0   59.16  ? 789  ILE   A HG21 1 1 
ATOM   1350 H  HG22 . ILE   A 1 99  ? 6.217   13.051  -1.074  0   57.68  ? 789  ILE   A HG22 1 1 
ATOM   1351 H  HG23 . ILE   A 1 99  ? 4.672   13.775  -0.556  0   58.29  ? 789  ILE   A HG23 1 1 
ATOM   1352 H  HD11 . ILE   A 1 99  ? 1.763   11.444  1.272   0   60.71  ? 789  ILE   A HD11 1 1 
ATOM   1353 H  HD12 . ILE   A 1 99  ? 2.839   12.856  1.29    0   60.87  ? 789  ILE   A HD12 1 1 
ATOM   1354 H  HD13 . ILE   A 1 99  ? 1.943   12.434  -0.196  0   59.19  ? 789  ILE   A HD13 1 1 
ATOM   1355 N  N    . THR   A 1 100 ? 5.187   13.223  -3.826  1   48.2   ? 790  THR   A N    1 1 
ATOM   1356 C  CA   . THR   A 1 100 ? 6.161   13.539  -4.877  1   48.56  ? 790  THR   A CA   1 1 
ATOM   1357 C  C    . THR   A 1 100 ? 6.735   14.952  -4.656  1   48.95  ? 790  THR   A C    1 1 
ATOM   1358 O  O    . THR   A 1 100 ? 6.163   15.737  -3.903  1   49.01  ? 790  THR   A O    1 1 
ATOM   1359 C  CB   . THR   A 1 100 ? 5.502   13.422  -6.275  1   49.47  ? 790  THR   A CB   1 1 
ATOM   1360 O  OG1  . THR   A 1 100 ? 6.512   13.464  -7.283  1   50.28  ? 790  THR   A OG1  1 1 
ATOM   1361 C  CG2  . THR   A 1 100 ? 4.488   14.524  -6.544  1   49.83  ? 790  THR   A CG2  1 1 
ATOM   1362 H  H    . THR   A 1 100 ? 4.731   14.051  -3.457  0   54.11  ? 790  THR   A H    1 1 
ATOM   1363 H  HA   . THR   A 1 100 ? 6.993   12.838  -4.82   0   53.69  ? 790  THR   A HA   1 1 
ATOM   1364 H  HB   . THR   A 1 100 ? 4.984   12.467  -6.346  0   52.35  ? 790  THR   A HB   1 1 
ATOM   1365 H  HG1  . THR   A 1 100 ? 7.095   12.663  -7.215  0   53.6   ? 790  THR   A HG1  1 1 
ATOM   1366 H  HG21 . THR   A 1 100 ? 3.926   14.283  -7.445  0   52.19  ? 790  THR   A HG21 1 1 
ATOM   1367 H  HG22 . THR   A 1 100 ? 3.792   14.601  -5.71   0   53.6   ? 790  THR   A HG22 1 1 
ATOM   1368 H  HG23 . THR   A 1 100 ? 4.979   15.483  -6.696  0   53.92  ? 790  THR   A HG23 1 1 
ATOM   1369 N  N    . GLN   A 1 101 ? 7.85    15.289  -5.329  1   49.12  ? 791  GLN   A N    1 1 
ATOM   1370 C  CA   . GLN   A 1 101 ? 8.441   16.626  -5.22   1   49.7   ? 791  GLN   A CA   1 1 
ATOM   1371 C  C    . GLN   A 1 101 ? 7.448   17.646  -5.807  1   49.87  ? 791  GLN   A C    1 1 
ATOM   1372 O  O    . GLN   A 1 101 ? 6.835   17.38   -6.842  1   50.02  ? 791  GLN   A O    1 1 
ATOM   1373 C  CB   . GLN   A 1 101 ? 9.776   16.695  -5.983  1   51.71  ? 791  GLN   A CB   1 1 
ATOM   1374 C  CG   . GLN   A 1 101 ? 10.644  17.906  -5.62   1   55.92  ? 791  GLN   A CG   1 1 
ATOM   1375 C  CD   . GLN   A 1 101 ? 11.625  18.306  -6.706  1   61.18  ? 791  GLN   A CD   1 1 
ATOM   1376 O  OE1  . GLN   A 1 101 ? 11.737  17.669  -7.762  1   62.81  ? 791  GLN   A OE1  1 1 
ATOM   1377 N  NE2  . GLN   A 1 101 ? 12.364  19.387  -6.473  1   62.01  ? 791  GLN   A NE2  1 1 
ATOM   1378 H  H    . GLN   A 1 101 ? 8.351   14.662  -5.951  0   55.02  ? 791  GLN   A H    1 1 
ATOM   1379 H  HA   . GLN   A 1 101 ? 8.618   16.86   -4.171  0   58.92  ? 791  GLN   A HA   1 1 
ATOM   1380 H  HB2  . GLN   A 1 101 ? 10.359  15.801  -5.764  0   60.16  ? 791  GLN   A HB2  1 1 
ATOM   1381 H  HB3  . GLN   A 1 101 ? 9.545   16.738  -7.046  0   58.99  ? 791  GLN   A HB3  1 1 
ATOM   1382 H  HG2  . GLN   A 1 101 ? 10.007  18.766  -5.419  0   66.89  ? 791  GLN   A HG2  1 1 
ATOM   1383 H  HG3  . GLN   A 1 101 ? 11.223  17.663  -4.729  0   67.73  ? 791  GLN   A HG3  1 1 
ATOM   1384 H  HE21 . GLN   A 1 101 ? 12.264  19.906  -5.605  0   76.5   ? 791  GLN   A HE21 1 1 
ATOM   1385 H  HE22 . GLN   A 1 101 ? 13.036  19.696  -7.168  0   75.77  ? 791  GLN   A HE22 1 1 
ATOM   1386 N  N    . LEU   A 1 102 ? 7.254   18.779  -5.126  1   49.66  ? 792  LEU   A N    1 1 
ATOM   1387 C  CA   . LEU   A 1 102 ? 6.305   19.792  -5.578  1   49.91  ? 792  LEU   A CA   1 1 
ATOM   1388 C  C    . LEU   A 1 102 ? 6.817   20.509  -6.822  1   50.04  ? 792  LEU   A C    1 1 
ATOM   1389 O  O    . LEU   A 1 102 ? 8.002   20.825  -6.91   1   50.2   ? 792  LEU   A O    1 1 
ATOM   1390 C  CB   . LEU   A 1 102 ? 6.047   20.807  -4.446  1   50.15  ? 792  LEU   A CB   1 1 
ATOM   1391 C  CG   . LEU   A 1 102 ? 5.066   21.97   -4.701  1   51.7   ? 792  LEU   A CG   1 1 
ATOM   1392 C  CD1  . LEU   A 1 102 ? 3.634   21.477  -4.891  1   52.35  ? 792  LEU   A CD1  1 1 
ATOM   1393 C  CD2  . LEU   A 1 102 ? 5.101   22.956  -3.547  1   52.35  ? 792  LEU   A CD2  1 1 
ATOM   1394 H  H    . LEU   A 1 102 ? 7.735   19.02   -4.265  0   60.21  ? 792  LEU   A H    1 1 
ATOM   1395 H  HA   . LEU   A 1 102 ? 5.367   19.294  -5.82   0   57.99  ? 792  LEU   A HA   1 1 
ATOM   1396 H  HB2  . LEU   A 1 102 ? 5.678   20.262  -3.579  0   61.78  ? 792  LEU   A HB2  1 1 
ATOM   1397 H  HB3  . LEU   A 1 102 ? 7.006   21.262  -4.203  0   63.04  ? 792  LEU   A HB3  1 1 
ATOM   1398 H  HG   . LEU   A 1 102 ? 5.357   22.513  -5.599  0   64.03  ? 792  LEU   A HG   1 1 
ATOM   1399 H  HD11 . LEU   A 1 102 ? 2.959   22.331  -4.9    0   64.51  ? 792  LEU   A HD11 1 1 
ATOM   1400 H  HD12 . LEU   A 1 102 ? 3.553   20.948  -5.839  0   61.8   ? 792  LEU   A HD12 1 1 
ATOM   1401 H  HD13 . LEU   A 1 102 ? 3.378   20.81   -4.069  0   63.77  ? 792  LEU   A HD13 1 1 
ATOM   1402 H  HD21 . LEU   A 1 102 ? 4.43    23.786  -3.764  0   68.46  ? 792  LEU   A HD21 1 1 
ATOM   1403 H  HD22 . LEU   A 1 102 ? 4.781   22.447  -2.639  0   67.75  ? 792  LEU   A HD22 1 1 
ATOM   1404 H  HD23 . LEU   A 1 102 ? 6.118   23.327  -3.427  0   68.72  ? 792  LEU   A HD23 1 1 
ATOM   1405 N  N    . MET   A 1 103 ? 5.914   20.762  -7.775  1   49.8   ? 793  MET   A N    1 1 
ATOM   1406 C  CA   . MET   A 1 103 ? 6.198   21.486  -9.008  1   50.06  ? 793  MET   A CA   1 1 
ATOM   1407 C  C    . MET   A 1 103 ? 5.553   22.872  -8.787  1   50.49  ? 793  MET   A C    1 1 
ATOM   1408 O  O    . MET   A 1 103 ? 4.326   22.973  -8.838  1   50.48  ? 793  MET   A O    1 1 
ATOM   1409 C  CB   . MET   A 1 103 ? 5.584   20.739  -10.204 1   50.39  ? 793  MET   A CB   1 1 
ATOM   1410 C  CG   . MET   A 1 103 ? 6.126   19.319  -10.378 1   51.95  ? 793  MET   A CG   1 1 
ATOM   1411 S  SD   . MET   A 1 103 ? 7.833   19.233  -10.968 1   54.87  ? 793  MET   A SD   1 1 
ATOM   1412 C  CE   . MET   A 1 103 ? 8.668   18.635  -9.529  1   53.58  ? 793  MET   A CE   1 1 
ATOM   1413 H  H    . MET   A 1 103 ? 4.943   20.471  -7.718  0   57.29  ? 793  MET   A H    1 1 
ATOM   1414 H  HA   . MET   A 1 103 ? 7.269   21.558  -9.187  0   58.61  ? 793  MET   A HA   1 1 
ATOM   1415 H  HB2  . MET   A 1 103 ? 4.507   20.66   -10.067 0   55.93  ? 793  MET   A HB2  1 1 
ATOM   1416 H  HB3  . MET   A 1 103 ? 5.804   21.294  -11.115 0   56.26  ? 793  MET   A HB3  1 1 
ATOM   1417 H  HG2  . MET   A 1 103 ? 6.061   18.773  -9.439  0   56.64  ? 793  MET   A HG2  1 1 
ATOM   1418 H  HG3  . MET   A 1 103 ? 5.519   18.815  -11.128 0   55.1   ? 793  MET   A HG3  1 1 
ATOM   1419 H  HE1  . MET   A 1 103 ? 9.73    18.535  -9.75   0   60.33  ? 793  MET   A HE1  1 1 
ATOM   1420 H  HE2  . MET   A 1 103 ? 8.522   19.348  -8.719  0   60.91  ? 793  MET   A HE2  1 1 
ATOM   1421 H  HE3  . MET   A 1 103 ? 8.254   17.667  -9.253  0   58.75  ? 793  MET   A HE3  1 1 
ATOM   1422 N  N    . PRO   A 1 104 ? 6.324   23.918  -8.405  1   50.74  ? 794  PRO   A N    1 1 
ATOM   1423 C  CA   . PRO   A 1 104 ? 5.692   25.208  -8.059  1   51.04  ? 794  PRO   A CA   1 1 
ATOM   1424 C  C    . PRO   A 1 104 ? 4.799   25.884  -9.095  1   51.51  ? 794  PRO   A C    1 1 
ATOM   1425 O  O    . PRO   A 1 104 ? 3.853   26.562  -8.702  1   51.62  ? 794  PRO   A O    1 1 
ATOM   1426 C  CB   . PRO   A 1 104 ? 6.886   26.116  -7.748  1   51.68  ? 794  PRO   A CB   1 1 
ATOM   1427 C  CG   . PRO   A 1 104 ? 7.989   25.213  -7.407  1   52.04  ? 794  PRO   A CG   1 1 
ATOM   1428 C  CD   . PRO   A 1 104 ? 7.787   23.975  -8.21   1   50.36  ? 794  PRO   A CD   1 1 
ATOM   1429 H  HA   . PRO   A 1 104 ? 5.114   25.087  -7.144  0   65.55  ? 794  PRO   A HA   1 1 
ATOM   1430 H  HB2  . PRO   A 1 104 ? 7.133   26.708  -8.628  0   68.86  ? 794  PRO   A HB2  1 1 
ATOM   1431 H  HB3  . PRO   A 1 104 ? 6.641   26.76   -6.904  0   70.45  ? 794  PRO   A HB3  1 1 
ATOM   1432 H  HG2  . PRO   A 1 104 ? 8.935   25.685  -7.669  0   69.5   ? 794  PRO   A HG2  1 1 
ATOM   1433 H  HG3  . PRO   A 1 104 ? 7.959   24.984  -6.343  0   68.94  ? 794  PRO   A HG3  1 1 
ATOM   1434 H  HD2  . PRO   A 1 104 ? 8.297   24.058  -9.169  0   63.13  ? 794  PRO   A HD2  1 1 
ATOM   1435 H  HD3  . PRO   A 1 104 ? 8.148   23.12   -7.64   0   62.99  ? 794  PRO   A HD3  1 1 
ATOM   1436 N  N    . PHE   A 1 105 ? 5.097   25.737  -10.393 1   51.57  ? 795  PHE   A N    1 1 
ATOM   1437 C  CA   . PHE   A 1 105 ? 4.334   26.417  -11.438 1   52.06  ? 795  PHE   A CA   1 1 
ATOM   1438 C  C    . PHE   A 1 105 ? 3.076   25.648  -11.943 1   51.87  ? 795  PHE   A C    1 1 
ATOM   1439 O  O    . PHE   A 1 105 ? 2.463   26.076  -12.921 1   51.98  ? 795  PHE   A O    1 1 
ATOM   1440 C  CB   . PHE   A 1 105 ? 5.277   26.783  -12.598 1   52.35  ? 795  PHE   A CB   1 1 
ATOM   1441 C  CG   . PHE   A 1 105 ? 6.341   27.785  -12.211 1   53.26  ? 795  PHE   A CG   1 1 
ATOM   1442 C  CD1  . PHE   A 1 105 ? 7.591   27.368  -11.791 1   54.17  ? 795  PHE   A CD1  1 1 
ATOM   1443 C  CD2  . PHE   A 1 105 ? 6.079   29.143  -12.239 1   54.12  ? 795  PHE   A CD2  1 1 
ATOM   1444 C  CE1  . PHE   A 1 105 ? 8.559   28.289  -11.412 1   54.9   ? 795  PHE   A CE1  1 1 
ATOM   1445 C  CE2  . PHE   A 1 105 ? 7.053   30.063  -11.868 1   54.84  ? 795  PHE   A CE2  1 1 
ATOM   1446 C  CZ   . PHE   A 1 105 ? 8.287   29.63   -11.459 1   54.64  ? 795  PHE   A CZ   1 1 
ATOM   1447 H  H    . PHE   A 1 105 ? 5.853   25.158  -10.744 0   63.32  ? 795  PHE   A H    1 1 
ATOM   1448 H  HA   . PHE   A 1 105 ? 3.966   27.362  -11.042 0   66.8   ? 795  PHE   A HA   1 1 
ATOM   1449 H  HB2  . PHE   A 1 105 ? 5.804   25.886  -12.919 0   63.38  ? 795  PHE   A HB2  1 1 
ATOM   1450 H  HB3  . PHE   A 1 105 ? 4.71    27.208  -13.424 0   64.91  ? 795  PHE   A HB3  1 1 
ATOM   1451 H  HD1  . PHE   A 1 105 ? 7.815   26.315  -11.748 0   68.13  ? 795  PHE   A HD1  1 1 
ATOM   1452 H  HD2  . PHE   A 1 105 ? 5.112   29.492  -12.56  0   72.09  ? 795  PHE   A HD2  1 1 
ATOM   1453 H  HE1  . PHE   A 1 105 ? 9.53    27.948  -11.094 0   73.85  ? 795  PHE   A HE1  1 1 
ATOM   1454 H  HE2  . PHE   A 1 105 ? 6.838   31.117  -11.904 0   77.8   ? 795  PHE   A HE2  1 1 
ATOM   1455 H  HZ   . PHE   A 1 105 ? 9.041   30.344  -11.174 0   78.09  ? 795  PHE   A HZ   1 1 
ATOM   1456 N  N    . GLY   A 1 106 ? 2.657   24.591  -11.243 1   51.46  ? 796  GLY   A N    1 1 
ATOM   1457 C  CA   . GLY   A 1 106 ? 1.438   23.857  -11.576 1   51.62  ? 796  GLY   A CA   1 1 
ATOM   1458 C  C    . GLY   A 1 106 ? 1.449   23.096  -12.886 1   51.51  ? 796  GLY   A C    1 1 
ATOM   1459 O  O    . GLY   A 1 106 ? 2.515   22.823  -13.437 1   51.54  ? 796  GLY   A O    1 1 
ATOM   1460 H  H    . GLY   A 1 106 ? 3.129   24.206  -10.431 0   61.17  ? 796  GLY   A H    1 1 
ATOM   1461 H  HA2  . GLY   A 1 106 ? 1.231   23.142  -10.781 0   59.51  ? 796  GLY   A HA2  1 1 
ATOM   1462 H  HA3  . GLY   A 1 106 ? 0.609   24.563  -11.612 0   61.04  ? 796  GLY   A HA3  1 1 
ATOM   1463 N  N    . CYS   A 1 107 ? 0.252   22.738  -13.393 1   51.35  ? 797  CYS   A N    1 1 
ATOM   1464 C  CA   . CYS   A 1 107 ? 0.147   22      -14.65  1   51.7   ? 797  CYS   A CA   1 1 
ATOM   1465 C  C    . CYS   A 1 107 ? 0.37    22.914  -15.864 1   51.67  ? 797  CYS   A C    1 1 
ATOM   1466 O  O    . CYS   A 1 107 ? 0.067   24.108  -15.816 1   51.85  ? 797  CYS   A O    1 1 
ATOM   1467 C  CB   . CYS   A 1 107 ? -1.149  21.191  -14.743 1   52.71  ? 797  CYS   A CB   1 1 
ATOM   1468 S  SG   . CYS   A 1 107 ? -2.579  22.094  -15.389 1   57.31  ? 797  CYS   A SG   1 1 
ATOM   1469 H  H    . CYS   A 1 107 ? -0.641  22.946  -12.958 0   57.66  ? 797  CYS   A H    1 1 
ATOM   1470 H  HA   . CYS   A 1 107 ? 0.931   21.248  -14.669 0   54.3   ? 797  CYS   A HA   1 1 
ATOM   1471 H  HB2  . CYS   A 1 107 ? -0.976  20.342  -15.403 0   54.37  ? 797  CYS   A HB2  1 1 
ATOM   1472 H  HB3  . CYS   A 1 107 ? -1.408  20.832  -13.748 0   56.17  ? 797  CYS   A HB3  1 1 
ATOM   1473 H  HG   . CYS   A 1 107 ? -3.636  21.275  -15.425 0   61.36  ? 797  CYS   A HG   1 1 
ATOM   1474 N  N    . LEU   A 1 108 ? 0.948   22.35   -16.932 1   51.24  ? 798  LEU   A N    1 1 
ATOM   1475 C  CA   . LEU   A 1 108 ? 1.299   23.068  -18.153 1   51.31  ? 798  LEU   A CA   1 1 
ATOM   1476 C  C    . LEU   A 1 108 ? 0.082   23.542  -18.946 1   51.26  ? 798  LEU   A C    1 1 
ATOM   1477 O  O    . LEU   A 1 108 ? 0.179   24.576  -19.598 1   51.32  ? 798  LEU   A O    1 1 
ATOM   1478 C  CB   . LEU   A 1 108 ? 2.244   22.197  -19.014 1   51.46  ? 798  LEU   A CB   1 1 
ATOM   1479 C  CG   . LEU   A 1 108 ? 2.861   22.795  -20.296 1   52.81  ? 798  LEU   A CG   1 1 
ATOM   1480 C  CD1  . LEU   A 1 108 ? 3.749   24.005  -20.011 1   53.29  ? 798  LEU   A CD1  1 1 
ATOM   1481 C  CD2  . LEU   A 1 108 ? 3.692   21.756  -21.011 1   53.5   ? 798  LEU   A CD2  1 1 
ATOM   1482 H  H    . LEU   A 1 108 ? 1.183   21.363  -16.976 0   52.54  ? 798  LEU   A H    1 1 
ATOM   1483 H  HA   . LEU   A 1 108 ? 1.846   23.957  -17.844 0   55.28  ? 798  LEU   A HA   1 1 
ATOM   1484 H  HB2  . LEU   A 1 108 ? 3.077   21.892  -18.382 0   52.61  ? 798  LEU   A HB2  1 1 
ATOM   1485 H  HB3  . LEU   A 1 108 ? 1.691   21.31   -19.317 0   51.49  ? 798  LEU   A HB3  1 1 
ATOM   1486 H  HG   . LEU   A 1 108 ? 2.067   23.109  -20.973 0   54.17  ? 798  LEU   A HG   1 1 
ATOM   1487 H  HD11 . LEU   A 1 108 ? 4.227   24.317  -20.938 0   56.54  ? 798  LEU   A HD11 1 1 
ATOM   1488 H  HD12 . LEU   A 1 108 ? 3.146   24.827  -19.627 0   57.57  ? 798  LEU   A HD12 1 1 
ATOM   1489 H  HD13 . LEU   A 1 108 ? 4.508   23.724  -19.284 0   56.5   ? 798  LEU   A HD13 1 1 
ATOM   1490 H  HD21 . LEU   A 1 108 ? 4.095   22.183  -21.928 0   53.7   ? 798  LEU   A HD21 1 1 
ATOM   1491 H  HD22 . LEU   A 1 108 ? 4.504   21.444  -20.356 0   53.59  ? 798  LEU   A HD22 1 1 
ATOM   1492 H  HD23 . LEU   A 1 108 ? 3.061   20.899  -21.245 0   52.42  ? 798  LEU   A HD23 1 1 
ATOM   1493 N  N    . LEU   A 1 109 ? -1.072  22.848  -18.86  1   51.08  ? 799  LEU   A N    1 1 
ATOM   1494 C  CA   . LEU   A 1 109 ? -2.29   23.296  -19.549 1   51.48  ? 799  LEU   A CA   1 1 
ATOM   1495 C  C    . LEU   A 1 109 ? -2.722  24.666  -19.011 1   52.07  ? 799  LEU   A C    1 1 
ATOM   1496 O  O    . LEU   A 1 109 ? -3.038  25.55   -19.797 1   52.17  ? 799  LEU   A O    1 1 
ATOM   1497 C  CB   . LEU   A 1 109 ? -3.429  22.265  -19.381 1   51.53  ? 799  LEU   A CB   1 1 
ATOM   1498 C  CG   . LEU   A 1 109 ? -4.831  22.632  -19.914 1   52.87  ? 799  LEU   A CG   1 1 
ATOM   1499 C  CD1  . LEU   A 1 109 ? -4.839  22.839  -21.433 1   53.39  ? 799  LEU   A CD1  1 1 
ATOM   1500 C  CD2  . LEU   A 1 109 ? -5.836  21.556  -19.55  1   53.48  ? 799  LEU   A CD2  1 1 
ATOM   1501 H  H    . LEU   A 1 109 ? -1.192  21.978  -18.351 0   53     ? 799  LEU   A H    1 1 
ATOM   1502 H  HA   . LEU   A 1 109 ? -2.06   23.402  -20.608 0   54.32  ? 799  LEU   A HA   1 1 
ATOM   1503 H  HB2  . LEU   A 1 109 ? -3.127  21.35   -19.888 0   52.99  ? 799  LEU   A HB2  1 1 
ATOM   1504 H  HB3  . LEU   A 1 109 ? -3.545  22.061  -18.317 0   54.8   ? 799  LEU   A HB3  1 1 
ATOM   1505 H  HG   . LEU   A 1 109 ? -5.177  23.554  -19.449 0   58.65  ? 799  LEU   A HG   1 1 
ATOM   1506 H  HD11 . LEU   A 1 109 ? -5.87   22.95   -21.766 0   58.14  ? 799  LEU   A HD11 1 1 
ATOM   1507 H  HD12 . LEU   A 1 109 ? -4.284  23.74   -21.687 0   57.39  ? 799  LEU   A HD12 1 1 
ATOM   1508 H  HD13 . LEU   A 1 109 ? -4.389  21.973  -21.916 0   55.58  ? 799  LEU   A HD13 1 1 
ATOM   1509 H  HD21 . LEU   A 1 109 ? -6.82   21.848  -19.915 0   58.62  ? 799  LEU   A HD21 1 1 
ATOM   1510 H  HD22 . LEU   A 1 109 ? -5.533  20.617  -20.01  0   56.05  ? 799  LEU   A HD22 1 1 
ATOM   1511 H  HD23 . LEU   A 1 109 ? -5.862  21.449  -18.467 0   57.99  ? 799  LEU   A HD23 1 1 
ATOM   1512 N  N    . ASP   A 1 110 ? -2.701  24.851  -17.682 1   52.3   ? 800  ASP   A N    1 1 
ATOM   1513 C  CA   . ASP   A 1 110 ? -3.041  26.136  -17.071 1   53.08  ? 800  ASP   A CA   1 1 
ATOM   1514 C  C    . ASP   A 1 110 ? -1.945  27.168  -17.344 1   53.48  ? 800  ASP   A C    1 1 
ATOM   1515 O  O    . ASP   A 1 110 ? -2.265  28.31   -17.643 1   53.66  ? 800  ASP   A O    1 1 
ATOM   1516 C  CB   . ASP   A 1 110 ? -3.242  25.988  -15.554 1   54.76  ? 800  ASP   A CB   1 1 
ATOM   1517 C  CG   . ASP   A 1 110 ? -4.466  25.186  -15.171 1   59.34  ? 800  ASP   A CG   1 1 
ATOM   1518 O  OD1  . ASP   A 1 110 ? -5.532  25.4    -15.786 1   60.12  ? 800  ASP   A OD1  1 1 
ATOM   1519 O  OD2  . ASP   A 1 110 ? -4.364  24.355  -14.244 1   61.6   ? 800  ASP   A OD2  1 1 
ATOM   1520 H  H    . ASP   A 1 110 ? -2.468  24.129  -17.008 0   58.32  ? 800  ASP   A H    1 1 
ATOM   1521 H  HA   . ASP   A 1 110 ? -3.967  26.509  -17.507 0   63.41  ? 800  ASP   A HA   1 1 
ATOM   1522 H  HB2  . ASP   A 1 110 ? -2.369  25.499  -15.124 0   64.17  ? 800  ASP   A HB2  1 1 
ATOM   1523 H  HB3  . ASP   A 1 110 ? -3.352  26.982  -15.123 0   67.26  ? 800  ASP   A HB3  1 1 
ATOM   1524 N  N    . TYR   A 1 111 ? -0.664  26.767  -17.253 1   53.78  ? 801  TYR   A N    1 1 
ATOM   1525 C  CA   . TYR   A 1 111 ? 0.479   27.651  -17.505 1   54.48  ? 801  TYR   A CA   1 1 
ATOM   1526 C  C    . TYR   A 1 111 ? 0.436   28.267  -18.91  1   55.37  ? 801  TYR   A C    1 1 
ATOM   1527 O  O    . TYR   A 1 111 ? 0.686   29.464  -19.043 1   55.61  ? 801  TYR   A O    1 1 
ATOM   1528 C  CB   . TYR   A 1 111 ? 1.808   26.892  -17.315 1   54.62  ? 801  TYR   A CB   1 1 
ATOM   1529 C  CG   . TYR   A 1 111 ? 3.016   27.796  -17.208 1   55.43  ? 801  TYR   A CG   1 1 
ATOM   1530 C  CD1  . TYR   A 1 111 ? 3.771   28.119  -18.327 1   56.38  ? 801  TYR   A CD1  1 1 
ATOM   1531 C  CD2  . TYR   A 1 111 ? 3.407   28.324  -15.986 1   56.5   ? 801  TYR   A CD2  1 1 
ATOM   1532 C  CE1  . TYR   A 1 111 ? 4.868   28.966  -18.238 1   57.28  ? 801  TYR   A CE1  1 1 
ATOM   1533 C  CE2  . TYR   A 1 111 ? 4.51    29.16   -15.882 1   57.35  ? 801  TYR   A CE2  1 1 
ATOM   1534 C  CZ   . TYR   A 1 111 ? 5.233   29.489  -17.011 1   58.22  ? 801  TYR   A CZ   1 1 
ATOM   1535 O  OH   . TYR   A 1 111 ? 6.322   30.321  -16.899 1   59.6   ? 801  TYR   A OH   1 1 
ATOM   1536 H  H    . TYR   A 1 111 ? -0.385  25.828  -16.987 0   61.36  ? 801  TYR   A H    1 1 
ATOM   1537 H  HA   . TYR   A 1 111 ? 0.45    28.466  -16.783 0   66.71  ? 801  TYR   A HA   1 1 
ATOM   1538 H  HB2  . TYR   A 1 111 ? 1.763   26.298  -16.403 0   63.04  ? 801  TYR   A HB2  1 1 
ATOM   1539 H  HB3  . TYR   A 1 111 ? 1.96    26.245  -18.178 0   61.76  ? 801  TYR   A HB3  1 1 
ATOM   1540 H  HD1  . TYR   A 1 111 ? 3.483   27.727  -19.288 0   65.46  ? 801  TYR   A HD1  1 1 
ATOM   1541 H  HD2  . TYR   A 1 111 ? 2.839   28.086  -15.103 0   69.09  ? 801  TYR   A HD2  1 1 
ATOM   1542 H  HE1  . TYR   A 1 111 ? 5.428   29.207  -19.126 0   69.81  ? 801  TYR   A HE1  1 1 
ATOM   1543 H  HE2  . TYR   A 1 111 ? 4.79    29.568  -14.924 0   73.38  ? 801  TYR   A HE2  1 1 
ATOM   1544 H  HH   . TYR   A 1 111 ? 6.89    30.267  -17.712 0   75.81  ? 801  TYR   A HH   1 1 
ATOM   1545 N  N    . VAL   A 1 112 ? 0.128   27.467  -19.954 1   55.52  ? 802  VAL   A N    1 1 
ATOM   1546 C  CA   . VAL   A 1 112 ? 0.061   28.004  -21.325 1   56.28  ? 802  VAL   A CA   1 1 
ATOM   1547 C  C    . VAL   A 1 112 ? -1.159  28.937  -21.501 1   56.9   ? 802  VAL   A C    1 1 
ATOM   1548 O  O    . VAL   A 1 112 ? -1.088  29.873  -22.294 1   57.07  ? 802  VAL   A O    1 1 
ATOM   1549 C  CB   . VAL   A 1 112 ? 0.158   26.943  -22.464 1   56.86  ? 802  VAL   A CB   1 1 
ATOM   1550 C  CG1  . VAL   A 1 112 ? 1.463   26.155  -22.385 1   57.42  ? 802  VAL   A CG1  1 1 
ATOM   1551 C  CG2  . VAL   A 1 112 ? -1.042  26.003  -22.494 1   57.32  ? 802  VAL   A CG2  1 1 
ATOM   1552 H  H    . VAL   A 1 112 ? -0.072  26.477  -19.861 0   62.38  ? 802  VAL   A H    1 1 
ATOM   1553 H  HA   . VAL   A 1 112 ? 0.938   28.635  -21.461 0   65.78  ? 802  VAL   A HA   1 1 
ATOM   1554 H  HB   . VAL   A 1 112 ? 0.168   27.474  -23.414 0   63.63  ? 802  VAL   A HB   1 1 
ATOM   1555 H  HG11 . VAL   A 1 112 ? 1.559   25.548  -23.283 0   60.9   ? 802  VAL   A HG11 1 1 
ATOM   1556 H  HG12 . VAL   A 1 112 ? 2.301   26.846  -22.31  0   63.33  ? 802  VAL   A HG12 1 1 
ATOM   1557 H  HG13 . VAL   A 1 112 ? 1.435   25.512  -21.507 0   61.96  ? 802  VAL   A HG13 1 1 
ATOM   1558 H  HG21 . VAL   A 1 112 ? -0.833  25.195  -23.193 0   61.05  ? 802  VAL   A HG21 1 1 
ATOM   1559 H  HG22 . VAL   A 1 112 ? -1.205  25.596  -21.497 0   62.14  ? 802  VAL   A HG22 1 1 
ATOM   1560 H  HG23 . VAL   A 1 112 ? -1.925  26.549  -22.824 0   63.69  ? 802  VAL   A HG23 1 1 
ATOM   1561 N  N    . ARG   A 1 113 ? -2.251  28.71   -20.748 1   57.33  ? 803  ARG   A N    1 1 
ATOM   1562 C  CA   . ARG   A 1 113 ? -3.443  29.567  -20.79  1   58.24  ? 803  ARG   A CA   1 1 
ATOM   1563 C  C    . ARG   A 1 113 ? -3.216  30.883  -20.018 1   59.63  ? 803  ARG   A C    1 1 
ATOM   1564 O  O    . ARG   A 1 113 ? -3.829  31.894  -20.347 1   59.86  ? 803  ARG   A O    1 1 
ATOM   1565 C  CB   . ARG   A 1 113 ? -4.657  28.846  -20.174 1   58.85  ? 803  ARG   A CB   1 1 
ATOM   1566 C  CG   . ARG   A 1 113 ? -5.153  27.648  -20.962 1   60.32  ? 803  ARG   A CG   1 1 
ATOM   1567 C  CD   . ARG   A 1 113 ? -6.252  26.915  -20.221 1   61.93  ? 803  ARG   A CD   1 1 
ATOM   1568 N  NE   . ARG   A 1 113 ? -6.911  25.898  -21.043 1   63.44  ? 803  ARG   A NE   1 1 
ATOM   1569 C  CZ   . ARG   A 1 113 ? -7.776  24.994  -20.585 1   64.93  ? 803  ARG   A CZ   1 1 
ATOM   1570 N  NH1  . ARG   A 1 113 ? -8.091  24.956  -19.292 1   64.42  ? 803  ARG   A NH1  1 1 
ATOM   1571 N  NH2  . ARG   A 1 113 ? -8.328  24.115  -21.414 1   64.69  ? 803  ARG   A NH2  1 1 
ATOM   1572 H  H    . ARG   A 1 113 ? -2.34   27.934  -20.1   0   67.56  ? 803  ARG   A H    1 1 
ATOM   1573 H  HA   . ARG   A 1 113 ? -3.686  29.81   -21.823 0   71.66  ? 803  ARG   A HA   1 1 
ATOM   1574 H  HB2  . ARG   A 1 113 ? -4.397  28.502  -19.174 0   72.12  ? 803  ARG   A HB2  1 1 
ATOM   1575 H  HB3  . ARG   A 1 113 ? -5.481  29.555  -20.112 0   74.47  ? 803  ARG   A HB3  1 1 
ATOM   1576 H  HG2  . ARG   A 1 113 ? -5.534  27.976  -21.928 0   71.94  ? 803  ARG   A HG2  1 1 
ATOM   1577 H  HG3  . ARG   A 1 113 ? -4.321  26.956  -21.08  0   69.6   ? 803  ARG   A HG3  1 1 
ATOM   1578 H  HD2  . ARG   A 1 113 ? -5.814  26.422  -19.354 0   72.65  ? 803  ARG   A HD2  1 1 
ATOM   1579 H  HD3  . ARG   A 1 113 ? -7.007  27.632  -19.904 0   75.6   ? 803  ARG   A HD3  1 1 
ATOM   1580 H  HE   . ARG   A 1 113 ? -6.704  25.891  -22.037 0   72.74  ? 803  ARG   A HE   1 1 
ATOM   1581 H  HH11 . ARG   A 1 113 ? -7.7    25.602  -18.614 0   76.25  ? 803  ARG   A HH11 1 1 
ATOM   1582 H  HH12 . ARG   A 1 113 ? -8.749  24.257  -18.963 0   75.42  ? 803  ARG   A HH12 1 1 
ATOM   1583 H  HH21 . ARG   A 1 113 ? -8.099  24.127  -22.402 0   72.96  ? 803  ARG   A HH21 1 1 
ATOM   1584 H  HH22 . ARG   A 1 113 ? -8.983  23.423  -21.063 0   73.8   ? 803  ARG   A HH22 1 1 
ATOM   1585 N  N    . GLU   A 1 114 ? -2.383  30.857  -18.963 1   60.4   ? 804  GLU   A N    1 1 
ATOM   1586 C  CA   . GLU   A 1 114 ? -2.105  32.031  -18.133 1   61.64  ? 804  GLU   A CA   1 1 
ATOM   1587 C  C    . GLU   A 1 114 ? -1.088  32.958  -18.815 1   62.69  ? 804  GLU   A C    1 1 
ATOM   1588 O  O    . GLU   A 1 114 ? -1.35   34.153  -18.95  1   62.97  ? 804  GLU   A O    1 1 
ATOM   1589 C  CB   . GLU   A 1 114 ? -1.591  31.597  -16.737 1   64.06  ? 804  GLU   A CB   1 1 
ATOM   1590 C  CG   . GLU   A 1 114 ? -2.666  31.005  -15.835 1   68.91  ? 804  GLU   A CG   1 1 
ATOM   1591 C  CD   . GLU   A 1 114 ? -2.182  30.223  -14.626 1   75.63  ? 804  GLU   A CD   1 1 
ATOM   1592 O  OE1  . GLU   A 1 114 ? -2.898  30.23   -13.599 1   77.2   ? 804  GLU   A OE1  1 1 
ATOM   1593 O  OE2  . GLU   A 1 114 ? -1.09   29.613  -14.696 1   77.92  ? 804  GLU   A OE2  1 1 
ATOM   1594 H  H    . GLU   A 1 114 ? -1.882  30.029  -18.656 0   75.39  ? 804  GLU   A H    1 1 
ATOM   1595 H  HA   . GLU   A 1 114 ? -3.024  32.595  -17.986 0   83.41  ? 804  GLU   A HA   1 1 
ATOM   1596 H  HB2  . GLU   A 1 114 ? -0.802  30.858  -16.872 0   81.79  ? 804  GLU   A HB2  1 1 
ATOM   1597 H  HB3  . GLU   A 1 114 ? -1.18   32.47   -16.233 0   86.13  ? 804  GLU   A HB3  1 1 
ATOM   1598 H  HG2  . GLU   A 1 114 ? -3.276  31.825  -15.458 0   91.23  ? 804  GLU   A HG2  1 1 
ATOM   1599 H  HG3  . GLU   A 1 114 ? -3.285  30.333  -16.428 0   86.98  ? 804  GLU   A HG3  1 1 
ATOM   1600 N  N    . HIS   A 1 115 ? 0.051   32.407  -19.268 1   63.07  ? 805  HIS   A N    1 1 
ATOM   1601 C  CA   . HIS   A 1 115 ? 1.12    33.175  -19.907 1   64.02  ? 805  HIS   A CA   1 1 
ATOM   1602 C  C    . HIS   A 1 115 ? 1.008   33.141  -21.444 1   64.42  ? 805  HIS   A C    1 1 
ATOM   1603 O  O    . HIS   A 1 115 ? 2.016   32.976  -22.128 1   64.67  ? 805  HIS   A O    1 1 
ATOM   1604 C  CB   . HIS   A 1 115 ? 2.48    32.623  -19.442 1   65.08  ? 805  HIS   A CB   1 1 
ATOM   1605 C  CG   . HIS   A 1 115 ? 2.624   32.588  -17.952 1   67.88  ? 805  HIS   A CG   1 1 
ATOM   1606 N  ND1  . HIS   A 1 115 ? 1.972   31.638  -17.189 1   69.99  ? 805  HIS   A ND1  1 1 
ATOM   1607 C  CD2  . HIS   A 1 115 ? 3.333   33.394  -17.129 1   69.07  ? 805  HIS   A CD2  1 1 
ATOM   1608 C  CE1  . HIS   A 1 115 ? 2.3     31.891  -15.933 1   70.53  ? 805  HIS   A CE1  1 1 
ATOM   1609 N  NE2  . HIS   A 1 115 ? 3.122   32.938  -15.847 1   70.3   ? 805  HIS   A NE2  1 1 
ATOM   1610 H  H    . HIS   A 1 115 ? 0.263   31.416  -19.208 0   79.72  ? 805  HIS   A H    1 1 
ATOM   1611 H  HA   . HIS   A 1 115 ? 1.073   34.217  -19.592 0   86.76  ? 805  HIS   A HA   1 1 
ATOM   1612 H  HB2  . HIS   A 1 115 ? 2.593   31.605  -19.81  0   81.46  ? 805  HIS   A HB2  1 1 
ATOM   1613 H  HB3  . HIS   A 1 115 ? 3.282   33.248  -19.83  0   85.25  ? 805  HIS   A HB3  1 1 
ATOM   1614 H  HD1  . HIS   A 1 115 ? 1.363   30.899  -17.526 0   86.5   ? 805  HIS   A HD1  1 1 
ATOM   1615 H  HD2  . HIS   A 1 115 ? 3.946   34.231  -17.419 0   93.59  ? 805  HIS   A HD2  1 1 
ATOM   1616 H  HE1  . HIS   A 1 115 ? 1.949   31.322  -15.088 0   89.87  ? 805  HIS   A HE1  1 1 
ATOM   1617 N  N    . LYS   A 1 116 ? -0.205  33.35   -21.983 1   64.43  ? 806  LYS   A N    1 1 
ATOM   1618 C  CA   . LYS   A 1 116 ? -0.453  33.325  -23.431 1   64.86  ? 806  LYS   A CA   1 1 
ATOM   1619 C  C    . LYS   A 1 116 ? 0.476   34.27   -24.209 1   65.07  ? 806  LYS   A C    1 1 
ATOM   1620 O  O    . LYS   A 1 116 ? 1.067   33.853  -25.204 1   65.17  ? 806  LYS   A O    1 1 
ATOM   1621 C  CB   . LYS   A 1 116 ? -1.919  33.7    -23.753 1   66.99  ? 806  LYS   A CB   1 1 
ATOM   1622 C  CG   . LYS   A 1 116 ? -2.953  32.626  -23.449 1   71.67  ? 806  LYS   A CG   1 1 
ATOM   1623 C  CD   . LYS   A 1 116 ? -4.372  33.162  -23.613 1   76.64  ? 806  LYS   A CD   1 1 
ATOM   1624 C  CE   . LYS   A 1 116 ? -5.421  32.156  -23.203 1   81     ? 806  LYS   A CE   1 1 
ATOM   1625 N  NZ   . LYS   A 1 116 ? -6.797  32.711  -23.309 1   84.17  ? 806  LYS   A NZ   1 1 
ATOM   1626 H  H    . LYS   A 1 116 ? -1.027  33.57   -21.43  0   84.33  ? 806  LYS   A H    1 1 
ATOM   1627 H  HA   . LYS   A 1 116 ? -0.28   32.314  -23.797 0   80.76  ? 806  LYS   A HA   1 1 
ATOM   1628 H  HB2  . LYS   A 1 116 ? -2.188  34.59   -23.186 0   89.54  ? 806  LYS   A HB2  1 1 
ATOM   1629 H  HB3  . LYS   A 1 116 ? -1.986  33.917  -24.818 0   86.7   ? 806  LYS   A HB3  1 1 
ATOM   1630 H  HG2  . LYS   A 1 116 ? -2.828  31.797  -24.143 0   87.53  ? 806  LYS   A HG2  1 1 
ATOM   1631 H  HG3  . LYS   A 1 116 ? -2.832  32.285  -22.422 0   90.15  ? 806  LYS   A HG3  1 1 
ATOM   1632 H  HD2  . LYS   A 1 116 ? -4.494  34.049  -22.993 0   99.62  ? 806  LYS   A HD2  1 1 
ATOM   1633 H  HD3  . LYS   A 1 116 ? -4.538  33.412  -24.66  0   96.89  ? 806  LYS   A HD3  1 1 
ATOM   1634 H  HE2  . LYS   A 1 116 ? -5.357  31.285  -23.853 0   97.64  ? 806  LYS   A HE2  1 1 
ATOM   1635 H  HE3  . LYS   A 1 116 ? -5.252  31.865  -22.167 0   100.14 ? 806  LYS   A HE3  1 1 
ATOM   1636 H  HZ1  . LYS   A 1 116 ? -7.481  31.975  -23.165 0   104.36 ? 806  LYS   A HZ1  1 1 
ATOM   1637 H  HZ2  . LYS   A 1 116 ? -6.936  33.43   -22.606 0   107.64 ? 806  LYS   A HZ2  1 1 
ATOM   1638 H  HZ3  . LYS   A 1 116 ? -6.935  33.117  -24.229 0   106.62 ? 806  LYS   A HZ3  1 1 
ATOM   1639 N  N    . ASP   A 1 117 ? 0.602   35.532  -23.757 1   64.74  ? 807  ASP   A N    1 1 
ATOM   1640 C  CA   . ASP   A 1 117 ? 1.393   36.554  -24.442 1   65.04  ? 807  ASP   A CA   1 1 
ATOM   1641 C  C    . ASP   A 1 117 ? 2.86    36.658  -23.977 1   64.63  ? 807  ASP   A C    1 1 
ATOM   1642 O  O    . ASP   A 1 117 ? 3.507   37.653  -24.296 1   64.93  ? 807  ASP   A O    1 1 
ATOM   1643 C  CB   . ASP   A 1 117 ? 0.7     37.923  -24.289 1   67.08  ? 807  ASP   A CB   1 1 
ATOM   1644 C  CG   . ASP   A 1 117 ? -0.751  37.937  -24.733 1   72.33  ? 807  ASP   A CG   1 1 
ATOM   1645 O  OD1  . ASP   A 1 117 ? -1.072  38.683  -25.684 1   73.34  ? 807  ASP   A OD1  1 1 
ATOM   1646 O  OD2  . ASP   A 1 117 ? -1.568  37.213  -24.122 1   74.68  ? 807  ASP   A OD2  1 1 
ATOM   1647 H  H    . ASP   A 1 117 ? 0.161   35.874  -22.909 0   89.6   ? 807  ASP   A H    1 1 
ATOM   1648 H  HA   . ASP   A 1 117 ? 1.412   36.336  -25.509 0   89.22  ? 807  ASP   A HA   1 1 
ATOM   1649 H  HB2  . ASP   A 1 117 ? 0.732   38.218  -23.241 0   98.17  ? 807  ASP   A HB2  1 1 
ATOM   1650 H  HB3  . ASP   A 1 117 ? 1.222   38.66   -24.897 0   98.3   ? 807  ASP   A HB3  1 1 
ATOM   1651 N  N    . ASN   A 1 118 ? 3.389   35.664  -23.236 1   63.88  ? 808  ASN   A N    1 1 
ATOM   1652 C  CA   . ASN   A 1 118 ? 4.785   35.694  -22.769 1   63.6   ? 808  ASN   A CA   1 1 
ATOM   1653 C  C    . ASN   A 1 118 ? 5.603   34.451  -23.195 1   62.46  ? 808  ASN   A C    1 1 
ATOM   1654 O  O    . ASN   A 1 118 ? 6.822   34.455  -23.025 1   62.57  ? 808  ASN   A O    1 1 
ATOM   1655 C  CB   . ASN   A 1 118 ? 4.84    35.837  -21.242 1   65.18  ? 808  ASN   A CB   1 1 
ATOM   1656 C  CG   . ASN   A 1 118 ? 3.957   36.931  -20.678 1   68.56  ? 808  ASN   A CG   1 1 
ATOM   1657 O  OD1  . ASN   A 1 118 ? 3.989   38.082  -21.131 1   69.79  ? 808  ASN   A OD1  1 1 
ATOM   1658 N  ND2  . ASN   A 1 118 ? 3.158   36.609  -19.66  1   69.07  ? 808  ASN   A ND2  1 1 
ATOM   1659 H  H    . ASN   A 1 118 ? 2.883   34.84   -22.927 0   86.06  ? 808  ASN   A H    1 1 
ATOM   1660 H  HA   . ASN   A 1 118 ? 5.301   36.56   -23.178 0   90.58  ? 808  ASN   A HA   1 1 
ATOM   1661 H  HB2  . ASN   A 1 118 ? 4.555   34.884  -20.801 0   89.14  ? 808  ASN   A HB2  1 1 
ATOM   1662 H  HB3  . ASN   A 1 118 ? 5.864   36.072  -20.958 0   92.67  ? 808  ASN   A HB3  1 1 
ATOM   1663 H  HD21 . ASN   A 1 118 ? 2.55    37.316  -19.258 0   99.95  ? 808  ASN   A HD21 1 1 
ATOM   1664 H  HD22 . ASN   A 1 118 ? 3.145   35.667  -19.282 0   95.35  ? 808  ASN   A HD22 1 1 
ATOM   1665 N  N    . ILE   A 1 119 ? 4.959   33.399  -23.736 1   61.17  ? 809  ILE   A N    1 1 
ATOM   1666 C  CA   . ILE   A 1 119 ? 5.668   32.184  -24.143 1   60.36  ? 809  ILE   A CA   1 1 
ATOM   1667 C  C    . ILE   A 1 119 ? 6.254   32.334  -25.559 1   59.4   ? 809  ILE   A C    1 1 
ATOM   1668 O  O    . ILE   A 1 119 ? 5.519   32.605  -26.509 1   59.6   ? 809  ILE   A O    1 1 
ATOM   1669 C  CB   . ILE   A 1 119 ? 4.739   30.933  -24.012 1   60.79  ? 809  ILE   A CB   1 1 
ATOM   1670 C  CG1  . ILE   A 1 119 ? 4.449   30.614  -22.517 1   61.48  ? 809  ILE   A CG1  1 1 
ATOM   1671 C  CG2  . ILE   A 1 119 ? 5.366   29.714  -24.709 1   61.33  ? 809  ILE   A CG2  1 1 
ATOM   1672 C  CD1  . ILE   A 1 119 ? 3.168   29.866  -22.252 1   62.6   ? 809  ILE   A CD1  1 1 
ATOM   1673 H  H    . ILE   A 1 119 ? 3.96    33.352  -23.906 0   79.41  ? 809  ILE   A H    1 1 
ATOM   1674 H  HA   . ILE   A 1 119 ? 6.499   32.018  -23.46  0   76.76  ? 809  ILE   A HA   1 1 
ATOM   1675 H  HB   . ILE   A 1 119 ? 3.796   31.148  -24.512 0   73.87  ? 809  ILE   A HB   1 1 
ATOM   1676 H  HG12 . ILE   A 1 119 ? 5.263   30.007  -22.126 0   73.89  ? 809  ILE   A HG12 1 1 
ATOM   1677 H  HG13 . ILE   A 1 119 ? 4.392   31.542  -21.95  0   76.86  ? 809  ILE   A HG13 1 1 
ATOM   1678 H  HG21 . ILE   A 1 119 ? 4.864   28.799  -24.397 0   70.18  ? 809  ILE   A HG21 1 1 
ATOM   1679 H  HG22 . ILE   A 1 119 ? 5.247   29.83   -25.785 0   71.99  ? 809  ILE   A HG22 1 1 
ATOM   1680 H  HG23 . ILE   A 1 119 ? 6.423   29.66   -24.452 0   72.15  ? 809  ILE   A HG23 1 1 
ATOM   1681 H  HD11 . ILE   A 1 119 ? 3.082   29.682  -21.182 0   74.38  ? 809  ILE   A HD11 1 1 
ATOM   1682 H  HD12 . ILE   A 1 119 ? 2.33    30.475  -22.589 0   75.06  ? 809  ILE   A HD12 1 1 
ATOM   1683 H  HD13 . ILE   A 1 119 ? 3.18    28.922  -22.792 0   72.05  ? 809  ILE   A HD13 1 1 
ATOM   1684 N  N    . GLY   A 1 120 ? 7.566   32.128  -25.68  1   58.09  ? 810  GLY   A N    1 1 
ATOM   1685 C  CA   . GLY   A 1 120 ? 8.27    32.181  -26.955 1   57.3   ? 810  GLY   A CA   1 1 
ATOM   1686 C  C    . GLY   A 1 120 ? 8.345   30.824  -27.633 1   56.14  ? 810  GLY   A C    1 1 
ATOM   1687 O  O    . GLY   A 1 120 ? 7.957   29.806  -27.053 1   56.3   ? 810  GLY   A O    1 1 
ATOM   1688 H  H    . GLY   A 1 120 ? 8.184   31.917  -24.903 0   74.76  ? 810  GLY   A H    1 1 
ATOM   1689 H  HA2  . GLY   A 1 120 ? 7.787   32.885  -27.632 0   74.6   ? 810  GLY   A HA2  1 1 
ATOM   1690 H  HA3  . GLY   A 1 120 ? 9.288   32.526  -26.782 0   75.42  ? 810  GLY   A HA3  1 1 
ATOM   1691 N  N    . SER   A 1 121 ? 8.859   30.797  -28.868 1   54.89  ? 811  SER   A N    1 1 
ATOM   1692 C  CA   . SER   A 1 121 ? 8.991   29.568  -29.648 1   54.03  ? 811  SER   A CA   1 1 
ATOM   1693 C  C    . SER   A 1 121 ? 9.993   28.576  -29.043 1   52.92  ? 811  SER   A C    1 1 
ATOM   1694 O  O    . SER   A 1 121 ? 9.795   27.366  -29.162 1   52.92  ? 811  SER   A O    1 1 
ATOM   1695 C  CB   . SER   A 1 121 ? 9.399   29.897  -31.079 1   55.35  ? 811  SER   A CB   1 1 
ATOM   1696 O  OG   . SER   A 1 121 ? 10.571  30.696  -31.122 1   57.65  ? 811  SER   A OG   1 1 
ATOM   1697 H  H    . SER   A 1 121 ? 9.194   31.622  -29.355 0   70.23  ? 811  SER   A H    1 1 
ATOM   1698 H  HA   . SER   A 1 121 ? 8.021   29.074  -29.686 0   63.65  ? 811  SER   A HA   1 1 
ATOM   1699 H  HB2  . SER   A 1 121 ? 9.595   28.966  -31.61  0   65.86  ? 811  SER   A HB2  1 1 
ATOM   1700 H  HB3  . SER   A 1 121 ? 8.586   30.443  -31.555 0   67.47  ? 811  SER   A HB3  1 1 
ATOM   1701 H  HG   . SER   A 1 121 ? 10.339  31.659  -31.046 0   73.76  ? 811  SER   A HG   1 1 
ATOM   1702 N  N    . GLN   A 1 122 ? 11.069  29.082  -28.415 1   51.62  ? 812  GLN   A N    1 1 
ATOM   1703 C  CA   . GLN   A 1 122 ? 12.092  28.239  -27.798 1   50.75  ? 812  GLN   A CA   1 1 
ATOM   1704 C  C    . GLN   A 1 122 ? 11.486  27.373  -26.69  1   49.61  ? 812  GLN   A C    1 1 
ATOM   1705 O  O    . GLN   A 1 122 ? 11.774  26.184  -26.635 1   49.58  ? 812  GLN   A O    1 1 
ATOM   1706 C  CB   . GLN   A 1 122 ? 13.24   29.113  -27.251 1   52.08  ? 812  GLN   A CB   1 1 
ATOM   1707 C  CG   . GLN   A 1 122 ? 14.464  28.348  -26.736 1   54.96  ? 812  GLN   A CG   1 1 
ATOM   1708 C  CD   . GLN   A 1 122 ? 15.24   27.663  -27.836 1   58.9   ? 812  GLN   A CD   1 1 
ATOM   1709 O  OE1  . GLN   A 1 122 ? 16.126  28.256  -28.458 1   60.54  ? 812  GLN   A OE1  1 1 
ATOM   1710 N  NE2  . GLN   A 1 122 ? 14.938  26.396  -28.104 1   59.19  ? 812  GLN   A NE2  1 1 
ATOM   1711 H  H    . GLN   A 1 122 ? 11.266  30.074  -28.328 0   66.37  ? 812  GLN   A H    1 1 
ATOM   1712 H  HA   . GLN   A 1 122 ? 12.495  27.574  -28.56  0   62.79  ? 812  GLN   A HA   1 1 
ATOM   1713 H  HB2  . GLN   A 1 122 ? 13.584  29.773  -28.046 0   69.39  ? 812  GLN   A HB2  1 1 
ATOM   1714 H  HB3  . GLN   A 1 122 ? 12.856  29.708  -26.424 0   68.69  ? 812  GLN   A HB3  1 1 
ATOM   1715 H  HG2  . GLN   A 1 122 ? 15.136  29.062  -26.262 0   73.76  ? 812  GLN   A HG2  1 1 
ATOM   1716 H  HG3  . GLN   A 1 122 ? 14.161  27.601  -26.003 0   69.89  ? 812  GLN   A HG3  1 1 
ATOM   1717 H  HE21 . GLN   A 1 122 ? 14.209  25.916  -27.585 0   71.43  ? 812  GLN   A HE21 1 1 
ATOM   1718 H  HE22 . GLN   A 1 122 ? 15.439  25.904  -28.837 0   73.19  ? 812  GLN   A HE22 1 1 
ATOM   1719 N  N    . TYR   A 1 123 ? 10.641  27.955  -25.825 1   48.49  ? 813  TYR   A N    1 1 
ATOM   1720 C  CA   . TYR   A 1 123 ? 9.987   27.212  -24.744 1   47.82  ? 813  TYR   A CA   1 1 
ATOM   1721 C  C    . TYR   A 1 123 ? 9.024   26.136  -25.263 1   46.28  ? 813  TYR   A C    1 1 
ATOM   1722 O  O    . TYR   A 1 123 ? 9.001   25.032  -24.721 1   46.47  ? 813  TYR   A O    1 1 
ATOM   1723 C  CB   . TYR   A 1 123 ? 9.211   28.168  -23.818 1   48.22  ? 813  TYR   A CB   1 1 
ATOM   1724 C  CG   . TYR   A 1 123 ? 10.08   28.954  -22.862 1   49.5   ? 813  TYR   A CG   1 1 
ATOM   1725 C  CD1  . TYR   A 1 123 ? 10.378  28.463  -21.601 1   50.55  ? 813  TYR   A CD1  1 1 
ATOM   1726 C  CD2  . TYR   A 1 123 ? 10.555  30.213  -23.198 1   50.68  ? 813  TYR   A CD2  1 1 
ATOM   1727 C  CE1  . TYR   A 1 123 ? 11.149  29.192  -20.706 1   51.65  ? 813  TYR   A CE1  1 1 
ATOM   1728 C  CE2  . TYR   A 1 123 ? 11.334  30.95   -22.314 1   51.77  ? 813  TYR   A CE2  1 1 
ATOM   1729 C  CZ   . TYR   A 1 123 ? 11.625  30.437  -21.064 1   52.8   ? 813  TYR   A CZ   1 1 
ATOM   1730 O  OH   . TYR   A 1 123 ? 12.388  31.15   -20.166 1   54.76  ? 813  TYR   A OH   1 1 
ATOM   1731 H  H    . TYR   A 1 123 ? 10.41   28.943  -25.838 0   60.96  ? 813  TYR   A H    1 1 
ATOM   1732 H  HA   . TYR   A 1 123 ? 10.753  26.707  -24.157 0   57.58  ? 813  TYR   A HA   1 1 
ATOM   1733 H  HB2  . TYR   A 1 123 ? 8.643   28.877  -24.419 0   59.42  ? 813  TYR   A HB2  1 1 
ATOM   1734 H  HB3  . TYR   A 1 123 ? 8.523   27.576  -23.216 0   57.56  ? 813  TYR   A HB3  1 1 
ATOM   1735 H  HD1  . TYR   A 1 123 ? 10.008  27.494  -21.312 0   61.89  ? 813  TYR   A HD1  1 1 
ATOM   1736 H  HD2  . TYR   A 1 123 ? 10.328  30.621  -24.168 0   66.85  ? 813  TYR   A HD2  1 1 
ATOM   1737 H  HE1  . TYR   A 1 123 ? 11.376  28.786  -19.734 0   67.54  ? 813  TYR   A HE1  1 1 
ATOM   1738 H  HE2  . TYR   A 1 123 ? 11.697  31.921  -22.606 0   72.87  ? 813  TYR   A HE2  1 1 
ATOM   1739 H  HH   . TYR   A 1 123 ? 12.483  32.094  -20.457 0   78.08  ? 813  TYR   A HH   1 1 
ATOM   1740 N  N    . LEU   A 1 124 ? 8.215   26.458  -26.283 1   44.66  ? 814  LEU   A N    1 1 
ATOM   1741 C  CA   . LEU   A 1 124 ? 7.255   25.499  -26.829 1   43.57  ? 814  LEU   A CA   1 1 
ATOM   1742 C  C    . LEU   A 1 124 ? 7.948   24.29   -27.441 1   42.5   ? 814  LEU   A C    1 1 
ATOM   1743 O  O    . LEU   A 1 124 ? 7.499   23.162  -27.231 1   42.56  ? 814  LEU   A O    1 1 
ATOM   1744 C  CB   . LEU   A 1 124 ? 6.347   26.16   -27.884 1   43.56  ? 814  LEU   A CB   1 1 
ATOM   1745 C  CG   . LEU   A 1 124 ? 5.253   27.1    -27.354 1   44.69  ? 814  LEU   A CG   1 1 
ATOM   1746 C  CD1  . LEU   A 1 124 ? 4.788   28.071  -28.429 1   45.09  ? 814  LEU   A CD1  1 1 
ATOM   1747 C  CD2  . LEU   A 1 124 ? 4.067   26.324  -26.798 1   45.28  ? 814  LEU   A CD2  1 1 
ATOM   1748 H  H    . LEU   A 1 124 ? 8.205   27.365  -26.737 0   52.3   ? 814  LEU   A H    1 1 
ATOM   1749 H  HA   . LEU   A 1 124 ? 6.634   25.141  -26.009 0   47.14  ? 814  LEU   A HA   1 1 
ATOM   1750 H  HB2  . LEU   A 1 124 ? 6.981   26.723  -28.568 0   48.99  ? 814  LEU   A HB2  1 1 
ATOM   1751 H  HB3  . LEU   A 1 124 ? 5.852   25.366  -28.441 0   46.53  ? 814  LEU   A HB3  1 1 
ATOM   1752 H  HG   . LEU   A 1 124 ? 5.663   27.693  -26.538 0   51.29  ? 814  LEU   A HG   1 1 
ATOM   1753 H  HD11 . LEU   A 1 124 ? 4.01    28.712  -28.018 0   52.42  ? 814  LEU   A HD11 1 1 
ATOM   1754 H  HD12 . LEU   A 1 124 ? 5.635   28.677  -28.749 0   52.78  ? 814  LEU   A HD12 1 1 
ATOM   1755 H  HD13 . LEU   A 1 124 ? 4.397   27.505  -29.273 0   50.34  ? 814  LEU   A HD13 1 1 
ATOM   1756 H  HD21 . LEU   A 1 124 ? 3.289   27.03   -26.51  0   50.12  ? 814  LEU   A HD21 1 1 
ATOM   1757 H  HD22 . LEU   A 1 124 ? 3.687   25.651  -27.565 0   48.02  ? 814  LEU   A HD22 1 1 
ATOM   1758 H  HD23 . LEU   A 1 124 ? 4.379   25.754  -25.924 0   48.56  ? 814  LEU   A HD23 1 1 
ATOM   1759 N  N    . LEU   A 1 125 ? 9.035   24.513  -28.189 1   41.39  ? 815  LEU   A N    1 1 
ATOM   1760 C  CA   . LEU   A 1 125 ? 9.768   23.412  -28.805 1   40.78  ? 815  LEU   A CA   1 1 
ATOM   1761 C  C    . LEU   A 1 125 ? 10.563  22.629  -27.757 1   39.95  ? 815  LEU   A C    1 1 
ATOM   1762 O  O    . LEU   A 1 125 ? 10.597  21.402  -27.837 1   40.09  ? 815  LEU   A O    1 1 
ATOM   1763 C  CB   . LEU   A 1 125 ? 10.67   23.915  -29.946 1   40.95  ? 815  LEU   A CB   1 1 
ATOM   1764 C  CG   . LEU   A 1 125 ? 9.926   24.429  -31.206 1   42.34  ? 815  LEU   A CG   1 1 
ATOM   1765 C  CD1  . LEU   A 1 125 ? 10.793  25.363  -32.015 1   42.9   ? 815  LEU   A CD1  1 1 
ATOM   1766 C  CD2  . LEU   A 1 125 ? 9.446   23.284  -32.089 1   42.88  ? 815  LEU   A CD2  1 1 
ATOM   1767 H  H    . LEU   A 1 125 ? 9.422   25.431  -28.382 0   47.01  ? 815  LEU   A H    1 1 
ATOM   1768 H  HA   . LEU   A 1 125 ? 9.041   22.728  -29.24  0   42.91  ? 815  LEU   A HA   1 1 
ATOM   1769 H  HB2  . LEU   A 1 125 ? 11.292  24.721  -29.56  0   47.53  ? 815  LEU   A HB2  1 1 
ATOM   1770 H  HB3  . LEU   A 1 125 ? 11.31   23.091  -30.26  0   45.82  ? 815  LEU   A HB3  1 1 
ATOM   1771 H  HG   . LEU   A 1 125 ? 9.048   24.998  -30.904 0   46.83  ? 815  LEU   A HG   1 1 
ATOM   1772 H  HD11 . LEU   A 1 125 ? 10.243  25.689  -32.896 0   49.46  ? 815  LEU   A HD11 1 1 
ATOM   1773 H  HD12 . LEU   A 1 125 ? 11.047  26.224  -31.399 0   51.01  ? 815  LEU   A HD12 1 1 
ATOM   1774 H  HD13 . LEU   A 1 125 ? 11.699  24.837  -32.313 0   50.07  ? 815  LEU   A HD13 1 1 
ATOM   1775 H  HD21 . LEU   A 1 125 ? 8.997   23.696  -32.991 0   45.94  ? 815  LEU   A HD21 1 1 
ATOM   1776 H  HD22 . LEU   A 1 125 ? 10.296  22.657  -32.354 0   46.31  ? 815  LEU   A HD22 1 1 
ATOM   1777 H  HD23 . LEU   A 1 125 ? 8.703   22.696  -31.552 0   44.7   ? 815  LEU   A HD23 1 1 
ATOM   1778 N  N    . ASN   A 1 126 ? 11.148  23.307  -26.746 1   38.93  ? 816  ASN   A N    1 1 
ATOM   1779 C  CA   . ASN   A 1 126 ? 11.86   22.597  -25.676 1   38.37  ? 816  ASN   A CA   1 1 
ATOM   1780 C  C    . ASN   A 1 126 ? 10.89   21.723  -24.875 1   37.08  ? 816  ASN   A C    1 1 
ATOM   1781 O  O    . ASN   A 1 126 ? 11.258  20.605  -24.525 1   37.2   ? 816  ASN   A O    1 1 
ATOM   1782 C  CB   . ASN   A 1 126 ? 12.599  23.555  -24.732 1   39.96  ? 816  ASN   A CB   1 1 
ATOM   1783 C  CG   . ASN   A 1 126 ? 13.866  24.147  -25.31  1   43.89  ? 816  ASN   A CG   1 1 
ATOM   1784 O  OD1  . ASN   A 1 126 ? 14.151  24.03   -26.506 1   45.24  ? 816  ASN   A OD1  1 1 
ATOM   1785 N  ND2  . ASN   A 1 126 ? 14.651  24.818  -24.476 1   44.75  ? 816  ASN   A ND2  1 1 
ATOM   1786 H  H    . ASN   A 1 126 ? 11.164  24.317  -26.654 0   45.21  ? 816  ASN   A H    1 1 
ATOM   1787 H  HA   . ASN   A 1 126 ? 12.602  21.939  -26.128 0   44.03  ? 816  ASN   A HA   1 1 
ATOM   1788 H  HB2  . ASN   A 1 126 ? 11.936  24.377  -24.465 0   47.73  ? 816  ASN   A HB2  1 1 
ATOM   1789 H  HB3  . ASN   A 1 126 ? 12.877  23.005  -23.834 0   47.46  ? 816  ASN   A HB3  1 1 
ATOM   1790 H  HD21 . ASN   A 1 126 ? 15.511  25.233  -24.819 0   58.75  ? 816  ASN   A HD21 1 1 
ATOM   1791 H  HD22 . ASN   A 1 126 ? 14.4    24.918  -23.497 0   56.86  ? 816  ASN   A HD22 1 1 
ATOM   1792 N  N    . TRP   A 1 127 ? 9.65    22.194  -24.618 1   35.63  ? 817  TRP   A N    1 1 
ATOM   1793 C  CA   . TRP   A 1 127 ? 8.659   21.384  -23.901 1   34.73  ? 817  TRP   A CA   1 1 
ATOM   1794 C  C    . TRP   A 1 127 ? 8.313   20.13   -24.707 1   33.74  ? 817  TRP   A C    1 1 
ATOM   1795 O  O    . TRP   A 1 127 ? 8.2     19.055  -24.128 1   33.83  ? 817  TRP   A O    1 1 
ATOM   1796 C  CB   . TRP   A 1 127 ? 7.38    22.186  -23.594 1   34.59  ? 817  TRP   A CB   1 1 
ATOM   1797 C  CG   . TRP   A 1 127 ? 7.554   23.319  -22.618 1   35.07  ? 817  TRP   A CG   1 1 
ATOM   1798 C  CD1  . TRP   A 1 127 ? 8.421   23.379  -21.564 1   35.95  ? 817  TRP   A CD1  1 1 
ATOM   1799 C  CD2  . TRP   A 1 127 ? 6.755   24.506  -22.546 1   35.12  ? 817  TRP   A CD2  1 1 
ATOM   1800 N  NE1  . TRP   A 1 127 ? 8.253   24.559  -20.882 1   36.23  ? 817  TRP   A NE1  1 1 
ATOM   1801 C  CE2  . TRP   A 1 127 ? 7.232   25.268  -21.46  1   35.9   ? 817  TRP   A CE2  1 1 
ATOM   1802 C  CE3  . TRP   A 1 127 ? 5.683   25.003  -23.296 1   35.6   ? 817  TRP   A CE3  1 1 
ATOM   1803 C  CZ2  . TRP   A 1 127 ? 6.688   26.506  -21.123 1   36.41  ? 817  TRP   A CZ2  1 1 
ATOM   1804 C  CZ3  . TRP   A 1 127 ? 5.141   26.224  -22.953 1   36.34  ? 817  TRP   A CZ3  1 1 
ATOM   1805 C  CH2  . TRP   A 1 127 ? 5.645   26.962  -21.881 1   36.45  ? 817  TRP   A CH2  1 1 
ATOM   1806 H  H    . TRP   A 1 127 ? 9.314   23.116  -24.88  0   39     ? 817  TRP   A H    1 1 
ATOM   1807 H  HA   . TRP   A 1 127 ? 9.093   21.053  -22.958 0   36.37  ? 817  TRP   A HA   1 1 
ATOM   1808 H  HB2  . TRP   A 1 127 ? 7.003   22.606  -24.525 0   35.72  ? 817  TRP   A HB2  1 1 
ATOM   1809 H  HB3  . TRP   A 1 127 ? 6.638   21.507  -23.176 0   34.73  ? 817  TRP   A HB3  1 1 
ATOM   1810 H  HD1  . TRP   A 1 127 ? 9.176   22.648  -21.325 0   39.64  ? 817  TRP   A HD1  1 1 
ATOM   1811 H  HE1  . TRP   A 1 127 ? 8.813   24.867  -20.059 0   42.98  ? 817  TRP   A HE1  1 1 
ATOM   1812 H  HE3  . TRP   A 1 127 ? 5.298   24.448  -24.135 0   38.12  ? 817  TRP   A HE3  1 1 
ATOM   1813 H  HZ2  . TRP   A 1 127 ? 7.059   27.07   -20.283 0   45.27  ? 817  TRP   A HZ2  1 1 
ATOM   1814 H  HZ3  . TRP   A 1 127 ? 4.331   26.627  -23.539 0   41.82  ? 817  TRP   A HZ3  1 1 
ATOM   1815 H  HH2  . TRP   A 1 127 ? 5.197   27.91   -21.64  0   45.16  ? 817  TRP   A HH2  1 1 
ATOM   1816 N  N    . CYS   A 1 128 ? 8.184   20.257  -26.037 1   32.74  ? 818  CYS   A N    1 1 
ATOM   1817 C  CA   . CYS   A 1 128 ? 7.924   19.121  -26.918 1   32.27  ? 818  CYS   A CA   1 1 
ATOM   1818 C  C    . CYS   A 1 128 ? 9.076   18.122  -26.854 1   32     ? 818  CYS   A C    1 1 
ATOM   1819 O  O    . CYS   A 1 128 ? 8.823   16.923  -26.842 1   32.24  ? 818  CYS   A O    1 1 
ATOM   1820 C  CB   . CYS   A 1 128 ? 7.685   19.593  -28.349 1   32.55  ? 818  CYS   A CB   1 1 
ATOM   1821 S  SG   . CYS   A 1 128 ? 6.241   20.667  -28.543 1   34.59  ? 818  CYS   A SG   1 1 
ATOM   1822 H  H    . CYS   A 1 128 ? 8.237   21.14   -26.536 0   33     ? 818  CYS   A H    1 1 
ATOM   1823 H  HA   . CYS   A 1 128 ? 7.023   18.611  -26.579 0   29.89  ? 818  CYS   A HA   1 1 
ATOM   1824 H  HB2  . CYS   A 1 128 ? 8.559   20.149  -28.685 0   32.12  ? 818  CYS   A HB2  1 1 
ATOM   1825 H  HB3  . CYS   A 1 128 ? 7.536   18.721  -28.984 0   30.51  ? 818  CYS   A HB3  1 1 
ATOM   1826 H  HG   . CYS   A 1 128 ? 6.152   21.055  -29.821 0   33.44  ? 818  CYS   A HG   1 1 
ATOM   1827 N  N    . VAL   A 1 129 ? 10.331  18.611  -26.82  1   31.45  ? 819  VAL   A N    1 1 
ATOM   1828 C  CA   . VAL   A 1 129 ? 11.527  17.765  -26.708 1   31.37  ? 819  VAL   A CA   1 1 
ATOM   1829 C  C    . VAL   A 1 129 ? 11.483  17.01   -25.367 1   31.26  ? 819  VAL   A C    1 1 
ATOM   1830 O  O    . VAL   A 1 129 ? 11.677  15.797  -25.338 1   31.31  ? 819  VAL   A O    1 1 
ATOM   1831 C  CB   . VAL   A 1 129 ? 12.84   18.608  -26.82  1   31.93  ? 819  VAL   A CB   1 1 
ATOM   1832 C  CG1  . VAL   A 1 129 ? 14.073  17.803  -26.4   1   32.28  ? 819  VAL   A CG1  1 1 
ATOM   1833 C  CG2  . VAL   A 1 129 ? 13.019  19.171  -28.22  1   32.3   ? 819  VAL   A CG2  1 1 
ATOM   1834 H  H    . VAL   A 1 129 ? 10.54   19.604  -26.853 0   32.67  ? 819  VAL   A H    1 1 
ATOM   1835 H  HA   . VAL   A 1 129 ? 11.523  17.032  -27.513 0   32.45  ? 819  VAL   A HA   1 1 
ATOM   1836 H  HB   . VAL   A 1 129 ? 12.767  19.454  -26.138 0   35.78  ? 819  VAL   A HB   1 1 
ATOM   1837 H  HG11 . VAL   A 1 129 ? 14.975  18.265  -26.798 0   38.82  ? 819  VAL   A HG11 1 1 
ATOM   1838 H  HG12 . VAL   A 1 129 ? 14.14   17.793  -25.313 0   36.88  ? 819  VAL   A HG12 1 1 
ATOM   1839 H  HG13 . VAL   A 1 129 ? 13.983  16.785  -26.778 0   36.94  ? 819  VAL   A HG13 1 1 
ATOM   1840 H  HG21 . VAL   A 1 129 ? 13.958  19.72   -28.271 0   37.96  ? 819  VAL   A HG21 1 1 
ATOM   1841 H  HG22 . VAL   A 1 129 ? 13.026  18.35   -28.935 0   35.95  ? 819  VAL   A HG22 1 1 
ATOM   1842 H  HG23 . VAL   A 1 129 ? 12.193  19.847  -28.434 0   35.53  ? 819  VAL   A HG23 1 1 
ATOM   1843 N  N    . GLN   A 1 130 ? 11.224  17.733  -24.269 1   31.01  ? 820  GLN   A N    1 1 
ATOM   1844 C  CA   . GLN   A 1 130 ? 11.216  17.178  -22.914 1   31.22  ? 820  GLN   A CA   1 1 
ATOM   1845 C  C    . GLN   A 1 130 ? 10.105  16.157  -22.687 1   31.34  ? 820  GLN   A C    1 1 
ATOM   1846 O  O    . GLN   A 1 130 ? 10.351  15.132  -22.047 1   31.62  ? 820  GLN   A O    1 1 
ATOM   1847 C  CB   . GLN   A 1 130 ? 11.141  18.305  -21.866 1   32.41  ? 820  GLN   A CB   1 1 
ATOM   1848 C  CG   . GLN   A 1 130 ? 12.405  19.166  -21.819 1   34.8   ? 820  GLN   A CG   1 1 
ATOM   1849 C  CD   . GLN   A 1 130 ? 12.221  20.424  -21.016 1   38.75  ? 820  GLN   A CD   1 1 
ATOM   1850 O  OE1  . GLN   A 1 130 ? 11.375  20.503  -20.122 1   40.29  ? 820  GLN   A OE1  1 1 
ATOM   1851 N  NE2  . GLN   A 1 130 ? 13.017  21.444  -21.308 1   39.19  ? 820  GLN   A NE2  1 1 
ATOM   1852 H  H    . GLN   A 1 130 ? 10.994  18.721  -24.298 0   32.5   ? 820  GLN   A H    1 1 
ATOM   1853 H  HA   . GLN   A 1 130 ? 12.165  16.662  -22.771 0   33.3   ? 820  GLN   A HA   1 1 
ATOM   1854 H  HB2  . GLN   A 1 130 ? 10.297  18.953  -22.094 0   33.7   ? 820  GLN   A HB2  1 1 
ATOM   1855 H  HB3  . GLN   A 1 130 ? 11.007  17.858  -20.882 0   34.1   ? 820  GLN   A HB3  1 1 
ATOM   1856 H  HG2  . GLN   A 1 130 ? 13.207  18.588  -21.361 0   39.61  ? 820  GLN   A HG2  1 1 
ATOM   1857 H  HG3  . GLN   A 1 130 ? 12.684  19.452  -22.831 0   39.1   ? 820  GLN   A HG3  1 1 
ATOM   1858 H  HE21 . GLN   A 1 130 ? 13.717  21.367  -22.039 0   46.71  ? 820  GLN   A HE21 1 1 
ATOM   1859 H  HE22 . GLN   A 1 130 ? 12.927  22.313  -20.791 0   47.02  ? 820  GLN   A HE22 1 1 
ATOM   1860 N  N    . ILE   A 1 131 ? 8.903   16.396  -23.234 1   30.9   ? 821  ILE   A N    1 1 
ATOM   1861 C  CA   . ILE   A 1 131 ? 7.804   15.435  -23.098 1   30.91  ? 821  ILE   A CA   1 1 
ATOM   1862 C  C    . ILE   A 1 131 ? 8.181   14.164  -23.893 1   30.99  ? 821  ILE   A C    1 1 
ATOM   1863 O  O    . ILE   A 1 131 ? 7.997   13.063  -23.383 1   31.35  ? 821  ILE   A O    1 1 
ATOM   1864 C  CB   . ILE   A 1 131 ? 6.424   16.052  -23.5   1   31.32  ? 821  ILE   A CB   1 1 
ATOM   1865 C  CG1  . ILE   A 1 131 ? 5.998   17.165  -22.494 1   32.14  ? 821  ILE   A CG1  1 1 
ATOM   1866 C  CG2  . ILE   A 1 131 ? 5.333   14.965  -23.575 1   31.75  ? 821  ILE   A CG2  1 1 
ATOM   1867 C  CD1  . ILE   A 1 131 ? 5.047   18.229  -23.079 1   33.48  ? 821  ILE   A CD1  1 1 
ATOM   1868 H  H    . ILE   A 1 131 ? 8.671   17.221  -23.778 0   29.4   ? 821  ILE   A H    1 1 
ATOM   1869 H  HA   . ILE   A 1 131 ? 7.722   15.148  -22.05  0   28.19  ? 821  ILE   A HA   1 1 
ATOM   1870 H  HB   . ILE   A 1 131 ? 6.525   16.497  -24.488 0   27.9   ? 821  ILE   A HB   1 1 
ATOM   1871 H  HG12 . ILE   A 1 131 ? 5.488   16.702  -21.65  0   28.78  ? 821  ILE   A HG12 1 1 
ATOM   1872 H  HG13 . ILE   A 1 131 ? 6.881   17.692  -22.135 0   29.87  ? 821  ILE   A HG13 1 1 
ATOM   1873 H  HG21 . ILE   A 1 131 ? 4.355   15.429  -23.695 0   27.11  ? 821  ILE   A HG21 1 1 
ATOM   1874 H  HG22 . ILE   A 1 131 ? 5.524   14.32   -24.43  0   27.34  ? 821  ILE   A HG22 1 1 
ATOM   1875 H  HG23 . ILE   A 1 131 ? 5.354   14.38   -22.657 0   27.41  ? 821  ILE   A HG23 1 1 
ATOM   1876 H  HD11 . ILE   A 1 131 ? 4.989   19.075  -22.397 0   30.94  ? 821  ILE   A HD11 1 1 
ATOM   1877 H  HD12 . ILE   A 1 131 ? 5.436   18.559  -24.041 0   30.72  ? 821  ILE   A HD12 1 1 
ATOM   1878 H  HD13 . ILE   A 1 131 ? 4.059   17.79   -23.211 0   29.73  ? 821  ILE   A HD13 1 1 
ATOM   1879 N  N    . ALA   A 1 132 ? 8.78    14.309  -25.092 1   30.6   ? 822  ALA   A N    1 1 
ATOM   1880 C  CA   . ALA   A 1 132 ? 9.227   13.157  -25.875 1   30.89  ? 822  ALA   A CA   1 1 
ATOM   1881 C  C    . ALA   A 1 132 ? 10.37   12.39   -25.178 1   31.2   ? 822  ALA   A C    1 1 
ATOM   1882 O  O    . ALA   A 1 132 ? 10.425  11.169  -25.296 1   31.31  ? 822  ALA   A O    1 1 
ATOM   1883 C  CB   . ALA   A 1 132 ? 9.663   13.6    -27.261 1   30.92  ? 822  ALA   A CB   1 1 
ATOM   1884 H  H    . ALA   A 1 132 ? 8.947   15.197  -25.555 0   28.55  ? 822  ALA   A H    1 1 
ATOM   1885 H  HA   . ALA   A 1 132 ? 8.393   12.467  -25.995 0   28.3   ? 822  ALA   A HA   1 1 
ATOM   1886 H  HB1  . ALA   A 1 132 ? 9.981   12.727  -27.829 0   29.93  ? 822  ALA   A HB1  1 1 
ATOM   1887 H  HB2  . ALA   A 1 132 ? 8.821   14.08   -27.758 0   28.69  ? 822  ALA   A HB2  1 1 
ATOM   1888 H  HB3  . ALA   A 1 132 ? 10.489  14.304  -27.168 0   30.28  ? 822  ALA   A HB3  1 1 
ATOM   1889 N  N    . LYS   A 1 133 ? 11.276  13.09   -24.463 1   31.18  ? 823  LYS   A N    1 1 
ATOM   1890 C  CA   . LYS   A 1 133 ? 12.359  12.435  -23.718 1   31.67  ? 823  LYS   A CA   1 1 
ATOM   1891 C  C    . LYS   A 1 133 ? 11.771  11.597  -22.581 1   32.08  ? 823  LYS   A C    1 1 
ATOM   1892 O  O    . LYS   A 1 133 ? 12.221  10.474  -22.355 1   32.39  ? 823  LYS   A O    1 1 
ATOM   1893 C  CB   . LYS   A 1 133 ? 13.36   13.457  -23.136 1   33.38  ? 823  LYS   A CB   1 1 
ATOM   1894 C  CG   . LYS   A 1 133 ? 14.359  14.023  -24.138 1   36.49  ? 823  LYS   A CG   1 1 
ATOM   1895 C  CD   . LYS   A 1 133 ? 15.302  15.011  -23.467 1   40.22  ? 823  LYS   A CD   1 1 
ATOM   1896 C  CE   . LYS   A 1 133 ? 16.312  15.595  -24.425 1   43.9   ? 823  LYS   A CE   1 1 
ATOM   1897 N  NZ   . LYS   A 1 133 ? 17.2    16.588  -23.763 1   46.1   ? 823  LYS   A NZ   1 1 
ATOM   1898 H  H    . LYS   A 1 133 ? 11.296  14.103  -24.406 0   31.44  ? 823  LYS   A H    1 1 
ATOM   1899 H  HA   . LYS   A 1 133 ? 12.897  11.765  -24.387 0   34.16  ? 823  LYS   A HA   1 1 
ATOM   1900 H  HB2  . LYS   A 1 133 ? 12.809  14.295  -22.712 0   35.72  ? 823  LYS   A HB2  1 1 
ATOM   1901 H  HB3  . LYS   A 1 133 ? 13.931  12.967  -22.349 0   37.28  ? 823  LYS   A HB3  1 1 
ATOM   1902 H  HG2  . LYS   A 1 133 ? 14.952  13.213  -24.559 0   41.87  ? 823  LYS   A HG2  1 1 
ATOM   1903 H  HG3  . LYS   A 1 133 ? 13.817  14.547  -24.924 0   40.18  ? 823  LYS   A HG3  1 1 
ATOM   1904 H  HD2  . LYS   A 1 133 ? 14.718  15.833  -23.055 0   45.67  ? 823  LYS   A HD2  1 1 
ATOM   1905 H  HD3  . LYS   A 1 133 ? 15.845  14.503  -22.671 0   47.28  ? 823  LYS   A HD3  1 1 
ATOM   1906 H  HE2  . LYS   A 1 133 ? 16.933  14.796  -24.827 0   52.84  ? 823  LYS   A HE2  1 1 
ATOM   1907 H  HE3  . LYS   A 1 133 ? 15.781  16.1    -25.231 0   51.01  ? 823  LYS   A HE3  1 1 
ATOM   1908 H  HZ1  . LYS   A 1 133 ? 17.781  17.049  -24.456 0   56.9   ? 823  LYS   A HZ1  1 1 
ATOM   1909 H  HZ2  . LYS   A 1 133 ? 16.643  17.285  -23.28  0   55.25  ? 823  LYS   A HZ2  1 1 
ATOM   1910 H  HZ3  . LYS   A 1 133 ? 17.801  16.122  -23.091 0   57.42  ? 823  LYS   A HZ3  1 1 
ATOM   1911 N  N    . GLY   A 1 134 ? 10.786  12.145  -21.874 1   31.91  ? 824  GLY   A N    1 1 
ATOM   1912 C  CA   . GLY   A 1 134 ? 10.12   11.432  -20.793 1   32.31  ? 824  GLY   A CA   1 1 
ATOM   1913 C  C    . GLY   A 1 134 ? 9.332   10.232  -21.283 1   32.28  ? 824  GLY   A C    1 1 
ATOM   1914 O  O    . GLY   A 1 134 ? 9.372   9.166   -20.663 1   32.58  ? 824  GLY   A O    1 1 
ATOM   1915 H  H    . GLY   A 1 134 ? 10.442  13.092  -21.998 0   31.41  ? 824  GLY   A H    1 1 
ATOM   1916 H  HA2  . GLY   A 1 134 ? 10.865  11.08   -20.08  0   32.73  ? 824  GLY   A HA2  1 1 
ATOM   1917 H  HA3  . GLY   A 1 134 ? 9.441   12.107  -20.275 0   31.1   ? 824  GLY   A HA3  1 1 
ATOM   1918 N  N    . MET   A 1 135 ? 8.624   10.386  -22.41  1   32.02  ? 825  MET   A N    1 1 
ATOM   1919 C  CA   . MET   A 1 135 ? 7.842   9.297   -22.988 1   32.18  ? 825  MET   A CA   1 1 
ATOM   1920 C  C    . MET   A 1 135 ? 8.745   8.21    -23.553 1   32.64  ? 825  MET   A C    1 1 
ATOM   1921 O  O    . MET   A 1 135 ? 8.407   7.035   -23.435 1   32.49  ? 825  MET   A O    1 1 
ATOM   1922 C  CB   . MET   A 1 135 ? 6.904   9.815   -24.088 1   32.77  ? 825  MET   A CB   1 1 
ATOM   1923 C  CG   . MET   A 1 135 ? 5.74    10.656  -23.58  1   34.3   ? 825  MET   A CG   1 1 
ATOM   1924 S  SD   . MET   A 1 135 ? 4.698   9.899   -22.294 1   36.36  ? 825  MET   A SD   1 1 
ATOM   1925 C  CE   . MET   A 1 135 ? 3.958   8.594   -23.206 1   34.6   ? 825  MET   A CE   1 1 
ATOM   1926 H  H    . MET   A 1 135 ? 8.576   11.254  -22.934 0   29.85  ? 825  MET   A H    1 1 
ATOM   1927 H  HA   . MET   A 1 135 ? 7.242   8.845   -22.201 0   29.91  ? 825  MET   A HA   1 1 
ATOM   1928 H  HB2  . MET   A 1 135 ? 7.48    10.437  -24.772 0   29.99  ? 825  MET   A HB2  1 1 
ATOM   1929 H  HB3  . MET   A 1 135 ? 6.506   8.964   -24.638 0   30     ? 825  MET   A HB3  1 1 
ATOM   1930 H  HG2  . MET   A 1 135 ? 6.14    11.581  -23.168 0   30.37  ? 825  MET   A HG2  1 1 
ATOM   1931 H  HG3  . MET   A 1 135 ? 5.103   10.886  -24.433 0   30     ? 825  MET   A HG3  1 1 
ATOM   1932 H  HE1  . MET   A 1 135 ? 3.083   8.234   -22.667 0   31.03  ? 825  MET   A HE1  1 1 
ATOM   1933 H  HE2  . MET   A 1 135 ? 3.668   8.987   -24.179 0   30.51  ? 825  MET   A HE2  1 1 
ATOM   1934 H  HE3  . MET   A 1 135 ? 4.68    7.789   -23.329 0   31.5   ? 825  MET   A HE3  1 1 
ATOM   1935 N  N    . ASN   A 1 136 ? 9.899   8.578   -24.14  1   32.83  ? 826  ASN   A N    1 1 
ATOM   1936 C  CA   . ASN   A 1 136 ? 10.852  7.592   -24.645 1   33.53  ? 826  ASN   A CA   1 1 
ATOM   1937 C  C    . ASN   A 1 136 ? 11.406  6.764   -23.484 1   33.95  ? 826  ASN   A C    1 1 
ATOM   1938 O  O    . ASN   A 1 136 ? 11.576  5.559   -23.637 1   34.12  ? 826  ASN   A O    1 1 
ATOM   1939 C  CB   . ASN   A 1 136 ? 11.985  8.27    -25.399 1   34.59  ? 826  ASN   A CB   1 1 
ATOM   1940 C  CG   . ASN   A 1 136 ? 12.991  7.3     -25.97  1   37.51  ? 826  ASN   A CG   1 1 
ATOM   1941 O  OD1  . ASN   A 1 136 ? 12.645  6.423   -26.768 1   38.8   ? 826  ASN   A OD1  1 1 
ATOM   1942 N  ND2  . ASN   A 1 136 ? 14.254  7.421   -25.576 1   37.92  ? 826  ASN   A ND2  1 1 
ATOM   1943 H  H    . ASN   A 1 136 ? 10.194  9.537   -24.297 0   32.78  ? 826  ASN   A H    1 1 
ATOM   1944 H  HA   . ASN   A 1 136 ? 10.341  6.918   -25.331 0   35.37  ? 826  ASN   A HA   1 1 
ATOM   1945 H  HB2  . ASN   A 1 136 ? 11.553  8.813   -26.237 0   36.66  ? 826  ASN   A HB2  1 1 
ATOM   1946 H  HB3  . ASN   A 1 136 ? 12.487  8.965   -24.728 0   37.65  ? 826  ASN   A HB3  1 1 
ATOM   1947 H  HD21 . ASN   A 1 136 ? 14.954  6.784   -25.942 0   46.31  ? 826  ASN   A HD21 1 1 
ATOM   1948 H  HD22 . ASN   A 1 136 ? 14.53   8.14    -24.915 0   44.44  ? 826  ASN   A HD22 1 1 
ATOM   1949 N  N    . TYR   A 1 137 ? 11.66   7.392   -22.322 1   34.32  ? 827  TYR   A N    1 1 
ATOM   1950 C  CA   . TYR   A 1 137 ? 12.115  6.672   -21.133 1   35.2   ? 827  TYR   A CA   1 1 
ATOM   1951 C  C    . TYR   A 1 137 ? 11.046  5.656   -20.698 1   35.71  ? 827  TYR   A C    1 1 
ATOM   1952 O  O    . TYR   A 1 137 ? 11.376  4.51    -20.403 1   35.93  ? 827  TYR   A O    1 1 
ATOM   1953 C  CB   . TYR   A 1 137 ? 12.426  7.652   -19.98  1   35.49  ? 827  TYR   A CB   1 1 
ATOM   1954 C  CG   . TYR   A 1 137 ? 12.688  6.95    -18.664 1   36.59  ? 827  TYR   A CG   1 1 
ATOM   1955 C  CD1  . TYR   A 1 137 ? 11.716  6.903   -17.673 1   37.43  ? 827  TYR   A CD1  1 1 
ATOM   1956 C  CD2  . TYR   A 1 137 ? 13.863  6.243   -18.453 1   37.74  ? 827  TYR   A CD2  1 1 
ATOM   1957 C  CE1  . TYR   A 1 137 ? 11.927  6.212   -16.488 1   38.43  ? 827  TYR   A CE1  1 1 
ATOM   1958 C  CE2  . TYR   A 1 137 ? 14.085  5.547   -17.273 1   38.66  ? 827  TYR   A CE2  1 1 
ATOM   1959 C  CZ   . TYR   A 1 137 ? 13.114  5.532   -16.29  1   39.53  ? 827  TYR   A CZ   1 1 
ATOM   1960 O  OH   . TYR   A 1 137 ? 13.331  4.838   -15.124 1   41.24  ? 827  TYR   A OH   1 1 
ATOM   1961 H  H    . TYR   A 1 137 ? 11.59   8.394   -22.18  0   36.37  ? 827  TYR   A H    1 1 
ATOM   1962 H  HA   . TYR   A 1 137 ? 13.026  6.126   -21.373 0   40.71  ? 827  TYR   A HA   1 1 
ATOM   1963 H  HB2  . TYR   A 1 137 ? 13.315  8.227   -20.235 0   40.01  ? 827  TYR   A HB2  1 1 
ATOM   1964 H  HB3  . TYR   A 1 137 ? 11.579  8.323   -19.841 0   37.76  ? 827  TYR   A HB3  1 1 
ATOM   1965 H  HD1  . TYR   A 1 137 ? 10.783  7.419   -17.82  0   39.55  ? 827  TYR   A HD1  1 1 
ATOM   1966 H  HD2  . TYR   A 1 137 ? 14.623  6.245   -19.216 0   45.62  ? 827  TYR   A HD2  1 1 
ATOM   1967 H  HE1  . TYR   A 1 137 ? 11.159  6.206   -15.732 0   42.15  ? 827  TYR   A HE1  1 1 
ATOM   1968 H  HE2  . TYR   A 1 137 ? 15.015  5.026   -17.128 0   48.35  ? 827  TYR   A HE2  1 1 
ATOM   1969 H  HH   . TYR   A 1 137 ? 12.658  5.084   -14.436 0   48.03  ? 827  TYR   A HH   1 1 
ATOM   1970 N  N    . LEU   A 1 138 ? 9.775   6.075   -20.681 1   35.73  ? 828  LEU   A N    1 1 
ATOM   1971 C  CA   . LEU   A 1 138 ? 8.665   5.207   -20.3   1   36.19  ? 828  LEU   A CA   1 1 
ATOM   1972 C  C    . LEU   A 1 138 ? 8.494   4.051   -21.299 1   36.8   ? 828  LEU   A C    1 1 
ATOM   1973 O  O    . LEU   A 1 138 ? 8.194   2.939   -20.879 1   36.91  ? 828  LEU   A O    1 1 
ATOM   1974 C  CB   . LEU   A 1 138 ? 7.361   6.022   -20.167 1   36.2   ? 828  LEU   A CB   1 1 
ATOM   1975 C  CG   . LEU   A 1 138 ? 7.317   7.105   -19.064 1   37.38  ? 828  LEU   A CG   1 1 
ATOM   1976 C  CD1  . LEU   A 1 138 ? 6.054   7.941   -19.183 1   37.94  ? 828  LEU   A CD1  1 1 
ATOM   1977 C  CD2  . LEU   A 1 138 ? 7.425   6.503   -17.66  1   37.88  ? 828  LEU   A CD2  1 1 
ATOM   1978 H  H    . LEU   A 1 138 ? 9.49    7.012   -20.95  0   36.44  ? 828  LEU   A H    1 1 
ATOM   1979 H  HA   . LEU   A 1 138 ? 8.899   4.753   -19.339 0   38.23  ? 828  LEU   A HA   1 1 
ATOM   1980 H  HB2  . LEU   A 1 138 ? 7.186   6.529   -21.115 0   35.38  ? 828  LEU   A HB2  1 1 
ATOM   1981 H  HB3  . LEU   A 1 138 ? 6.54    5.333   -19.978 0   35.97  ? 828  LEU   A HB3  1 1 
ATOM   1982 H  HG   . LEU   A 1 138 ? 8.165   7.775   -19.2   0   36.65  ? 828  LEU   A HG   1 1 
ATOM   1983 H  HD11 . LEU   A 1 138 ? 6.076   8.729   -18.432 0   35.49  ? 828  LEU   A HD11 1 1 
ATOM   1984 H  HD12 . LEU   A 1 138 ? 6.014   8.382   -20.178 0   35.33  ? 828  LEU   A HD12 1 1 
ATOM   1985 H  HD13 . LEU   A 1 138 ? 5.188   7.3     -19.025 0   35.7   ? 828  LEU   A HD13 1 1 
ATOM   1986 H  HD21 . LEU   A 1 138 ? 7.142   7.253   -16.923 0   37.24  ? 828  LEU   A HD21 1 1 
ATOM   1987 H  HD22 . LEU   A 1 138 ? 6.762   5.643   -17.588 0   37.59  ? 828  LEU   A HD22 1 1 
ATOM   1988 H  HD23 . LEU   A 1 138 ? 8.453   6.194   -17.477 0   38.7   ? 828  LEU   A HD23 1 1 
ATOM   1989 N  N    . GLU   A 1 139 ? 8.725   4.289   -22.601 1   37.23  ? 829  GLU   A N    1 1 
ATOM   1990 C  CA   . GLU   A 1 139 ? 8.666   3.239   -23.618 1   38.04  ? 829  GLU   A CA   1 1 
ATOM   1991 C  C    . GLU   A 1 139 ? 9.771   2.194   -23.355 1   39.09  ? 829  GLU   A C    1 1 
ATOM   1992 O  O    . GLU   A 1 139 ? 9.513   0.993   -23.468 1   39.31  ? 829  GLU   A O    1 1 
ATOM   1993 C  CB   . GLU   A 1 139 ? 8.816   3.847   -25.025 1   39.95  ? 829  GLU   A CB   1 1 
ATOM   1994 C  CG   . GLU   A 1 139 ? 8.731   2.821   -26.145 1   44.36  ? 829  GLU   A CG   1 1 
ATOM   1995 C  CD   . GLU   A 1 139 ? 8.671   3.381   -27.551 1   50.17  ? 829  GLU   A CD   1 1 
ATOM   1996 O  OE1  . GLU   A 1 139 ? 8.752   4.62    -27.708 1   51.24  ? 829  GLU   A OE1  1 1 
ATOM   1997 O  OE2  . GLU   A 1 139 ? 8.545   2.575   -28.501 1   52.16  ? 829  GLU   A OE2  1 1 
ATOM   1998 H  H    . GLU   A 1 139 ? 8.937   5.202   -22.991 0   38.95  ? 829  GLU   A H    1 1 
ATOM   1999 H  HA   . GLU   A 1 139 ? 7.701   2.737   -23.564 0   41.43  ? 829  GLU   A HA   1 1 
ATOM   2000 H  HB2  . GLU   A 1 139 ? 8.017   4.573   -25.17  0   41.75  ? 829  GLU   A HB2  1 1 
ATOM   2001 H  HB3  . GLU   A 1 139 ? 9.784   4.341   -25.096 0   43.54  ? 829  GLU   A HB3  1 1 
ATOM   2002 H  HG2  . GLU   A 1 139 ? 9.611   2.182   -26.109 0   50.69  ? 829  GLU   A HG2  1 1 
ATOM   2003 H  HG3  . GLU   A 1 139 ? 7.835   2.22    -25.994 0   49.11  ? 829  GLU   A HG3  1 1 
ATOM   2004 N  N    . ASP   A 1 140 ? 10.99   2.646   -22.987 1   39.32  ? 830  ASP   A N    1 1 
ATOM   2005 C  CA   . ASP   A 1 140 ? 12.1    1.746   -22.666 1   40.11  ? 830  ASP   A CA   1 1 
ATOM   2006 C  C    . ASP   A 1 140 ? 11.79   0.884   -21.439 1   40.56  ? 830  ASP   A C    1 1 
ATOM   2007 O  O    . ASP   A 1 140 ? 12.222  -0.264  -21.39  1   40.71  ? 830  ASP   A O    1 1 
ATOM   2008 C  CB   . ASP   A 1 140 ? 13.401  2.533   -22.42  1   42.07  ? 830  ASP   A CB   1 1 
ATOM   2009 C  CG   . ASP   A 1 140 ? 14.033  3.138   -23.659 1   47.12  ? 830  ASP   A CG   1 1 
ATOM   2010 O  OD1  . ASP   A 1 140 ? 13.588  2.805   -24.781 1   48     ? 830  ASP   A OD1  1 1 
ATOM   2011 O  OD2  . ASP   A 1 140 ? 14.974  3.946   -23.508 1   49.48  ? 830  ASP   A OD2  1 1 
ATOM   2012 H  H    . ASP   A 1 140 ? 11.238  3.627   -22.922 0   45.03  ? 830  ASP   A H    1 1 
ATOM   2013 H  HA   . ASP   A 1 140 ? 12.257  1.065   -23.501 0   50.41  ? 830  ASP   A HA   1 1 
ATOM   2014 H  HB2  . ASP   A 1 140 ? 13.2    3.343   -21.721 0   50.58  ? 830  ASP   A HB2  1 1 
ATOM   2015 H  HB3  . ASP   A 1 140 ? 14.134  1.855   -21.984 0   53.77  ? 830  ASP   A HB3  1 1 
ATOM   2016 N  N    . ARG   A 1 141 ? 11.033  1.416   -20.461 1   40.69  ? 831  ARG   A N    1 1 
ATOM   2017 C  CA   . ARG   A 1 141 ? 10.652  0.659   -19.267 1   41.2   ? 831  ARG   A CA   1 1 
ATOM   2018 C  C    . ARG   A 1 141 ? 9.326   -0.114  -19.464 1   41.15  ? 831  ARG   A C    1 1 
ATOM   2019 O  O    . ARG   A 1 141 ? 8.683   -0.456  -18.471 1   41.42  ? 831  ARG   A O    1 1 
ATOM   2020 C  CB   . ARG   A 1 141 ? 10.531  1.596   -18.046 1   42.84  ? 831  ARG   A CB   1 1 
ATOM   2021 C  CG   . ARG   A 1 141 ? 11.752  2.483   -17.74  1   46.46  ? 831  ARG   A CG   1 1 
ATOM   2022 C  CD   . ARG   A 1 141 ? 13.101  1.776   -17.601 1   50.19  ? 831  ARG   A CD   1 1 
ATOM   2023 N  NE   . ARG   A 1 141 ? 13.038  0.479   -16.915 1   53.66  ? 831  ARG   A NE   1 1 
ATOM   2024 C  CZ   . ARG   A 1 141 ? 12.915  0.299   -15.599 1   56.11  ? 831  ARG   A CZ   1 1 
ATOM   2025 N  NH1  . ARG   A 1 141 ? 12.878  -0.928  -15.092 1   56.01  ? 831  ARG   A NH1  1 1 
ATOM   2026 N  NH2  . ARG   A 1 141 ? 12.821  1.344   -14.78  1   55.86  ? 831  ARG   A NH2  1 1 
ATOM   2027 H  H    . ARG   A 1 141 ? 10.659  2.36    -20.473 0   47.01  ? 831  ARG   A H    1 1 
ATOM   2028 H  HA   . ARG   A 1 141 ? 11.414  -0.086  -19.041 0   51.6   ? 831  ARG   A HA   1 1 
ATOM   2029 H  HB2  . ARG   A 1 141 ? 9.686   2.262   -18.214 0   48.26  ? 831  ARG   A HB2  1 1 
ATOM   2030 H  HB3  . ARG   A 1 141 ? 10.347  0.998   -17.155 0   50.53  ? 831  ARG   A HB3  1 1 
ATOM   2031 H  HG2  . ARG   A 1 141 ? 11.853  3.219   -18.536 0   53.18  ? 831  ARG   A HG2  1 1 
ATOM   2032 H  HG3  . ARG   A 1 141 ? 11.567  3       -16.799 0   53.19  ? 831  ARG   A HG3  1 1 
ATOM   2033 H  HD2  . ARG   A 1 141 ? 13.506  1.597   -18.596 0   61.04  ? 831  ARG   A HD2  1 1 
ATOM   2034 H  HD3  . ARG   A 1 141 ? 13.782  2.424   -17.051 0   60.56  ? 831  ARG   A HD3  1 1 
ATOM   2035 H  HE   . ARG   A 1 141 ? 13.113  -0.348  -17.498 0   66.63  ? 831  ARG   A HE   1 1 
ATOM   2036 H  HH11 . ARG   A 1 141 ? 12.95   -1.736  -15.701 0   70.92  ? 831  ARG   A HH11 1 1 
ATOM   2037 H  HH12 . ARG   A 1 141 ? 12.781  -1.067  -14.091 0   69.82  ? 831  ARG   A HH12 1 1 
ATOM   2038 H  HH21 . ARG   A 1 141 ? 12.841  2.303   -15.11  0   65.26  ? 831  ARG   A HH21 1 1 
ATOM   2039 H  HH22 . ARG   A 1 141 ? 12.723  1.184   -13.783 0   66.61  ? 831  ARG   A HH22 1 1 
ATOM   2040 N  N    . ARG   A 1 142 ? 8.935   -0.409  -20.728 1   40.61  ? 832  ARG   A N    1 1 
ATOM   2041 C  CA   . ARG   A 1 142 ? 7.708   -1.134  -21.074 1   40.49  ? 832  ARG   A CA   1 1 
ATOM   2042 C  C    . ARG   A 1 142 ? 6.46    -0.538  -20.395 1   39.85  ? 832  ARG   A C    1 1 
ATOM   2043 O  O    . ARG   A 1 142 ? 5.646   -1.281  -19.852 1   40.16  ? 832  ARG   A O    1 1 
ATOM   2044 C  CB   . ARG   A 1 142 ? 7.858   -2.635  -20.743 1   42.08  ? 832  ARG   A CB   1 1 
ATOM   2045 C  CG   . ARG   A 1 142 ? 9.143   -3.262  -21.285 1   45.42  ? 832  ARG   A CG   1 1 
ATOM   2046 C  CD   . ARG   A 1 142 ? 9.094   -4.782  -21.308 1   48.65  ? 832  ARG   A CD   1 1 
ATOM   2047 N  NE   . ARG   A 1 142 ? 8.109   -5.297  -22.266 1   51.64  ? 832  ARG   A NE   1 1 
ATOM   2048 C  CZ   . ARG   A 1 142 ? 8.283   -5.397  -23.586 1   53.95  ? 832  ARG   A CZ   1 1 
ATOM   2049 N  NH1  . ARG   A 1 142 ? 9.426   -5.009  -24.149 1   53.64  ? 832  ARG   A NH1  1 1 
ATOM   2050 N  NH2  . ARG   A 1 142 ? 7.312   -5.877  -24.355 1   54.01  ? 832  ARG   A NH2  1 1 
ATOM   2051 H  H    . ARG   A 1 142 ? 9.469   -0.172  -21.558 0   49.15  ? 832  ARG   A H    1 1 
ATOM   2052 H  HA   . ARG   A 1 142 ? 7.559   -1.054  -22.15  0   48.84  ? 832  ARG   A HA   1 1 
ATOM   2053 H  HB2  . ARG   A 1 142 ? 7.865   -2.758  -19.661 0   53.29  ? 832  ARG   A HB2  1 1 
ATOM   2054 H  HB3  . ARG   A 1 142 ? 7.008   -3.167  -21.169 0   53.64  ? 832  ARG   A HB3  1 1 
ATOM   2055 H  HG2  . ARG   A 1 142 ? 9.306   -2.916  -22.305 0   58.59  ? 832  ARG   A HG2  1 1 
ATOM   2056 H  HG3  . ARG   A 1 142 ? 9.979   -2.967  -20.652 0   58.99  ? 832  ARG   A HG3  1 1 
ATOM   2057 H  HD2  . ARG   A 1 142 ? 10.078  -5.18   -21.552 0   66.9   ? 832  ARG   A HD2  1 1 
ATOM   2058 H  HD3  . ARG   A 1 142 ? 8.8     -5.13   -20.319 0   65.39  ? 832  ARG   A HD3  1 1 
ATOM   2059 H  HE   . ARG   A 1 142 ? 7.221   -5.606  -21.883 0   68.49  ? 832  ARG   A HE   1 1 
ATOM   2060 H  HH11 . ARG   A 1 142 ? 10.201  -4.625  -23.618 0   71.44  ? 832  ARG   A HH11 1 1 
ATOM   2061 H  HH12 . ARG   A 1 142 ? 9.532   -5.09   -25.156 0   72.39  ? 832  ARG   A HH12 1 1 
ATOM   2062 H  HH21 . ARG   A 1 142 ? 6.435   -6.18   -23.943 0   72.3   ? 832  ARG   A HH21 1 1 
ATOM   2063 H  HH22 . ARG   A 1 142 ? 7.442   -5.954  -25.358 0   73.03  ? 832  ARG   A HH22 1 1 
ATOM   2064 N  N    . LEU   A 1 143 ? 6.307   0.796   -20.43  1   38.82  ? 833  LEU   A N    1 1 
ATOM   2065 C  CA   . LEU   A 1 143 ? 5.184   1.477   -19.784 1   38.23  ? 833  LEU   A CA   1 1 
ATOM   2066 C  C    . LEU   A 1 143 ? 4.378   2.305   -20.788 1   37.16  ? 833  LEU   A C    1 1 
ATOM   2067 O  O    . LEU   A 1 143 ? 4.925   3.203   -21.428 1   37     ? 833  LEU   A O    1 1 
ATOM   2068 C  CB   . LEU   A 1 143 ? 5.723   2.382   -18.641 1   38.59  ? 833  LEU   A CB   1 1 
ATOM   2069 C  CG   . LEU   A 1 143 ? 4.741   3.018   -17.616 1   40.25  ? 833  LEU   A CG   1 1 
ATOM   2070 C  CD1  . LEU   A 1 143 ? 4.021   4.242   -18.171 1   41.02  ? 833  LEU   A CD1  1 1 
ATOM   2071 C  CD2  . LEU   A 1 143 ? 3.743   2.017   -17.089 1   40.93  ? 833  LEU   A CD2  1 1 
ATOM   2072 H  H    . LEU   A 1 143 ? 6.94    1.431   -20.906 0   43.02  ? 833  LEU   A H    1 1 
ATOM   2073 H  HA   . LEU   A 1 143 ? 4.519   0.73    -19.357 0   42.1   ? 833  LEU   A HA   1 1 
ATOM   2074 H  HB2  . LEU   A 1 143 ? 6.424   1.785   -18.059 0   42     ? 833  LEU   A HB2  1 1 
ATOM   2075 H  HB3  . LEU   A 1 143 ? 6.271   3.203   -19.1   0   40.3   ? 833  LEU   A HB3  1 1 
ATOM   2076 H  HG   . LEU   A 1 143 ? 5.326   3.358   -16.763 0   41.45  ? 833  LEU   A HG   1 1 
ATOM   2077 H  HD11 . LEU   A 1 143 ? 3.422   4.688   -17.378 0   40.3   ? 833  LEU   A HD11 1 1 
ATOM   2078 H  HD12 . LEU   A 1 143 ? 4.754   4.961   -18.533 0   40.29  ? 833  LEU   A HD12 1 1 
ATOM   2079 H  HD13 . LEU   A 1 143 ? 3.374   3.929   -18.99  0   40.82  ? 833  LEU   A HD13 1 1 
ATOM   2080 H  HD21 . LEU   A 1 143 ? 3.235   2.443   -16.228 0   42.34  ? 833  LEU   A HD21 1 1 
ATOM   2081 H  HD22 . LEU   A 1 143 ? 3.007   1.788   -17.858 0   43.29  ? 833  LEU   A HD22 1 1 
ATOM   2082 H  HD23 . LEU   A 1 143 ? 4.279   1.115   -16.8   0   44.1   ? 833  LEU   A HD23 1 1 
ATOM   2083 N  N    . VAL   A 1 144 ? 3.067   2.025   -20.886 1   36.19  ? 834  VAL   A N    1 1 
ATOM   2084 C  CA   . VAL   A 1 144 ? 2.143   2.76    -21.749 1   35.64  ? 834  VAL   A CA   1 1 
ATOM   2085 C  C    . VAL   A 1 144 ? 1.383   3.681   -20.799 1   34.66  ? 834  VAL   A C    1 1 
ATOM   2086 O  O    . VAL   A 1 144 ? 0.699   3.191   -19.907 1   34.78  ? 834  VAL   A O    1 1 
ATOM   2087 C  CB   . VAL   A 1 144 ? 1.192   1.812   -22.523 1   36.55  ? 834  VAL   A CB   1 1 
ATOM   2088 C  CG1  . VAL   A 1 144 ? 0.296   2.593   -23.482 1   37.24  ? 834  VAL   A CG1  1 1 
ATOM   2089 C  CG2  . VAL   A 1 144 ? 1.985   0.757   -23.289 1   37.04  ? 834  VAL   A CG2  1 1 
ATOM   2090 H  H    . VAL   A 1 144 ? 2.605   1.292   -20.357 0   38.97  ? 834  VAL   A H    1 1 
ATOM   2091 H  HA   . VAL   A 1 144 ? 2.683   3.36    -22.48  0   36.04  ? 834  VAL   A HA   1 1 
ATOM   2092 H  HB   . VAL   A 1 144 ? 0.554   1.292   -21.81  0   39.41  ? 834  VAL   A HB   1 1 
ATOM   2093 H  HG11 . VAL   A 1 144 ? -0.375  1.894   -23.979 0   39.64  ? 834  VAL   A HG11 1 1 
ATOM   2094 H  HG12 . VAL   A 1 144 ? -0.29   3.338   -22.946 0   37.84  ? 834  VAL   A HG12 1 1 
ATOM   2095 H  HG13 . VAL   A 1 144 ? 0.924   3.086   -24.223 0   37.89  ? 834  VAL   A HG13 1 1 
ATOM   2096 H  HG21 . VAL   A 1 144 ? 1.32    0.239   -23.979 0   41.7   ? 834  VAL   A HG21 1 1 
ATOM   2097 H  HG22 . VAL   A 1 144 ? 2.783   1.25    -23.842 0   40.08  ? 834  VAL   A HG22 1 1 
ATOM   2098 H  HG23 . VAL   A 1 144 ? 2.406   0.039   -22.587 0   41.5   ? 834  VAL   A HG23 1 1 
ATOM   2099 N  N    . HIS   A 1 145 ? 1.554   4.999   -20.943 1   33.6   ? 835  HIS   A N    1 1 
ATOM   2100 C  CA   . HIS   A 1 145 ? 0.931   5.984   -20.059 1   33.06  ? 835  HIS   A CA   1 1 
ATOM   2101 C  C    . HIS   A 1 145 ? -0.599  5.98    -20.146 1   32.81  ? 835  HIS   A C    1 1 
ATOM   2102 O  O    . HIS   A 1 145 ? -1.26   6.096   -19.115 1   32.86  ? 835  HIS   A O    1 1 
ATOM   2103 C  CB   . HIS   A 1 145 ? 1.485   7.384   -20.367 1   33.15  ? 835  HIS   A CB   1 1 
ATOM   2104 C  CG   . HIS   A 1 145 ? 1.199   8.403   -19.31  1   34.02  ? 835  HIS   A CG   1 1 
ATOM   2105 N  ND1  . HIS   A 1 145 ? 0.011   9.097   -19.287 1   35.42  ? 835  HIS   A ND1  1 1 
ATOM   2106 C  CD2  . HIS   A 1 145 ? 1.978   8.839   -18.295 1   34.83  ? 835  HIS   A CD2  1 1 
ATOM   2107 C  CE1  . HIS   A 1 145 ? 0.095   9.927   -18.262 1   35.83  ? 835  HIS   A CE1  1 1 
ATOM   2108 N  NE2  . HIS   A 1 145 ? 1.261   9.802   -17.632 1   35.76  ? 835  HIS   A NE2  1 1 
ATOM   2109 H  H    . HIS   A 1 145 ? 2.115   5.417   -21.678 0   31.83  ? 835  HIS   A H    1 1 
ATOM   2110 H  HA   . HIS   A 1 145 ? 1.198   5.741   -19.031 0   31.22  ? 835  HIS   A HA   1 1 
ATOM   2111 H  HB2  . HIS   A 1 145 ? 2.567   7.324   -20.467 0   30.03  ? 835  HIS   A HB2  1 1 
ATOM   2112 H  HB3  . HIS   A 1 145 ? 1.046   7.739   -21.299 0   29.71  ? 835  HIS   A HB3  1 1 
ATOM   2113 H  HD2  . HIS   A 1 145 ? 2.969   8.495   -18.051 0   31.54  ? 835  HIS   A HD2  1 1 
ATOM   2114 H  HE1  . HIS   A 1 145 ? -0.681  10.615  -17.972 0   32.23  ? 835  HIS   A HE1  1 1 
ATOM   2115 H  HE2  . HIS   A 1 145 ? 1.562   10.323  -16.814 0   32.16  ? 835  HIS   A HE2  1 1 
ATOM   2116 N  N    . ARG   A 1 146 ? -1.159  5.866   -21.367 1   32.42  ? 836  ARG   A N    1 1 
ATOM   2117 C  CA   . ARG   A 1 146 ? -2.608  5.841   -21.621 1   32.43  ? 836  ARG   A CA   1 1 
ATOM   2118 C  C    . ARG   A 1 146 ? -3.356  7.144   -21.242 1   32.48  ? 836  ARG   A C    1 1 
ATOM   2119 O  O    . ARG   A 1 146 ? -4.571  7.196   -21.427 1   32.57  ? 836  ARG   A O    1 1 
ATOM   2120 C  CB   . ARG   A 1 146 ? -3.288  4.625   -20.956 1   33.27  ? 836  ARG   A CB   1 1 
ATOM   2121 C  CG   . ARG   A 1 146 ? -2.797  3.284   -21.483 1   35.48  ? 836  ARG   A CG   1 1 
ATOM   2122 C  CD   . ARG   A 1 146 ? -3.536  2.094   -20.901 1   37.71  ? 836  ARG   A CD   1 1 
ATOM   2123 N  NE   . ARG   A 1 146 ? -4.982  2.165   -21.158 1   39.58  ? 836  ARG   A NE   1 1 
ATOM   2124 C  CZ   . ARG   A 1 146 ? -5.969  2.175   -20.256 1   41.05  ? 836  ARG   A CZ   1 1 
ATOM   2125 N  NH1  . ARG   A 1 146 ? -5.703  2.096   -18.953 1   40.33  ? 836  ARG   A NH1  1 1 
ATOM   2126 N  NH2  . ARG   A 1 146 ? -7.234  2.25    -20.651 1   40.85  ? 836  ARG   A NH2  1 1 
ATOM   2127 H  H    . ARG   A 1 146 ? -0.62   5.803   -22.225 0   30.43  ? 836  ARG   A H    1 1 
ATOM   2128 H  HA   . ARG   A 1 146 ? -2.741  5.715   -22.694 0   31.46  ? 836  ARG   A HA   1 1 
ATOM   2129 H  HB2  . ARG   A 1 146 ? -3.102  4.646   -19.883 0   33.59  ? 836  ARG   A HB2  1 1 
ATOM   2130 H  HB3  . ARG   A 1 146 ? -4.358  4.682   -21.147 0   34.33  ? 836  ARG   A HB3  1 1 
ATOM   2131 H  HG2  . ARG   A 1 146 ? -2.906  3.258   -22.566 0   37.06  ? 836  ARG   A HG2  1 1 
ATOM   2132 H  HG3  . ARG   A 1 146 ? -1.754  3.168   -21.195 0   36.49  ? 836  ARG   A HG3  1 1 
ATOM   2133 H  HD2  . ARG   A 1 146 ? -3.17   1.2     -21.403 0   41.85  ? 836  ARG   A HD2  1 1 
ATOM   2134 H  HD3  . ARG   A 1 146 ? -3.276  2.036   -19.847 0   40.77  ? 836  ARG   A HD3  1 1 
ATOM   2135 H  HE   . ARG   A 1 146 ? -5.26   2.239   -22.131 0   44.06  ? 836  ARG   A HE   1 1 
ATOM   2136 H  HH11 . ARG   A 1 146 ? -4.777  2.032   -18.546 0   44.45  ? 836  ARG   A HH11 1 1 
ATOM   2137 H  HH12 . ARG   A 1 146 ? -6.485  2.101   -18.307 0   45.89  ? 836  ARG   A HH12 1 1 
ATOM   2138 H  HH21 . ARG   A 1 146 ? -7.458  2.313   -21.639 0   47.26  ? 836  ARG   A HH21 1 1 
ATOM   2139 H  HH22 . ARG   A 1 146 ? -7.987  2.253   -19.971 0   47.84  ? 836  ARG   A HH22 1 1 
ATOM   2140 N  N    . ASP   A 1 147 ? -2.66   8.19    -20.751 1   32.17  ? 837  ASP   A N    1 1 
ATOM   2141 C  CA   . ASP   A 1 147 ? -3.322  9.447   -20.392 1   32.36  ? 837  ASP   A CA   1 1 
ATOM   2142 C  C    . ASP   A 1 147 ? -2.398  10.662  -20.604 1   32.39  ? 837  ASP   A C    1 1 
ATOM   2143 O  O    . ASP   A 1 147 ? -2.36   11.562  -19.763 1   32.67  ? 837  ASP   A O    1 1 
ATOM   2144 C  CB   . ASP   A 1 147 ? -3.817  9.386   -18.933 1   33.98  ? 837  ASP   A CB   1 1 
ATOM   2145 C  CG   . ASP   A 1 147 ? -4.919  10.373  -18.586 1   38.44  ? 837  ASP   A CG   1 1 
ATOM   2146 O  OD1  . ASP   A 1 147 ? -5.455  11.021  -19.512 1   38.93  ? 837  ASP   A OD1  1 1 
ATOM   2147 O  OD2  . ASP   A 1 147 ? -5.228  10.517  -17.384 1   40.82  ? 837  ASP   A OD2  1 1 
ATOM   2148 H  H    . ASP   A 1 147 ? -1.66   8.204   -20.582 0   29.17  ? 837  ASP   A H    1 1 
ATOM   2149 H  HA   . ASP   A 1 147 ? -4.178  9.589   -21.05  0   30.24  ? 837  ASP   A HA   1 1 
ATOM   2150 H  HB2  . ASP   A 1 147 ? -4.193  8.384   -18.734 0   32.73  ? 837  ASP   A HB2  1 1 
ATOM   2151 H  HB3  . ASP   A 1 147 ? -2.98   9.58    -18.264 0   31.6   ? 837  ASP   A HB3  1 1 
ATOM   2152 N  N    . LEU   A 1 148 ? -1.665  10.699  -21.73  1   31.78  ? 838  LEU   A N    1 1 
ATOM   2153 C  CA   . LEU   A 1 148 ? -0.774  11.82   -22.009 1   31.73  ? 838  LEU   A CA   1 1 
ATOM   2154 C  C    . LEU   A 1 148 ? -1.611  13.005  -22.501 1   31.74  ? 838  LEU   A C    1 1 
ATOM   2155 O  O    . LEU   A 1 148 ? -2.3    12.904  -23.514 1   31.76  ? 838  LEU   A O    1 1 
ATOM   2156 C  CB   . LEU   A 1 148 ? 0.312   11.424  -23.025 1   31.77  ? 838  LEU   A CB   1 1 
ATOM   2157 C  CG   . LEU   A 1 148 ? 1.307   12.502  -23.489 1   33.09  ? 838  LEU   A CG   1 1 
ATOM   2158 C  CD1  . LEU   A 1 148 ? 1.976   13.24   -22.308 1   33.56  ? 838  LEU   A CD1  1 1 
ATOM   2159 C  CD2  . LEU   A 1 148 ? 2.363   11.884  -24.361 1   33.71  ? 838  LEU   A CD2  1 1 
ATOM   2160 H  H    . LEU   A 1 148 ? -1.678  9.989   -22.456 0   27.88  ? 838  LEU   A H    1 1 
ATOM   2161 H  HA   . LEU   A 1 148 ? -0.279  12.091  -21.077 0   27.09  ? 838  LEU   A HA   1 1 
ATOM   2162 H  HB2  . LEU   A 1 148 ? 0.9     10.62   -22.587 0   26.98  ? 838  LEU   A HB2  1 1 
ATOM   2163 H  HB3  . LEU   A 1 148 ? -0.185  11.053  -23.921 0   26.96  ? 838  LEU   A HB3  1 1 
ATOM   2164 H  HG   . LEU   A 1 148 ? 0.783   13.235  -24.099 0   27.81  ? 838  LEU   A HG   1 1 
ATOM   2165 H  HD11 . LEU   A 1 148 ? 2.85    13.783  -22.665 0   28.47  ? 838  LEU   A HD11 1 1 
ATOM   2166 H  HD12 . LEU   A 1 148 ? 1.274   13.952  -21.879 0   28.58  ? 838  LEU   A HD12 1 1 
ATOM   2167 H  HD13 . LEU   A 1 148 ? 2.274   12.51   -21.556 0   28.56  ? 838  LEU   A HD13 1 1 
ATOM   2168 H  HD21 . LEU   A 1 148 ? 3.038   12.658  -24.722 0   28.47  ? 838  LEU   A HD21 1 1 
ATOM   2169 H  HD22 . LEU   A 1 148 ? 2.91    11.156  -23.765 0   28.74  ? 838  LEU   A HD22 1 1 
ATOM   2170 H  HD23 . LEU   A 1 148 ? 1.881   11.389  -25.203 0   28.55  ? 838  LEU   A HD23 1 1 
ATOM   2171 N  N    . ALA   A 1 149 ? -1.592  14.102  -21.739 1   31.54  ? 839  ALA   A N    1 1 
ATOM   2172 C  CA   . ALA   A 1 149 ? -2.34   15.324  -22.039 1   31.8   ? 839  ALA   A CA   1 1 
ATOM   2173 C  C    . ALA   A 1 149 ? -1.664  16.52   -21.361 1   32.03  ? 839  ALA   A C    1 1 
ATOM   2174 O  O    . ALA   A 1 149 ? -0.909  16.326  -20.411 1   32.05  ? 839  ALA   A O    1 1 
ATOM   2175 C  CB   . ALA   A 1 149 ? -3.774  15.187  -21.545 1   31.9   ? 839  ALA   A CB   1 1 
ATOM   2176 H  H    . ALA   A 1 149 ? -1.062  14.169  -20.876 0   27.28  ? 839  ALA   A H    1 1 
ATOM   2177 H  HA   . ALA   A 1 149 ? -2.356  15.502  -23.114 0   27.94  ? 839  ALA   A HA   1 1 
ATOM   2178 H  HB1  . ALA   A 1 149 ? -4.292  16.133  -21.693 0   29.81  ? 839  ALA   A HB1  1 1 
ATOM   2179 H  HB2  . ALA   A 1 149 ? -4.268  14.401  -22.113 0   29.19  ? 839  ALA   A HB2  1 1 
ATOM   2180 H  HB3  . ALA   A 1 149 ? -3.761  14.929  -20.487 0   29.39  ? 839  ALA   A HB3  1 1 
ATOM   2181 N  N    . ALA   A 1 150 ? -1.94   17.751  -21.819 1   31.98  ? 840  ALA   A N    1 1 
ATOM   2182 C  CA   . ALA   A 1 150 ? -1.344  18.945  -21.218 1   32.61  ? 840  ALA   A CA   1 1 
ATOM   2183 C  C    . ALA   A 1 150 ? -1.693  19.066  -19.722 1   33.03  ? 840  ALA   A C    1 1 
ATOM   2184 O  O    . ALA   A 1 150 ? -0.87   19.54   -18.943 1   33     ? 840  ALA   A O    1 1 
ATOM   2185 C  CB   . ALA   A 1 150 ? -1.793  20.183  -21.97  1   32.9   ? 840  ALA   A CB   1 1 
ATOM   2186 H  H    . ALA   A 1 150 ? -2.563  17.945  -22.596 0   29.41  ? 840  ALA   A H    1 1 
ATOM   2187 H  HA   . ALA   A 1 150 ? -0.26   18.878  -21.305 0   30.05  ? 840  ALA   A HA   1 1 
ATOM   2188 H  HB1  . ALA   A 1 150 ? -1.39   21.065  -21.475 0   32.48  ? 840  ALA   A HB1  1 1 
ATOM   2189 H  HB2  . ALA   A 1 150 ? -1.426  20.131  -22.994 0   31.2   ? 840  ALA   A HB2  1 1 
ATOM   2190 H  HB3  . ALA   A 1 150 ? -2.882  20.216  -21.967 0   32.38  ? 840  ALA   A HB3  1 1 
ATOM   2191 N  N    . ARG   A 1 151 ? -2.899  18.618  -19.322 1   33.36  ? 841  ARG   A N    1 1 
ATOM   2192 C  CA   . ARG   A 1 151 ? -3.313  18.601  -17.915 1   34.06  ? 841  ARG   A CA   1 1 
ATOM   2193 C  C    . ARG   A 1 151 ? -2.41   17.687  -17.054 1   35.09  ? 841  ARG   A C    1 1 
ATOM   2194 O  O    . ARG   A 1 151 ? -2.297  17.919  -15.851 1   35.29  ? 841  ARG   A O    1 1 
ATOM   2195 C  CB   . ARG   A 1 151 ? -4.79   18.166  -17.777 1   35.01  ? 841  ARG   A CB   1 1 
ATOM   2196 C  CG   . ARG   A 1 151 ? -5.075  16.72   -18.194 1   37.51  ? 841  ARG   A CG   1 1 
ATOM   2197 C  CD   . ARG   A 1 151 ? -6.524  16.316  -18.027 1   39.8   ? 841  ARG   A CD   1 1 
ATOM   2198 N  NE   . ARG   A 1 151 ? -6.769  14.994  -18.615 1   41.56  ? 841  ARG   A NE   1 1 
ATOM   2199 C  CZ   . ARG   A 1 151 ? -7.046  14.745  -19.897 1   42.8   ? 841  ARG   A CZ   1 1 
ATOM   2200 N  NH1  . ARG   A 1 151 ? -7.14   15.741  -20.776 1   42.2   ? 841  ARG   A NH1  1 1 
ATOM   2201 N  NH2  . ARG   A 1 151 ? -7.236  13.498  -20.309 1   42.33  ? 841  ARG   A NH2  1 1 
ATOM   2202 H  H    . ARG   A 1 151 ? -3.624  18.316  -19.964 0   32.46  ? 841  ARG   A H    1 1 
ATOM   2203 H  HA   . ARG   A 1 151 ? -3.23   19.612  -17.518 0   35.02  ? 841  ARG   A HA   1 1 
ATOM   2204 H  HB2  . ARG   A 1 151 ? -5.088  18.275  -16.735 0   36.75  ? 841  ARG   A HB2  1 1 
ATOM   2205 H  HB3  . ARG   A 1 151 ? -5.403  18.815  -18.402 0   36.63  ? 841  ARG   A HB3  1 1 
ATOM   2206 H  HG2  . ARG   A 1 151 ? -4.82   16.602  -19.246 0   36.8   ? 841  ARG   A HG2  1 1 
ATOM   2207 H  HG3  . ARG   A 1 151 ? -4.486  16.033  -17.589 0   36.92  ? 841  ARG   A HG3  1 1 
ATOM   2208 H  HD2  . ARG   A 1 151 ? -6.735  16.238  -16.962 0   41.79  ? 841  ARG   A HD2  1 1 
ATOM   2209 H  HD3  . ARG   A 1 151 ? -7.182  17.062  -18.469 0   41.96  ? 841  ARG   A HD3  1 1 
ATOM   2210 H  HE   . ARG   A 1 151 ? -6.71   14.2    -17.985 0   42.23  ? 841  ARG   A HE   1 1 
ATOM   2211 H  HH11 . ARG   A 1 151 ? -6.988  16.715  -20.539 0   43.25  ? 841  ARG   A HH11 1 1 
ATOM   2212 H  HH12 . ARG   A 1 151 ? -7.347  15.519  -21.745 0   42.79  ? 841  ARG   A HH12 1 1 
ATOM   2213 H  HH21 . ARG   A 1 151 ? -7.179  12.727  -19.651 0   42.71  ? 841  ARG   A HH21 1 1 
ATOM   2214 H  HH22 . ARG   A 1 151 ? -7.455  13.305  -21.282 0   42.66  ? 841  ARG   A HH22 1 1 
ATOM   2215 N  N    . ASN   A 1 152 ? -1.794  16.644  -17.658 1   35.42  ? 842  ASN   A N    1 1 
ATOM   2216 C  CA   . ASN   A 1 152 ? -0.913  15.707  -16.963 1   36.13  ? 842  ASN   A CA   1 1 
ATOM   2217 C  C    . ASN   A 1 152 ? 0.572   15.963  -17.25  1   36.33  ? 842  ASN   A C    1 1 
ATOM   2218 O  O    . ASN   A 1 152 ? 1.367   15.026  -17.274 1   36.55  ? 842  ASN   A O    1 1 
ATOM   2219 C  CB   . ASN   A 1 152 ? -1.304  14.273  -17.314 1   37.47  ? 842  ASN   A CB   1 1 
ATOM   2220 C  CG   . ASN   A 1 152 ? -2.726  13.976  -16.918 1   40.73  ? 842  ASN   A CG   1 1 
ATOM   2221 O  OD1  . ASN   A 1 152 ? -3.181  14.369  -15.842 1   42.11  ? 842  ASN   A OD1  1 1 
ATOM   2222 N  ND2  . ASN   A 1 152 ? -3.472  13.289  -17.765 1   41.25  ? 842  ASN   A ND2  1 1 
ATOM   2223 H  H    . ASN   A 1 152 ? -1.904  16.407  -18.639 0   32.97  ? 842  ASN   A H    1 1 
ATOM   2224 H  HA   . ASN   A 1 152 ? -1.035  15.812  -15.887 0   34.24  ? 842  ASN   A HA   1 1 
ATOM   2225 H  HB2  . ASN   A 1 152 ? -1.192  14.132  -18.388 0   33.99  ? 842  ASN   A HB2  1 1 
ATOM   2226 H  HB3  . ASN   A 1 152 ? -0.667  13.574  -16.773 0   34.27  ? 842  ASN   A HB3  1 1 
ATOM   2227 H  HD21 . ASN   A 1 152 ? -4.434  13.075  -17.523 0   39.8   ? 842  ASN   A HD21 1 1 
ATOM   2228 H  HD22 . ASN   A 1 152 ? -3.095  12.967  -18.65  0   38.45  ? 842  ASN   A HD22 1 1 
ATOM   2229 N  N    . VAL   A 1 153 ? 0.944   17.233  -17.443 1   36.23  ? 843  VAL   A N    1 1 
ATOM   2230 C  CA   . VAL   A 1 153 ? 2.333   17.664  -17.622 1   36.71  ? 843  VAL   A CA   1 1 
ATOM   2231 C  C    . VAL   A 1 153 ? 2.51    18.792  -16.606 1   37.31  ? 843  VAL   A C    1 1 
ATOM   2232 O  O    . VAL   A 1 153 ? 1.693   19.704  -16.581 1   37.2   ? 843  VAL   A O    1 1 
ATOM   2233 C  CB   . VAL   A 1 153 ? 2.661   18.148  -19.059 1   37.14  ? 843  VAL   A CB   1 1 
ATOM   2234 C  CG1  . VAL   A 1 153 ? 4.106   18.635  -19.148 1   37.58  ? 843  VAL   A CG1  1 1 
ATOM   2235 C  CG2  . VAL   A 1 153 ? 2.405   17.048  -20.085 1   37.39  ? 843  VAL   A CG2  1 1 
ATOM   2236 H  H    . VAL   A 1 153 ? 0.3     18.016  -17.472 0   34.44  ? 843  VAL   A H    1 1 
ATOM   2237 H  HA   . VAL   A 1 153 ? 3.025   16.862  -17.372 0   34.09  ? 843  VAL   A HA   1 1 
ATOM   2238 H  HB   . VAL   A 1 153 ? 2.012   18.988  -19.305 0   35.1   ? 843  VAL   A HB   1 1 
ATOM   2239 H  HG11 . VAL   A 1 153 ? 4.358   18.802  -20.194 0   35.54  ? 843  VAL   A HG11 1 1 
ATOM   2240 H  HG12 . VAL   A 1 153 ? 4.217   19.571  -18.604 0   36.59  ? 843  VAL   A HG12 1 1 
ATOM   2241 H  HG13 . VAL   A 1 153 ? 4.762   17.876  -18.725 0   35.38  ? 843  VAL   A HG13 1 1 
ATOM   2242 H  HG21 . VAL   A 1 153 ? 2.725   17.393  -21.068 0   33.75  ? 843  VAL   A HG21 1 1 
ATOM   2243 H  HG22 . VAL   A 1 153 ? 2.968   16.16   -19.8   0   33.58  ? 843  VAL   A HG22 1 1 
ATOM   2244 H  HG23 . VAL   A 1 153 ? 1.341   16.82   -20.111 0   33.71  ? 843  VAL   A HG23 1 1 
ATOM   2245 N  N    . LEU   A 1 154 ? 3.527   18.706  -15.74  1   37.76  ? 844  LEU   A N    1 1 
ATOM   2246 C  CA   . LEU   A 1 154 ? 3.78    19.713  -14.711 1   38.7   ? 844  LEU   A CA   1 1 
ATOM   2247 C  C    . LEU   A 1 154 ? 4.984   20.559  -15.034 1   39.67  ? 844  LEU   A C    1 1 
ATOM   2248 O  O    . LEU   A 1 154 ? 5.87    20.127  -15.762 1   39.69  ? 844  LEU   A O    1 1 
ATOM   2249 C  CB   . LEU   A 1 154 ? 3.957   19.06   -13.342 1   39     ? 844  LEU   A CB   1 1 
ATOM   2250 C  CG   . LEU   A 1 154 ? 2.83    18.14   -12.881 1   40.46  ? 844  LEU   A CG   1 1 
ATOM   2251 C  CD1  . LEU   A 1 154 ? 3.275   17.297  -11.737 1   41.12  ? 844  LEU   A CD1  1 1 
ATOM   2252 C  CD2  . LEU   A 1 154 ? 1.568   18.919  -12.49  1   40.94  ? 844  LEU   A CD2  1 1 
ATOM   2253 H  H    . LEU   A 1 154 ? 4.199   17.945  -15.722 0   36.89  ? 844  LEU   A H    1 1 
ATOM   2254 H  HA   . LEU   A 1 154 ? 2.947   20.405  -14.641 0   40.3   ? 844  LEU   A HA   1 1 
ATOM   2255 H  HB2  . LEU   A 1 154 ? 4.884   18.488  -13.374 0   40.11  ? 844  LEU   A HB2  1 1 
ATOM   2256 H  HB3  . LEU   A 1 154 ? 4.051   19.854  -12.603 0   41.62  ? 844  LEU   A HB3  1 1 
ATOM   2257 H  HG   . LEU   A 1 154 ? 2.567   17.465  -13.693 0   40.12  ? 844  LEU   A HG   1 1 
ATOM   2258 H  HD11 . LEU   A 1 154 ? 2.512   16.549  -11.529 0   41.66  ? 844  LEU   A HD11 1 1 
ATOM   2259 H  HD12 . LEU   A 1 154 ? 4.214   16.808  -11.992 0   41.52  ? 844  LEU   A HD12 1 1 
ATOM   2260 H  HD13 . LEU   A 1 154 ? 3.403   17.93   -10.861 0   43.09  ? 844  LEU   A HD13 1 1 
ATOM   2261 H  HD21 . LEU   A 1 154 ? 0.875   18.247  -11.987 0   42.23  ? 844  LEU   A HD21 1 1 
ATOM   2262 H  HD22 . LEU   A 1 154 ? 1.84    19.737  -11.825 0   43.74  ? 844  LEU   A HD22 1 1 
ATOM   2263 H  HD23 . LEU   A 1 154 ? 1.094   19.311  -13.388 0   42.5   ? 844  LEU   A HD23 1 1 
ATOM   2264 N  N    . VAL   A 1 155 ? 5.015   21.775  -14.475 1   40.37  ? 845  VAL   A N    1 1 
ATOM   2265 C  CA   . VAL   A 1 155 ? 6.077   22.743  -14.707 1   41.54  ? 845  VAL   A CA   1 1 
ATOM   2266 C  C    . VAL   A 1 155 ? 6.89    22.916  -13.415 1   42.69  ? 845  VAL   A C    1 1 
ATOM   2267 O  O    . VAL   A 1 155 ? 6.399   23.518  -12.462 1   42.85  ? 845  VAL   A O    1 1 
ATOM   2268 C  CB   . VAL   A 1 155 ? 5.466   24.085  -15.209 1   42.24  ? 845  VAL   A CB   1 1 
ATOM   2269 C  CG1  . VAL   A 1 155 ? 6.553   25.095  -15.566 1   42.89  ? 845  VAL   A CG1  1 1 
ATOM   2270 C  CG2  . VAL   A 1 155 ? 4.547   23.857  -16.407 1   42.67  ? 845  VAL   A CG2  1 1 
ATOM   2271 H  H    . VAL   A 1 155 ? 4.308   22.119  -13.833 0   44.73  ? 845  VAL   A H    1 1 
ATOM   2272 H  HA   . VAL   A 1 155 ? 6.752   22.392  -15.485 0   46.18  ? 845  VAL   A HA   1 1 
ATOM   2273 H  HB   . VAL   A 1 155 ? 4.837   24.502  -14.425 0   49.66  ? 845  VAL   A HB   1 1 
ATOM   2274 H  HG11 . VAL   A 1 155 ? 6.082   26.018  -15.902 0   52.09  ? 845  VAL   A HG11 1 1 
ATOM   2275 H  HG12 . VAL   A 1 155 ? 7.177   25.306  -14.699 0   52.38  ? 845  VAL   A HG12 1 1 
ATOM   2276 H  HG13 . VAL   A 1 155 ? 7.166   24.685  -16.367 0   50.32  ? 845  VAL   A HG13 1 1 
ATOM   2277 H  HG21 . VAL   A 1 155 ? 4.345   24.805  -16.904 0   48.75  ? 845  VAL   A HG21 1 1 
ATOM   2278 H  HG22 . VAL   A 1 155 ? 5.036   23.167  -17.094 0   46.79  ? 845  VAL   A HG22 1 1 
ATOM   2279 H  HG23 . VAL   A 1 155 ? 3.608   23.43   -16.058 0   46.79  ? 845  VAL   A HG23 1 1 
ATOM   2280 N  N    . LYS   A 1 156 ? 8.117   22.356  -13.376 1   43.43  ? 846  LYS   A N    1 1 
ATOM   2281 C  CA   . LYS   A 1 156 ? 9.023   22.5    -12.233 1   44.58  ? 846  LYS   A CA   1 1 
ATOM   2282 C  C    . LYS   A 1 156 ? 9.5     23.959  -12.231 1   45.8   ? 846  LYS   A C    1 1 
ATOM   2283 O  O    . LYS   A 1 156 ? 9.406   24.639  -11.211 1   46.17  ? 846  LYS   A O    1 1 
ATOM   2284 C  CB   . LYS   A 1 156 ? 10.212  21.518  -12.352 1   46.44  ? 846  LYS   A CB   1 1 
ATOM   2285 C  CG   . LYS   A 1 156 ? 11.121  21.487  -11.131 1   50.49  ? 846  LYS   A CG   1 1 
ATOM   2286 C  CD   . LYS   A 1 156 ? 12.384  20.672  -11.382 1   54.84  ? 846  LYS   A CD   1 1 
ATOM   2287 C  CE   . LYS   A 1 156 ? 13.322  20.69   -10.197 1   58.66  ? 846  LYS   A CE   1 1 
ATOM   2288 N  NZ   . LYS   A 1 156 ? 14.226  21.876  -10.199 1   61.15  ? 846  LYS   A NZ   1 1 
ATOM   2289 H  H    . LYS   A 1 156 ? 8.507   21.791  -14.123 0   49.37  ? 846  LYS   A H    1 1 
ATOM   2290 H  HA   . LYS   A 1 156 ? 8.492   22.297  -11.304 0   53.16  ? 846  LYS   A HA   1 1 
ATOM   2291 H  HB2  . LYS   A 1 156 ? 9.817   20.513  -12.494 0   53.17  ? 846  LYS   A HB2  1 1 
ATOM   2292 H  HB3  . LYS   A 1 156 ? 10.819  21.797  -13.212 0   55.06  ? 846  LYS   A HB3  1 1 
ATOM   2293 H  HG2  . LYS   A 1 156 ? 11.431  22.497  -10.869 0   62.52  ? 846  LYS   A HG2  1 1 
ATOM   2294 H  HG3  . LYS   A 1 156 ? 10.585  21.031  -10.299 0   60.37  ? 846  LYS   A HG3  1 1 
ATOM   2295 H  HD2  . LYS   A 1 156 ? 12.109  19.638  -11.584 0   63.68  ? 846  LYS   A HD2  1 1 
ATOM   2296 H  HD3  . LYS   A 1 156 ? 12.912  21.092  -12.237 0   65.67  ? 846  LYS   A HD3  1 1 
ATOM   2297 H  HE2  . LYS   A 1 156 ? 12.741  20.709  -9.276  0   71.11  ? 846  LYS   A HE2  1 1 
ATOM   2298 H  HE3  . LYS   A 1 156 ? 13.943  19.796  -10.225 0   71.23  ? 846  LYS   A HE3  1 1 
ATOM   2299 H  HZ1  . LYS   A 1 156 ? 14.69   21.953  -9.3    0   77.85  ? 846  LYS   A HZ1  1 1 
ATOM   2300 H  HZ2  . LYS   A 1 156 ? 14.932  21.767  -10.92  0   77.22  ? 846  LYS   A HZ2  1 1 
ATOM   2301 H  HZ3  . LYS   A 1 156 ? 13.706  22.73   -10.374 0   76.36  ? 846  LYS   A HZ3  1 1 
ATOM   2302 N  N    . THR   A 1 157 ? 10.009  24.42   -13.388 1   46.18  ? 847  THR   A N    1 1 
ATOM   2303 C  CA   . THR   A 1 157 ? 10.435  25.795  -13.685 1   47.07  ? 847  THR   A CA   1 1 
ATOM   2304 C  C    . THR   A 1 157 ? 10.025  26.069  -15.159 1   47.39  ? 847  THR   A C    1 1 
ATOM   2305 O  O    . THR   A 1 157 ? 9.871   25.098  -15.908 1   47.57  ? 847  THR   A O    1 1 
ATOM   2306 C  CB   . THR   A 1 157 ? 11.965  25.968  -13.505 1   48.75  ? 847  THR   A CB   1 1 
ATOM   2307 O  OG1  . THR   A 1 157 ? 12.656  24.886  -14.142 1   50.24  ? 847  THR   A OG1  1 1 
ATOM   2308 C  CG2  . THR   A 1 157 ? 12.386  26.063  -12.042 1   48.9   ? 847  THR   A CG2  1 1 
ATOM   2309 H  H    . THR   A 1 157 ? 10.171  23.811  -14.185 0   56.13  ? 847  THR   A H    1 1 
ATOM   2310 H  HA   . THR   A 1 157 ? 9.913   26.482  -13.021 0   62     ? 847  THR   A HA   1 1 
ATOM   2311 H  HB   . THR   A 1 157 ? 12.256  26.907  -13.972 0   66.13  ? 847  THR   A HB   1 1 
ATOM   2312 H  HG1  . THR   A 1 157 ? 12.787  25.054  -15.113 0   62.83  ? 847  THR   A HG1  1 1 
ATOM   2313 H  HG21 . THR   A 1 157 ? 13.466  26.189  -11.975 0   68.04  ? 847  THR   A HG21 1 1 
ATOM   2314 H  HG22 . THR   A 1 157 ? 11.902  26.92   -11.576 0   67.7   ? 847  THR   A HG22 1 1 
ATOM   2315 H  HG23 . THR   A 1 157 ? 12.101  25.16   -11.505 0   64.89  ? 847  THR   A HG23 1 1 
ATOM   2316 N  N    . PRO   A 1 158 ? 9.859   27.327  -15.633 1   47.26  ? 848  PRO   A N    1 1 
ATOM   2317 C  CA   . PRO   A 1 158 ? 9.472   27.529  -17.047 1   47.2   ? 848  PRO   A CA   1 1 
ATOM   2318 C  C    . PRO   A 1 158 ? 10.271  26.729  -18.088 1   47.17  ? 848  PRO   A C    1 1 
ATOM   2319 O  O    . PRO   A 1 158 ? 9.705   26.337  -19.103 1   47.24  ? 848  PRO   A O    1 1 
ATOM   2320 C  CB   . PRO   A 1 158 ? 9.649   29.035  -17.249 1   47.94  ? 848  PRO   A CB   1 1 
ATOM   2321 C  CG   . PRO   A 1 158 ? 9.468   29.621  -15.91  1   48.4   ? 848  PRO   A CG   1 1 
ATOM   2322 C  CD   . PRO   A 1 158 ? 9.979   28.616  -14.921 1   46.84  ? 848  PRO   A CD   1 1 
ATOM   2323 H  HA   . PRO   A 1 158 ? 8.417   27.289  -17.171 0   58.98  ? 848  PRO   A HA   1 1 
ATOM   2324 H  HB2  . PRO   A 1 158 ? 10.649  29.243  -17.627 0   65.32  ? 848  PRO   A HB2  1 1 
ATOM   2325 H  HB3  . PRO   A 1 158 ? 8.889   29.403  -17.938 0   63.84  ? 848  PRO   A HB3  1 1 
ATOM   2326 H  HG2  . PRO   A 1 158 ? 10.041  30.544  -15.841 0   69.14  ? 848  PRO   A HG2  1 1 
ATOM   2327 H  HG3  . PRO   A 1 158 ? 8.41    29.815  -15.74  0   66.31  ? 848  PRO   A HG3  1 1 
ATOM   2328 H  HD2  . PRO   A 1 158 ? 11.022  28.819  -14.68  0   65.89  ? 848  PRO   A HD2  1 1 
ATOM   2329 H  HD3  . PRO   A 1 158 ? 9.354   28.623  -14.029 0   64.43  ? 848  PRO   A HD3  1 1 
ATOM   2330 N  N    . GLN   A 1 159 ? 11.561  26.454  -17.825 1   46.92  ? 849  GLN   A N    1 1 
ATOM   2331 C  CA   . GLN   A 1 159 ? 12.434  25.715  -18.743 1   47.08  ? 849  GLN   A CA   1 1 
ATOM   2332 C  C    . GLN   A 1 159 ? 12.453  24.182  -18.529 1   46.57  ? 849  GLN   A C    1 1 
ATOM   2333 O  O    . GLN   A 1 159 ? 13.121  23.5    -19.301 1   46.72  ? 849  GLN   A O    1 1 
ATOM   2334 C  CB   . GLN   A 1 159 ? 13.879  26.246  -18.63  1   48.97  ? 849  GLN   A CB   1 1 
ATOM   2335 C  CG   . GLN   A 1 159 ? 14.045  27.724  -18.99  1   53     ? 849  GLN   A CG   1 1 
ATOM   2336 C  CD   . GLN   A 1 159 ? 13.68   28.684  -17.877 1   58.1   ? 849  GLN   A CD   1 1 
ATOM   2337 O  OE1  . GLN   A 1 159 ? 13.554  28.306  -16.707 1   59.79  ? 849  GLN   A OE1  1 1 
ATOM   2338 N  NE2  . GLN   A 1 159 ? 13.501  29.958  -18.218 1   58.84  ? 849  GLN   A NE2  1 1 
ATOM   2339 H  H    . GLN   A 1 159 ? 12.032  26.725  -16.968 0   61.66  ? 849  GLN   A H    1 1 
ATOM   2340 H  HA   . GLN   A 1 159 ? 12.115  25.898  -19.768 0   58.87  ? 849  GLN   A HA   1 1 
ATOM   2341 H  HB2  . GLN   A 1 159 ? 14.241  26.081  -17.616 0   65.24  ? 849  GLN   A HB2  1 1 
ATOM   2342 H  HB3  . GLN   A 1 159 ? 14.507  25.69   -19.325 0   64.07  ? 849  GLN   A HB3  1 1 
ATOM   2343 H  HG2  . GLN   A 1 159 ? 15.086  27.904  -19.253 0   72.65  ? 849  GLN   A HG2  1 1 
ATOM   2344 H  HG3  . GLN   A 1 159 ? 13.406  27.948  -19.843 0   69.94  ? 849  GLN   A HG3  1 1 
ATOM   2345 H  HE21 . GLN   A 1 159 ? 13.609  30.254  -19.183 0   80.61  ? 849  GLN   A HE21 1 1 
ATOM   2346 H  HE22 . GLN   A 1 159 ? 13.256  30.639  -17.507 0   82.14  ? 849  GLN   A HE22 1 1 
ATOM   2347 N  N    . HIS   A 1 160 ? 11.762  23.639  -17.502 1   45.77  ? 850  HIS   A N    1 1 
ATOM   2348 C  CA   . HIS   A 1 160 ? 11.778  22.203  -17.196 1   45.46  ? 850  HIS   A CA   1 1 
ATOM   2349 C  C    . HIS   A 1 160 ? 10.363  21.671  -16.9   1   44.46  ? 850  HIS   A C    1 1 
ATOM   2350 O  O    . HIS   A 1 160 ? 9.687   22.206  -16.022 1   44.59  ? 850  HIS   A O    1 1 
ATOM   2351 C  CB   . HIS   A 1 160 ? 12.684  21.974  -15.973 1   46.69  ? 850  HIS   A CB   1 1 
ATOM   2352 C  CG   . HIS   A 1 160 ? 13.004  20.538  -15.687 1   49.69  ? 850  HIS   A CG   1 1 
ATOM   2353 N  ND1  . HIS   A 1 160 ? 14.271  20.028  -15.906 1   51.67  ? 850  HIS   A ND1  1 1 
ATOM   2354 C  CD2  . HIS   A 1 160 ? 12.225  19.562  -15.163 1   50.94  ? 850  HIS   A CD2  1 1 
ATOM   2355 C  CE1  . HIS   A 1 160 ? 14.217  18.758  -15.535 1   52.2   ? 850  HIS   A CE1  1 1 
ATOM   2356 N  NE2  . HIS   A 1 160 ? 13.004  18.434  -15.085 1   52.07  ? 850  HIS   A NE2  1 1 
ATOM   2357 H  H    . HIS   A 1 160 ? 11.179  24.162  -16.857 0   55.64  ? 850  HIS   A H    1 1 
ATOM   2358 H  HA   . HIS   A 1 160 ? 12.189  21.635  -18.029 0   52.73  ? 850  HIS   A HA   1 1 
ATOM   2359 H  HB2  . HIS   A 1 160 ? 13.629  22.487  -16.142 0   57.9   ? 850  HIS   A HB2  1 1 
ATOM   2360 H  HB3  . HIS   A 1 160 ? 12.198  22.387  -15.09  0   56.55  ? 850  HIS   A HB3  1 1 
ATOM   2361 H  HD2  . HIS   A 1 160 ? 11.194  19.653  -14.865 0   56.77  ? 850  HIS   A HD2  1 1 
ATOM   2362 H  HE1  . HIS   A 1 160 ? 15.046  18.073  -15.59  0   61.59  ? 850  HIS   A HE1  1 1 
ATOM   2363 H  HE2  . HIS   A 1 160 ? 12.71   17.523  -14.75  0   58.12  ? 850  HIS   A HE2  1 1 
ATOM   2364 N  N    . VAL   A 1 161 ? 9.932   20.599  -17.608 1   43.22  ? 851  VAL   A N    1 1 
ATOM   2365 C  CA   . VAL   A 1 161 ? 8.606   19.981  -17.42  1   42.38  ? 851  VAL   A CA   1 1 
ATOM   2366 C  C    . VAL   A 1 161 ? 8.708   18.47   -17.133 1   41.17  ? 851  VAL   A C    1 1 
ATOM   2367 O  O    . VAL   A 1 161 ? 9.705   17.84   -17.485 1   41.08  ? 851  VAL   A O    1 1 
ATOM   2368 C  CB   . VAL   A 1 161 ? 7.611   20.275  -18.583 1   43.02  ? 851  VAL   A CB   1 1 
ATOM   2369 C  CG1  . VAL   A 1 161 ? 7.369   21.772  -18.739 1   43.52  ? 851  VAL   A CG1  1 1 
ATOM   2370 C  CG2  . VAL   A 1 161 ? 8.06    19.651  -19.905 1   43.41  ? 851  VAL   A CG2  1 1 
ATOM   2371 H  H    . VAL   A 1 161 ? 10.5    20.126  -18.303 0   46.98  ? 851  VAL   A H    1 1 
ATOM   2372 H  HA   . VAL   A 1 161 ? 8.146   20.408  -16.531 0   45.22  ? 851  VAL   A HA   1 1 
ATOM   2373 H  HB   . VAL   A 1 161 ? 6.653   19.823  -18.328 0   43.41  ? 851  VAL   A HB   1 1 
ATOM   2374 H  HG11 . VAL   A 1 161 ? 6.606   21.928  -19.5   0   45.47  ? 851  VAL   A HG11 1 1 
ATOM   2375 H  HG12 . VAL   A 1 161 ? 7.033   22.178  -17.786 0   46.71  ? 851  VAL   A HG12 1 1 
ATOM   2376 H  HG13 . VAL   A 1 161 ? 8.295   22.256  -19.043 0   47.2   ? 851  VAL   A HG13 1 1 
ATOM   2377 H  HG21 . VAL   A 1 161 ? 7.406   20.011  -20.698 0   43.34  ? 851  VAL   A HG21 1 1 
ATOM   2378 H  HG22 . VAL   A 1 161 ? 9.088   19.945  -20.114 0   44.95  ? 851  VAL   A HG22 1 1 
ATOM   2379 H  HG23 . VAL   A 1 161 ? 7.988   18.566  -19.843 0   43.21  ? 851  VAL   A HG23 1 1 
ATOM   2380 N  N    . LYS   A 1 162 ? 7.67    17.902  -16.481 1   40.16  ? 852  LYS   A N    1 1 
ATOM   2381 C  CA   . LYS   A 1 162 ? 7.618   16.483  -16.103 1   39.65  ? 852  LYS   A CA   1 1 
ATOM   2382 C  C    . LYS   A 1 162 ? 6.253   15.862  -16.417 1   38.9   ? 852  LYS   A C    1 1 
ATOM   2383 O  O    . LYS   A 1 162 ? 5.235   16.516  -16.246 1   38.91  ? 852  LYS   A O    1 1 
ATOM   2384 C  CB   . LYS   A 1 162 ? 7.876   16.326  -14.596 1   41.35  ? 852  LYS   A CB   1 1 
ATOM   2385 C  CG   . LYS   A 1 162 ? 9.315   16.549  -14.161 1   45.3   ? 852  LYS   A CG   1 1 
ATOM   2386 C  CD   . LYS   A 1 162 ? 9.437   16.424  -12.647 1   49.69  ? 852  LYS   A CD   1 1 
ATOM   2387 C  CE   . LYS   A 1 162 ? 10.852  16.555  -12.12  1   53.48  ? 852  LYS   A CE   1 1 
ATOM   2388 N  NZ   . LYS   A 1 162 ? 11.633  15.28   -12.152 1   56.08  ? 852  LYS   A NZ   1 1 
ATOM   2389 H  H    . LYS   A 1 162 ? 6.841   18.415  -16.198 0   40.57  ? 852  LYS   A H    1 1 
ATOM   2390 H  HA   . LYS   A 1 162 ? 8.376   15.915  -16.64  0   39.4   ? 852  LYS   A HA   1 1 
ATOM   2391 H  HB2  . LYS   A 1 162 ? 7.258   17.047  -14.063 0   42.14  ? 852  LYS   A HB2  1 1 
ATOM   2392 H  HB3  . LYS   A 1 162 ? 7.597   15.316  -14.298 0   41.33  ? 852  LYS   A HB3  1 1 
ATOM   2393 H  HG2  . LYS   A 1 162 ? 9.956   15.8    -14.623 0   47.33  ? 852  LYS   A HG2  1 1 
ATOM   2394 H  HG3  . LYS   A 1 162 ? 9.629   17.55   -14.45  0   48.11  ? 852  LYS   A HG3  1 1 
ATOM   2395 H  HD2  . LYS   A 1 162 ? 8.85    17.221  -12.192 0   52.82  ? 852  LYS   A HD2  1 1 
ATOM   2396 H  HD3  . LYS   A 1 162 ? 9.035   15.46   -12.339 0   51.91  ? 852  LYS   A HD3  1 1 
ATOM   2397 H  HE2  . LYS   A 1 162 ? 11.384  17.285  -12.729 0   58.91  ? 852  LYS   A HE2  1 1 
ATOM   2398 H  HE3  . LYS   A 1 162 ? 10.813  16.897  -11.087 0   59.06  ? 852  LYS   A HE3  1 1 
ATOM   2399 H  HZ1  . LYS   A 1 162 ? 12.142  15.175  -11.28  0   61.92  ? 852  LYS   A HZ1  1 1 
ATOM   2400 H  HZ2  . LYS   A 1 162 ? 11.038  14.468  -12.28  0   59.76  ? 852  LYS   A HZ2  1 1 
ATOM   2401 H  HZ3  . LYS   A 1 162 ? 12.304  15.313  -12.912 0   61.52  ? 852  LYS   A HZ3  1 1 
ATOM   2402 N  N    . ILE   A 1 163 ? 6.228   14.583  -16.809 1   38.09  ? 853  ILE   A N    1 1 
ATOM   2403 C  CA   . ILE   A 1 163 ? 4.981   13.862  -17.09  1   37.88  ? 853  ILE   A CA   1 1 
ATOM   2404 C  C    . ILE   A 1 163 ? 4.45    13.322  -15.753 1   37.53  ? 853  ILE   A C    1 1 
ATOM   2405 O  O    . ILE   A 1 163 ? 5.236   12.829  -14.943 1   37.28  ? 853  ILE   A O    1 1 
ATOM   2406 C  CB   . ILE   A 1 163 ? 5.217   12.724  -18.127 1   38.31  ? 853  ILE   A CB   1 1 
ATOM   2407 C  CG1  . ILE   A 1 163 ? 5.707   13.307  -19.484 1   39.14  ? 853  ILE   A CG1  1 1 
ATOM   2408 C  CG2  . ILE   A 1 163 ? 3.939   11.884  -18.331 1   38.77  ? 853  ILE   A CG2  1 1 
ATOM   2409 C  CD1  . ILE   A 1 163 ? 6.511   12.369  -20.314 1   40.26  ? 853  ILE   A CD1  1 1 
ATOM   2410 H  H    . ILE   A 1 163 ? 7.061   14.012  -16.913 0   36.14  ? 853  ILE   A H    1 1 
ATOM   2411 H  HA   . ILE   A 1 163 ? 4.243   14.542  -17.512 0   34.55  ? 853  ILE   A HA   1 1 
ATOM   2412 H  HB   . ILE   A 1 163 ? 5.982   12.065  -17.719 0   35.26  ? 853  ILE   A HB   1 1 
ATOM   2413 H  HG12 . ILE   A 1 163 ? 4.838   13.596  -20.074 0   35.04  ? 853  ILE   A HG12 1 1 
ATOM   2414 H  HG13 . ILE   A 1 163 ? 6.328   14.184  -19.314 0   36     ? 853  ILE   A HG13 1 1 
ATOM   2415 H  HG21 . ILE   A 1 163 ? 4.061   11.225  -19.189 0   34.71  ? 853  ILE   A HG21 1 1 
ATOM   2416 H  HG22 . ILE   A 1 163 ? 3.756   11.274  -17.447 0   35.01  ? 853  ILE   A HG22 1 1 
ATOM   2417 H  HG23 . ILE   A 1 163 ? 3.099   12.556  -18.499 0   34.5   ? 853  ILE   A HG23 1 1 
ATOM   2418 H  HD11 . ILE   A 1 163 ? 7.054   12.94   -21.066 0   36.85  ? 853  ILE   A HD11 1 1 
ATOM   2419 H  HD12 . ILE   A 1 163 ? 7.21    11.831  -19.676 0   37.54  ? 853  ILE   A HD12 1 1 
ATOM   2420 H  HD13 . ILE   A 1 163 ? 5.839   11.666  -20.804 0   36.56  ? 853  ILE   A HD13 1 1 
ATOM   2421 N  N    . THR   A 1 164 ? 3.124   13.42   -15.523 1   37.25  ? 854  THR   A N    1 1 
ATOM   2422 C  CA   . THR   A 1 164 ? 2.495   12.961  -14.28  1   37.53  ? 854  THR   A CA   1 1 
ATOM   2423 C  C    . THR   A 1 164 ? 1.196   12.148  -14.559 1   37.54  ? 854  THR   A C    1 1 
ATOM   2424 O  O    . THR   A 1 164 ? 0.834   11.946  -15.723 1   37.51  ? 854  THR   A O    1 1 
ATOM   2425 C  CB   . THR   A 1 164 ? 2.247   14.189  -13.339 1   38.75  ? 854  THR   A CB   1 1 
ATOM   2426 O  OG1  . THR   A 1 164 ? 1.982   13.709  -12.017 1   39.81  ? 854  THR   A OG1  1 1 
ATOM   2427 C  CG2  . THR   A 1 164 ? 1.062   15.042  -13.785 1   39.11  ? 854  THR   A CG2  1 1 
ATOM   2428 H  H    . THR   A 1 164 ? 2.463   13.8    -16.193 0   33.94  ? 854  THR   A H    1 1 
ATOM   2429 H  HA   . THR   A 1 164 ? 3.178   12.272  -13.784 0   35.16  ? 854  THR   A HA   1 1 
ATOM   2430 H  HB   . THR   A 1 164 ? 3.131   14.825  -13.303 0   37.21  ? 854  THR   A HB   1 1 
ATOM   2431 H  HG1  . THR   A 1 164 ? 2.068   14.446  -11.357 0   39.22  ? 854  THR   A HG1  1 1 
ATOM   2432 H  HG21 . THR   A 1 164 ? 0.966   15.913  -13.139 0   38.22  ? 854  THR   A HG21 1 1 
ATOM   2433 H  HG22 . THR   A 1 164 ? 1.204   15.373  -14.812 0   37.01  ? 854  THR   A HG22 1 1 
ATOM   2434 H  HG23 . THR   A 1 164 ? 0.131   14.481  -13.719 0   37.33  ? 854  THR   A HG23 1 1 
ATOM   2435 N  N    . ASP   A 1 165 ? 0.543   11.644  -13.474 1   37.41  ? 855  ASP   A N    1 1 
ATOM   2436 C  CA   . ASP   A 1 165 ? -0.718  10.915  -13.476 1   37.68  ? 855  ASP   A CA   1 1 
ATOM   2437 C  C    . ASP   A 1 165 ? -0.592  9.57    -14.163 1   38.21  ? 855  ASP   A C    1 1 
ATOM   2438 O  O    . ASP   A 1 165 ? -0.922  9.425   -15.338 1   38.24  ? 855  ASP   A O    1 1 
ATOM   2439 C  CB   . ASP   A 1 165 ? -1.868  11.771  -14.049 1   38.96  ? 855  ASP   A CB   1 1 
ATOM   2440 C  CG   . ASP   A 1 165 ? -3.25   11.34   -13.591 1   42.64  ? 855  ASP   A CG   1 1 
ATOM   2441 O  OD1  . ASP   A 1 165 ? -3.512  10.121  -13.563 1   43.16  ? 855  ASP   A OD1  1 1 
ATOM   2442 O  OD2  . ASP   A 1 165 ? -4.068  12.226  -13.257 1   44.54  ? 855  ASP   A OD2  1 1 
ATOM   2443 H  H    . ASP   A 1 165 ? 0.916   11.71   -12.532 0   35.62  ? 855  ASP   A H    1 1 
ATOM   2444 H  HA   . ASP   A 1 165 ? -0.965  10.712  -12.435 0   36.4   ? 855  ASP   A HA   1 1 
ATOM   2445 H  HB2  . ASP   A 1 165 ? -1.726  12.797  -13.713 0   37.42  ? 855  ASP   A HB2  1 1 
ATOM   2446 H  HB3  . ASP   A 1 165 ? -1.848  11.746  -15.137 0   36.72  ? 855  ASP   A HB3  1 1 
ATOM   2447 N  N    . PHE   A 1 166 ? -0.145  8.57    -13.399 1   38.37  ? 856  PHE   A N    1 1 
ATOM   2448 C  CA   . PHE   A 1 166 ? -0.012  7.201   -13.882 1   38.98  ? 856  PHE   A CA   1 1 
ATOM   2449 C  C    . PHE   A 1 166 ? -1.23   6.371   -13.411 1   39.45  ? 856  PHE   A C    1 1 
ATOM   2450 O  O    . PHE   A 1 166 ? -1.086  5.212   -13.032 1   39.56  ? 856  PHE   A O    1 1 
ATOM   2451 C  CB   . PHE   A 1 166 ? 1.338   6.614   -13.413 1   38.86  ? 856  PHE   A CB   1 1 
ATOM   2452 C  CG   . PHE   A 1 166 ? 2.52    7.306   -14.053 1   39.49  ? 856  PHE   A CG   1 1 
ATOM   2453 C  CD1  . PHE   A 1 166 ? 3.031   8.479   -13.521 1   40.21  ? 856  PHE   A CD1  1 1 
ATOM   2454 C  CD2  . PHE   A 1 166 ? 3.078   6.821   -15.222 1   40.26  ? 856  PHE   A CD2  1 1 
ATOM   2455 C  CE1  . PHE   A 1 166 ? 4.092   9.134   -14.131 1   40.79  ? 856  PHE   A CE1  1 1 
ATOM   2456 C  CE2  . PHE   A 1 166 ? 4.144   7.477   -15.825 1   40.88  ? 856  PHE   A CE2  1 1 
ATOM   2457 C  CZ   . PHE   A 1 166 ? 4.639   8.631   -15.279 1   40.57  ? 856  PHE   A CZ   1 1 
ATOM   2458 H  H    . PHE   A 1 166 ? 0.132   8.677   -12.428 0   37.09  ? 856  PHE   A H    1 1 
ATOM   2459 H  HA   . PHE   A 1 166 ? -0.007  7.181   -14.971 0   37.3   ? 856  PHE   A HA   1 1 
ATOM   2460 H  HB2  . PHE   A 1 166 ? 1.438   6.735   -12.336 0   38.23  ? 856  PHE   A HB2  1 1 
ATOM   2461 H  HB3  . PHE   A 1 166 ? 1.394   5.558   -13.674 0   38.38  ? 856  PHE   A HB3  1 1 
ATOM   2462 H  HD1  . PHE   A 1 166 ? 2.601   8.886   -12.622 0   38.58  ? 856  PHE   A HD1  1 1 
ATOM   2463 H  HD2  . PHE   A 1 166 ? 2.69    5.918   -15.662 0   38.94  ? 856  PHE   A HD2  1 1 
ATOM   2464 H  HE1  . PHE   A 1 166 ? 4.486   10.038  -13.699 0   38.77  ? 856  PHE   A HE1  1 1 
ATOM   2465 H  HE2  . PHE   A 1 166 ? 4.577   7.081   -16.728 0   38.98  ? 856  PHE   A HE2  1 1 
ATOM   2466 H  HZ   . PHE   A 1 166 ? 5.468   9.136   -15.746 0   38.36  ? 856  PHE   A HZ   1 1 
ATOM   2467 N  N    . GLY   A 1 167 ? -2.422  6.974   -13.483 1   39.66  ? 857  GLY   A N    1 1 
ATOM   2468 C  CA   . GLY   A 1 167 ? -3.673  6.347   -13.08  1   40.46  ? 857  GLY   A CA   1 1 
ATOM   2469 C  C    . GLY   A 1 167 ? -4.137  5.294   -14.062 1   41.09  ? 857  GLY   A C    1 1 
ATOM   2470 O  O    . GLY   A 1 167 ? -4.55   4.21    -13.648 1   41.38  ? 857  GLY   A O    1 1 
ATOM   2471 H  H    . GLY   A 1 167 ? -2.565  7.91    -13.848 0   39.07  ? 857  GLY   A H    1 1 
ATOM   2472 H  HA2  . GLY   A 1 167 ? -3.547  5.876   -12.106 0   42.22  ? 857  GLY   A HA2  1 1 
ATOM   2473 H  HA3  . GLY   A 1 167 ? -4.448  7.107   -12.997 0   41.85  ? 857  GLY   A HA3  1 1 
ATOM   2474 N  N    . LEU   A 1 168 ? -4.072  5.599   -15.369 1   41.29  ? 858  LEU   A N    1 1 
ATOM   2475 C  CA   . LEU   A 1 168 ? -4.429  4.634   -16.416 1   41.95  ? 858  LEU   A CA   1 1 
ATOM   2476 C  C    . LEU   A 1 168 ? -3.191  3.873   -16.946 1   42.86  ? 858  LEU   A C    1 1 
ATOM   2477 O  O    . LEU   A 1 168 ? -3.364  2.963   -17.747 1   42.77  ? 858  LEU   A O    1 1 
ATOM   2478 C  CB   . LEU   A 1 168 ? -5.137  5.33    -17.602 1   42.07  ? 858  LEU   A CB   1 1 
ATOM   2479 C  CG   . LEU   A 1 168 ? -6.333  6.261   -17.317 1   43.38  ? 858  LEU   A CG   1 1 
ATOM   2480 C  CD1  . LEU   A 1 168 ? -6.923  6.778   -18.62  1   43.94  ? 858  LEU   A CD1  1 1 
ATOM   2481 C  CD2  . LEU   A 1 168 ? -7.426  5.564   -16.499 1   43.94  ? 858  LEU   A CD2  1 1 
ATOM   2482 H  H    . LEU   A 1 168 ? -3.769  6.497   -15.732 0   41.44  ? 858  LEU   A H    1 1 
ATOM   2483 H  HA   . LEU   A 1 168 ? -5.107  3.88    -16.019 0   45.04  ? 858  LEU   A HA   1 1 
ATOM   2484 H  HB2  . LEU   A 1 168 ? -4.393  5.926   -18.13  0   42.48  ? 858  LEU   A HB2  1 1 
ATOM   2485 H  HB3  . LEU   A 1 168 ? -5.503  4.552   -18.271 0   44.44  ? 858  LEU   A HB3  1 1 
ATOM   2486 H  HG   . LEU   A 1 168 ? -5.984  7.118   -16.744 0   44.71  ? 858  LEU   A HG   1 1 
ATOM   2487 H  HD11 . LEU   A 1 168 ? -7.735  7.469   -18.4   0   46.65  ? 858  LEU   A HD11 1 1 
ATOM   2488 H  HD12 . LEU   A 1 168 ? -6.15   7.285   -19.195 0   44.83  ? 858  LEU   A HD12 1 1 
ATOM   2489 H  HD13 . LEU   A 1 168 ? -7.298  5.929   -19.187 0   46.89  ? 858  LEU   A HD13 1 1 
ATOM   2490 H  HD21 . LEU   A 1 168 ? -8.349  6.14    -16.554 0   48.39  ? 858  LEU   A HD21 1 1 
ATOM   2491 H  HD22 . LEU   A 1 168 ? -7.586  4.564   -16.9   0   48.81  ? 858  LEU   A HD22 1 1 
ATOM   2492 H  HD23 . LEU   A 1 168 ? -7.114  5.502   -15.457 0   47.86  ? 858  LEU   A HD23 1 1 
ATOM   2493 N  N    . ALA   A 1 169 ? -1.96   4.239   -16.526 1   43.64  ? 859  ALA   A N    1 1 
ATOM   2494 C  CA   . ALA   A 1 169 ? -0.731  3.603   -17.006 1   44.87  ? 859  ALA   A CA   1 1 
ATOM   2495 C  C    . ALA   A 1 169 ? -0.672  2.107   -16.714 1   46.06  ? 859  ALA   A C    1 1 
ATOM   2496 O  O    . ALA   A 1 169 ? -1.141  1.664   -15.664 1   46.18  ? 859  ALA   A O    1 1 
ATOM   2497 C  CB   . ALA   A 1 169 ? 0.482   4.295   -16.412 1   44.99  ? 859  ALA   A CB   1 1 
ATOM   2498 H  H    . ALA   A 1 169 ? -1.785  4.982   -15.856 0   43.71  ? 859  ALA   A H    1 1 
ATOM   2499 H  HA   . ALA   A 1 169 ? -0.686  3.736   -18.086 0   45.24  ? 859  ALA   A HA   1 1 
ATOM   2500 H  HB1  . ALA   A 1 169 ? 1.38    3.746   -16.691 0   45.17  ? 859  ALA   A HB1  1 1 
ATOM   2501 H  HB2  . ALA   A 1 169 ? 0.531   5.31    -16.805 0   43.94  ? 859  ALA   A HB2  1 1 
ATOM   2502 H  HB3  . ALA   A 1 169 ? 0.367   4.318   -15.33  0   45.21  ? 859  ALA   A HB3  1 1 
ATOM   2503 N  N    . LYS   A 1 170 ? -0.123  1.324   -17.668 1   46.74  ? 860  LYS   A N    1 1 
ATOM   2504 C  CA   . LYS   A 1 170 ? -0.025  -0.131  -17.557 1   47.85  ? 860  LYS   A CA   1 1 
ATOM   2505 C  C    . LYS   A 1 170 ? 1.332   -0.628  -18.058 1   49.21  ? 860  LYS   A C    1 1 
ATOM   2506 O  O    . LYS   A 1 170 ? 1.783   -0.203  -19.121 1   49.3   ? 860  LYS   A O    1 1 
ATOM   2507 C  CB   . LYS   A 1 170 ? -1.138  -0.809  -18.384 1   49.3   ? 860  LYS   A CB   1 1 
ATOM   2508 C  CG   . LYS   A 1 170 ? -2.572  -0.372  -18.063 1   52.88  ? 860  LYS   A CG   1 1 
ATOM   2509 C  CD   . LYS   A 1 170 ? -3.129  -0.976  -16.773 1   56.64  ? 860  LYS   A CD   1 1 
ATOM   2510 C  CE   . LYS   A 1 170 ? -4.352  -0.231  -16.294 1   59.92  ? 860  LYS   A CE   1 1 
ATOM   2511 N  NZ   . LYS   A 1 170 ? -4.918  -0.829  -15.057 1   62.05  ? 860  LYS   A NZ   1 1 
ATOM   2512 H  H    . LYS   A 1 170 ? 0.264   1.681   -18.536 0   49.08  ? 860  LYS   A H    1 1 
ATOM   2513 H  HA   . LYS   A 1 170 ? -0.13   -0.44   -16.518 0   53.24  ? 860  LYS   A HA   1 1 
ATOM   2514 H  HB2  . LYS   A 1 170 ? -0.961  -0.597  -19.438 0   55.02  ? 860  LYS   A HB2  1 1 
ATOM   2515 H  HB3  . LYS   A 1 170 ? -1.083  -1.884  -18.219 0   57.1   ? 860  LYS   A HB3  1 1 
ATOM   2516 H  HG2  . LYS   A 1 170 ? -2.623  0.712   -17.978 0   57.52  ? 860  LYS   A HG2  1 1 
ATOM   2517 H  HG3  . LYS   A 1 170 ? -3.218  -0.699  -18.876 0   59.77  ? 860  LYS   A HG3  1 1 
ATOM   2518 H  HD2  . LYS   A 1 170 ? -3.417  -2.009  -16.961 0   65.81  ? 860  LYS   A HD2  1 1 
ATOM   2519 H  HD3  . LYS   A 1 170 ? -2.385  -0.936  -15.979 0   63.63  ? 860  LYS   A HD3  1 1 
ATOM   2520 H  HE2  . LYS   A 1 170 ? -4.08   0.801   -16.078 0   65.62  ? 860  LYS   A HE2  1 1 
ATOM   2521 H  HE3  . LYS   A 1 170 ? -5.117  -0.263  -17.069 0   67.8   ? 860  LYS   A HE3  1 1 
ATOM   2522 H  HZ1  . LYS   A 1 170 ? -5.565  -0.178  -14.624 0   70.04  ? 860  LYS   A HZ1  1 1 
ATOM   2523 H  HZ2  . LYS   A 1 170 ? -5.418  -1.682  -15.285 0   72.31  ? 860  LYS   A HZ2  1 1 
ATOM   2524 H  HZ3  . LYS   A 1 170 ? -4.175  -1.046  -14.4   0   70.98  ? 860  LYS   A HZ3  1 1 
ATOM   2525 N  N    . LEU   A 1 171 ? 1.968   -1.549  -17.311 1   50.17  ? 861  LEU   A N    1 1 
ATOM   2526 C  CA   . LEU   A 1 171 ? 3.246   -2.146  -17.708 1   51.59  ? 861  LEU   A CA   1 1 
ATOM   2527 C  C    . LEU   A 1 171 ? 2.976   -3.334  -18.634 1   52.82  ? 861  LEU   A C    1 1 
ATOM   2528 O  O    . LEU   A 1 171 ? 2.046   -4.1    -18.387 1   52.94  ? 861  LEU   A O    1 1 
ATOM   2529 C  CB   . LEU   A 1 171 ? 4.044   -2.63   -16.474 1   52     ? 861  LEU   A CB   1 1 
ATOM   2530 C  CG   . LEU   A 1 171 ? 4.647   -1.539  -15.566 1   53.76  ? 861  LEU   A CG   1 1 
ATOM   2531 C  CD1  . LEU   A 1 171 ? 4.94    -2.073  -14.175 1   54.29  ? 861  LEU   A CD1  1 1 
ATOM   2532 C  CD2  . LEU   A 1 171 ? 5.945   -0.974  -16.147 1   54.62  ? 861  LEU   A CD2  1 1 
ATOM   2533 H  H    . LEU   A 1 171 ? 1.617   -1.898  -16.425 0   57.56  ? 861  LEU   A H    1 1 
ATOM   2534 H  HA   . LEU   A 1 171 ? 3.849   -1.415  -18.245 0   58.4   ? 861  LEU   A HA   1 1 
ATOM   2535 H  HB2  . LEU   A 1 171 ? 3.383   -3.248  -15.867 0   61.86  ? 861  LEU   A HB2  1 1 
ATOM   2536 H  HB3  . LEU   A 1 171 ? 4.868   -3.246  -16.83  0   62.26  ? 861  LEU   A HB3  1 1 
ATOM   2537 H  HG   . LEU   A 1 171 ? 3.931   -0.726  -15.457 0   59.75  ? 861  LEU   A HG   1 1 
ATOM   2538 H  HD11 . LEU   A 1 171 ? 5.378   -1.276  -13.577 0   61.84  ? 861  LEU   A HD11 1 1 
ATOM   2539 H  HD12 . LEU   A 1 171 ? 4.01    -2.409  -13.718 0   63.15  ? 861  LEU   A HD12 1 1 
ATOM   2540 H  HD13 . LEU   A 1 171 ? 5.639   -2.905  -14.254 0   64.4   ? 861  LEU   A HD13 1 1 
ATOM   2541 H  HD21 . LEU   A 1 171 ? 6.286   -0.156  -15.514 0   60.77  ? 861  LEU   A HD21 1 1 
ATOM   2542 H  HD22 . LEU   A 1 171 ? 6.694   -1.765  -16.158 0   63.22  ? 861  LEU   A HD22 1 1 
ATOM   2543 H  HD23 . LEU   A 1 171 ? 5.779   -0.614  -17.161 0   60.78  ? 861  LEU   A HD23 1 1 
ATOM   2544 N  N    . LEU   A 1 172 ? 3.784   -3.494  -19.69  1   53.62  ? 862  LEU   A N    1 1 
ATOM   2545 C  CA   . LEU   A 1 172 ? 3.633   -4.601  -20.631 1   55     ? 862  LEU   A CA   1 1 
ATOM   2546 C  C    . LEU   A 1 172 ? 4.65    -5.686  -20.303 1   56.52  ? 862  LEU   A C    1 1 
ATOM   2547 O  O    . LEU   A 1 172 ? 5.805   -5.376  -20.011 1   56.82  ? 862  LEU   A O    1 1 
ATOM   2548 C  CB   . LEU   A 1 172 ? 3.874   -4.131  -22.077 1   55.14  ? 862  LEU   A CB   1 1 
ATOM   2549 C  CG   . LEU   A 1 172 ? 2.945   -3.056  -22.65  1   56.58  ? 862  LEU   A CG   1 1 
ATOM   2550 C  CD1  . LEU   A 1 172 ? 3.504   -2.51   -23.952 1   57.18  ? 862  LEU   A CD1  1 1 
ATOM   2551 C  CD2  . LEU   A 1 172 ? 1.541   -3.594  -22.896 1   57.25  ? 862  LEU   A CD2  1 1 
ATOM   2552 H  H    . LEU   A 1 172 ? 4.558   -2.876  -19.913 0   63.22  ? 862  LEU   A H    1 1 
ATOM   2553 H  HA   . LEU   A 1 172 ? 2.636   -5.033  -20.566 0   68.36  ? 862  LEU   A HA   1 1 
ATOM   2554 H  HB2  . LEU   A 1 172 ? 4.891   -3.744  -22.131 0   66.8   ? 862  LEU   A HB2  1 1 
ATOM   2555 H  HB3  . LEU   A 1 172 ? 3.793   -5.001  -22.728 0   69.11  ? 862  LEU   A HB3  1 1 
ATOM   2556 H  HG   . LEU   A 1 172 ? 2.871   -2.229  -21.945 0   64.94  ? 862  LEU   A HG   1 1 
ATOM   2557 H  HD11 . LEU   A 1 172 ? 2.823   -1.759  -24.348 0   65.03  ? 862  LEU   A HD11 1 1 
ATOM   2558 H  HD12 . LEU   A 1 172 ? 4.477   -2.06   -23.759 0   65.83  ? 862  LEU   A HD12 1 1 
ATOM   2559 H  HD13 . LEU   A 1 172 ? 3.609   -3.33   -24.662 0   68.13  ? 862  LEU   A HD13 1 1 
ATOM   2560 H  HD21 . LEU   A 1 172 ? 0.958   -2.838  -23.42  0   66.83  ? 862  LEU   A HD21 1 1 
ATOM   2561 H  HD22 . LEU   A 1 172 ? 1.606   -4.495  -23.504 0   69.99  ? 862  LEU   A HD22 1 1 
ATOM   2562 H  HD23 . LEU   A 1 172 ? 1.061   -3.821  -21.945 0   68.76  ? 862  LEU   A HD23 1 1 
ATOM   2563 N  N    . GLY   A 1 173 ? 4.228   -6.943  -20.384 1   57.32  ? 863  GLY   A N    1 1 
ATOM   2564 C  CA   . GLY   A 1 173 ? 5.113   -8.076  -20.152 1   58.62  ? 863  GLY   A CA   1 1 
ATOM   2565 C  C    . GLY   A 1 173 ? 6.089   -8.272  -21.298 1   59.95  ? 863  GLY   A C    1 1 
ATOM   2566 O  O    . GLY   A 1 173 ? 5.899   -7.71   -22.381 1   60.17  ? 863  GLY   A O    1 1 
ATOM   2567 H  H    . GLY   A 1 173 ? 3.279   -7.218  -20.62  0   75.52  ? 863  GLY   A H    1 1 
ATOM   2568 H  HA2  . GLY   A 1 173 ? 5.676   -7.925  -19.233 0   78.83  ? 863  GLY   A HA2  1 1 
ATOM   2569 H  HA3  . GLY   A 1 173 ? 4.521   -8.985  -20.048 0   81.13  ? 863  GLY   A HA3  1 1 
ATOM   2570 N  N    . ALA   A 1 174 ? 7.139   -9.084  -21.077 1   60.65  ? 864  ALA   A N    1 1 
ATOM   2571 C  CA   . ALA   A 1 174 ? 8.169   -9.358  -22.087 1   61.76  ? 864  ALA   A CA   1 1 
ATOM   2572 C  C    . ALA   A 1 174 ? 7.579   -9.802  -23.434 1   62.76  ? 864  ALA   A C    1 1 
ATOM   2573 O  O    . ALA   A 1 174 ? 8.012   -9.315  -24.478 1   62.96  ? 864  ALA   A O    1 1 
ATOM   2574 C  CB   . ALA   A 1 174 ? 9.136   -10.412 -21.568 1   61.97  ? 864  ALA   A CB   1 1 
ATOM   2575 H  H    . ALA   A 1 174 ? 7.301   -9.567  -20.199 0   86.52  ? 864  ALA   A H    1 1 
ATOM   2576 H  HA   . ALA   A 1 174 ? 8.741   -8.447  -22.26  0   86.42  ? 864  ALA   A HA   1 1 
ATOM   2577 H  HB1  . ALA   A 1 174 ? 9.866   -10.634 -22.346 0   93.53  ? 864  ALA   A HB1  1 1 
ATOM   2578 H  HB2  . ALA   A 1 174 ? 9.64    -10.027 -20.683 0   91.09  ? 864  ALA   A HB2  1 1 
ATOM   2579 H  HB3  . ALA   A 1 174 ? 8.579   -11.313 -21.315 0   93.89  ? 864  ALA   A HB3  1 1 
ATOM   2580 N  N    . GLU   A 1 175 ? 6.572   -10.691 -23.401 1   63.25  ? 865  GLU   A N    1 1 
ATOM   2581 C  CA   . GLU   A 1 175 ? 5.902   -11.199 -24.599 1   64.16  ? 865  GLU   A CA   1 1 
ATOM   2582 C  C    . GLU   A 1 175 ? 4.498   -10.562 -24.713 1   64.35  ? 865  GLU   A C    1 1 
ATOM   2583 O  O    . GLU   A 1 175 ? 3.505   -11.276 -24.876 1   64.6   ? 865  GLU   A O    1 1 
ATOM   2584 C  CB   . GLU   A 1 175 ? 5.798   -12.737 -24.528 1   67.07  ? 865  GLU   A CB   1 1 
ATOM   2585 C  CG   . GLU   A 1 175 ? 7.103   -13.46  -24.227 1   73.18  ? 865  GLU   A CG   1 1 
ATOM   2586 C  CD   . GLU   A 1 175 ? 8.239   -13.164 -25.185 1   81.06  ? 865  GLU   A CD   1 1 
ATOM   2587 O  OE1  . GLU   A 1 175 ? 8.124   -13.531 -26.377 1   82.73  ? 865  GLU   A OE1  1 1 
ATOM   2588 O  OE2  . GLU   A 1 175 ? 9.253   -12.578 -24.742 1   83.65  ? 865  GLU   A OE2  1 1 
ATOM   2589 H  H    . GLU   A 1 175 ? 6.201   -11.088 -22.544 0   91.69  ? 865  GLU   A H    1 1 
ATOM   2590 H  HA   . GLU   A 1 175 ? 6.458   -10.936 -25.497 0   94.38  ? 865  GLU   A HA   1 1 
ATOM   2591 H  HB2  . GLU   A 1 175 ? 5.099   -13.002 -23.736 0   101.93 ? 865  GLU   A HB2  1 1 
ATOM   2592 H  HB3  . GLU   A 1 175 ? 5.428   -13.106 -25.483 0   103.27 ? 865  GLU   A HB3  1 1 
ATOM   2593 H  HG2  . GLU   A 1 175 ? 7.435   -13.203 -23.223 0   108.78 ? 865  GLU   A HG2  1 1 
ATOM   2594 H  HG3  . GLU   A 1 175 ? 6.916   -14.532 -24.276 0   113.44 ? 865  GLU   A HG3  1 1 
ATOM   2595 N  N    . GLU   A 1 176 ? 4.422   -9.217  -24.634 1   63.93  ? 866  GLU   A N    1 1 
ATOM   2596 C  CA   . GLU   A 1 176 ? 3.155   -8.483  -24.701 1   64.05  ? 866  GLU   A CA   1 1 
ATOM   2597 C  C    . GLU   A 1 176 ? 3.39    -7.109  -25.35  1   63.69  ? 866  GLU   A C    1 1 
ATOM   2598 O  O    . GLU   A 1 176 ? 4.035   -6.256  -24.743 1   63.85  ? 866  GLU   A O    1 1 
ATOM   2599 C  CB   . GLU   A 1 176 ? 2.597   -8.314  -23.276 1   66.68  ? 866  GLU   A CB   1 1 
ATOM   2600 C  CG   . GLU   A 1 176 ? 1.182   -7.762  -23.18  1   72.47  ? 866  GLU   A CG   1 1 
ATOM   2601 C  CD   . GLU   A 1 176 ? 0.684   -7.526  -21.764 1   79.47  ? 866  GLU   A CD   1 1 
ATOM   2602 O  OE1  . GLU   A 1 176 ? 1.393   -7.905  -20.803 1   80.46  ? 866  GLU   A OE1  1 1 
ATOM   2603 O  OE2  . GLU   A 1 176 ? -0.422  -6.956  -21.616 1   81.73  ? 866  GLU   A OE2  1 1 
ATOM   2604 H  H    . GLU   A 1 176 ? 5.226   -8.609  -24.519 0   87.34  ? 866  GLU   A H    1 1 
ATOM   2605 H  HA   . GLU   A 1 176 ? 2.426   -9.029  -25.298 0   87.87  ? 866  GLU   A HA   1 1 
ATOM   2606 H  HB2  . GLU   A 1 176 ? 2.608   -9.285  -22.784 0   91.16  ? 866  GLU   A HB2  1 1 
ATOM   2607 H  HB3  . GLU   A 1 176 ? 3.246   -7.63   -22.733 0   87.19  ? 866  GLU   A HB3  1 1 
ATOM   2608 H  HG2  . GLU   A 1 176 ? 1.13    -6.805  -23.697 0   90.91  ? 866  GLU   A HG2  1 1 
ATOM   2609 H  HG3  . GLU   A 1 176 ? 0.5     -8.469  -23.651 0   94.79  ? 866  GLU   A HG3  1 1 
ATOM   2610 N  N    . LYS   A 1 177 ? 2.889   -6.897  -26.581 1   63.03  ? 867  LYS   A N    1 1 
ATOM   2611 C  CA   . LYS   A 1 177 ? 3.065   -5.623  -27.29  1   62.84  ? 867  LYS   A CA   1 1 
ATOM   2612 C  C    . LYS   A 1 177 ? 1.817   -4.716  -27.251 1   62.24  ? 867  LYS   A C    1 1 
ATOM   2613 O  O    . LYS   A 1 177 ? 1.821   -3.687  -27.92  1   62.34  ? 867  LYS   A O    1 1 
ATOM   2614 C  CB   . LYS   A 1 177 ? 3.478   -5.876  -28.76  1   64.8   ? 867  LYS   A CB   1 1 
ATOM   2615 C  CG   . LYS   A 1 177 ? 4.736   -6.732  -28.961 1   68.92  ? 867  LYS   A CG   1 1 
ATOM   2616 C  CD   . LYS   A 1 177 ? 6.038   -5.99   -28.625 1   73.23  ? 867  LYS   A CD   1 1 
ATOM   2617 C  CE   . LYS   A 1 177 ? 7.241   -6.837  -28.943 1   76.66  ? 867  LYS   A CE   1 1 
ATOM   2618 N  NZ   . LYS   A 1 177 ? 8.494   -6.274  -28.373 1   78.84  ? 867  LYS   A NZ   1 1 
ATOM   2619 H  H    . LYS   A 1 177 ? 2.376   -7.589  -27.116 0   84.56  ? 867  LYS   A H    1 1 
ATOM   2620 H  HA   . LYS   A 1 177 ? 3.867   -5.05   -26.827 0   78.76  ? 867  LYS   A HA   1 1 
ATOM   2621 H  HB2  . LYS   A 1 177 ? 2.656   -6.373  -29.274 0   84.64  ? 867  LYS   A HB2  1 1 
ATOM   2622 H  HB3  . LYS   A 1 177 ? 3.678   -4.917  -29.237 0   81.39  ? 867  LYS   A HB3  1 1 
ATOM   2623 H  HG2  . LYS   A 1 177 ? 4.687   -7.628  -28.344 0   92.05  ? 867  LYS   A HG2  1 1 
ATOM   2624 H  HG3  . LYS   A 1 177 ? 4.788   -7.018  -30.01  0   90.69  ? 867  LYS   A HG3  1 1 
ATOM   2625 H  HD2  . LYS   A 1 177 ? 6.096   -5.077  -29.216 0   90.83  ? 867  LYS   A HD2  1 1 
ATOM   2626 H  HD3  . LYS   A 1 177 ? 6.069   -5.752  -27.563 0   91.72  ? 867  LYS   A HD3  1 1 
ATOM   2627 H  HE2  . LYS   A 1 177 ? 7.094   -7.832  -28.525 0   101.14 ? 867  LYS   A HE2  1 1 
ATOM   2628 H  HE3  . LYS   A 1 177 ? 7.354   -6.895  -30.024 0   100.13 ? 867  LYS   A HE3  1 1 
ATOM   2629 H  HZ1  . LYS   A 1 177 ? 9.272   -6.892  -28.58  0   102.37 ? 867  LYS   A HZ1  1 1 
ATOM   2630 H  HZ2  . LYS   A 1 177 ? 8.683   -5.362  -28.776 0   98.81  ? 867  LYS   A HZ2  1 1 
ATOM   2631 H  HZ3  . LYS   A 1 177 ? 8.408   -6.181  -27.366 0   98.6   ? 867  LYS   A HZ3  1 1 
ATOM   2632 N  N    . GLU   A 1 178 ? 0.777   -5.057  -26.462 1   61.46  ? 868  GLU   A N    1 1 
ATOM   2633 C  CA   . GLU   A 1 178 ? -0.447  -4.251  -26.391 1   61.19  ? 868  GLU   A CA   1 1 
ATOM   2634 C  C    . GLU   A 1 178 ? -1.226  -4.507  -25.097 1   60.6   ? 868  GLU   A C    1 1 
ATOM   2635 O  O    . GLU   A 1 178 ? -1.08   -5.567  -24.493 1   60.67  ? 868  GLU   A O    1 1 
ATOM   2636 C  CB   . GLU   A 1 178 ? -1.354  -4.528  -27.612 1   63.36  ? 868  GLU   A CB   1 1 
ATOM   2637 C  CG   . GLU   A 1 178 ? -1.656  -5.998  -27.872 1   68.52  ? 868  GLU   A CG   1 1 
ATOM   2638 C  CD   . GLU   A 1 178 ? -2.493  -6.274  -29.107 1   74.86  ? 868  GLU   A CD   1 1 
ATOM   2639 O  OE1  . GLU   A 1 178 ? -2.712  -5.337  -29.909 1   75.82  ? 868  GLU   A OE1  1 1 
ATOM   2640 O  OE2  . GLU   A 1 178 ? -2.923  -7.437  -29.28  1   76.81  ? 868  GLU   A OE2  1 1 
ATOM   2641 H  H    . GLU   A 1 178 ? 0.742   -5.868  -25.852 0   78.75  ? 868  GLU   A H    1 1 
ATOM   2642 H  HA   . GLU   A 1 178 ? -0.187  -3.194  -26.401 0   72.46  ? 868  GLU   A HA   1 1 
ATOM   2643 H  HB2  . GLU   A 1 178 ? -2.305  -4.024  -27.452 0   77.43  ? 868  GLU   A HB2  1 1 
ATOM   2644 H  HB3  . GLU   A 1 178 ? -0.866  -4.128  -28.5   0   77.75  ? 868  GLU   A HB3  1 1 
ATOM   2645 H  HG2  . GLU   A 1 178 ? -0.722  -6.541  -28.003 0   87.99  ? 868  GLU   A HG2  1 1 
ATOM   2646 H  HG3  . GLU   A 1 178 ? -2.199  -6.404  -27.02  0   87.57  ? 868  GLU   A HG3  1 1 
ATOM   2647 N  N    . TYR   A 1 179 ? -2.054  -3.532  -24.679 1   59.89  ? 869  TYR   A N    1 1 
ATOM   2648 C  CA   . TYR   A 1 179 ? -2.901  -3.644  -23.488 1   59.66  ? 869  TYR   A CA   1 1 
ATOM   2649 C  C    . TYR   A 1 179 ? -4.363  -3.453  -23.906 1   59.84  ? 869  TYR   A C    1 1 
ATOM   2650 O  O    . TYR   A 1 179 ? -4.691  -2.425  -24.492 1   59.92  ? 869  TYR   A O    1 1 
ATOM   2651 C  CB   . TYR   A 1 179 ? -2.505  -2.603  -22.417 1   59.29  ? 869  TYR   A CB   1 1 
ATOM   2652 C  CG   . TYR   A 1 179 ? -3.495  -2.509  -21.271 1   59.52  ? 869  TYR   A CG   1 1 
ATOM   2653 C  CD1  . TYR   A 1 179 ? -4.412  -1.469  -21.202 1   60.09  ? 869  TYR   A CD1  1 1 
ATOM   2654 C  CD2  . TYR   A 1 179 ? -3.567  -3.503  -20.307 1   60.27  ? 869  TYR   A CD2  1 1 
ATOM   2655 C  CE1  . TYR   A 1 179 ? -5.359  -1.408  -20.188 1   60.86  ? 869  TYR   A CE1  1 1 
ATOM   2656 C  CE2  . TYR   A 1 179 ? -4.504  -3.449  -19.283 1   61.03  ? 869  TYR   A CE2  1 1 
ATOM   2657 C  CZ   . TYR   A 1 179 ? -5.402  -2.4    -19.227 1   61.78  ? 869  TYR   A CZ   1 1 
ATOM   2658 O  OH   . TYR   A 1 179 ? -6.32   -2.35   -18.203 1   63.15  ? 869  TYR   A OH   1 1 
ATOM   2659 H  H    . TYR   A 1 179 ? -2.155  -2.641  -25.156 0   70.54  ? 869  TYR   A H    1 1 
ATOM   2660 H  HA   . TYR   A 1 179 ? -2.8    -4.631  -23.038 0   73.92  ? 869  TYR   A HA   1 1 
ATOM   2661 H  HB2  . TYR   A 1 179 ? -1.54   -2.883  -21.997 0   69.3   ? 869  TYR   A HB2  1 1 
ATOM   2662 H  HB3  . TYR   A 1 179 ? -2.429  -1.623  -22.885 0   67.67  ? 869  TYR   A HB3  1 1 
ATOM   2663 H  HD1  . TYR   A 1 179 ? -4.393  -0.695  -21.95  0   68.03  ? 869  TYR   A HD1  1 1 
ATOM   2664 H  HD2  . TYR   A 1 179 ? -2.876  -4.329  -20.347 0   73.44  ? 869  TYR   A HD2  1 1 
ATOM   2665 H  HE1  . TYR   A 1 179 ? -6.046  -0.58   -20.152 0   69.89  ? 869  TYR   A HE1  1 1 
ATOM   2666 H  HE2  . TYR   A 1 179 ? -4.532  -4.223  -18.535 0   74.9   ? 869  TYR   A HE2  1 1 
ATOM   2667 H  HH   . TYR   A 1 179 ? -6.808  -1.485  -18.207 0   74.09  ? 869  TYR   A HH   1 1 
ATOM   2668 N  N    . HIS   A 1 180 ? -5.238  -4.42   -23.575 1   59.75  ? 870  HIS   A N    1 1 
ATOM   2669 C  CA   . HIS   A 1 180 ? -6.666  -4.354  -23.892 1   60.25  ? 870  HIS   A CA   1 1 
ATOM   2670 C  C    . HIS   A 1 180 ? -7.445  -3.941  -22.648 1   60.24  ? 870  HIS   A C    1 1 
ATOM   2671 O  O    . HIS   A 1 180 ? -7.534  -4.719  -21.701 1   60.39  ? 870  HIS   A O    1 1 
ATOM   2672 C  CB   . HIS   A 1 180 ? -7.172  -5.718  -24.376 1   61.31  ? 870  HIS   A CB   1 1 
ATOM   2673 C  CG   . HIS   A 1 180 ? -6.578  -6.145  -25.678 1   63.95  ? 870  HIS   A CG   1 1 
ATOM   2674 N  ND1  . HIS   A 1 180 ? -5.308  -6.682  -25.747 1   65.93  ? 870  HIS   A ND1  1 1 
ATOM   2675 C  CD2  . HIS   A 1 180 ? -7.106  -6.111  -26.923 1   65.19  ? 870  HIS   A CD2  1 1 
ATOM   2676 C  CE1  . HIS   A 1 180 ? -5.096  -6.953  -27.024 1   66.5   ? 870  HIS   A CE1  1 1 
ATOM   2677 N  NE2  . HIS   A 1 180 ? -6.154  -6.631  -27.77  1   66.39  ? 870  HIS   A NE2  1 1 
ATOM   2678 H  H    . HIS   A 1 180 ? -4.985  -5.265  -23.072 0   76.64  ? 870  HIS   A H    1 1 
ATOM   2679 H  HA   . HIS   A 1 180 ? -6.855  -3.635  -24.687 0   75.85  ? 870  HIS   A HA   1 1 
ATOM   2680 H  HB2  . HIS   A 1 180 ? -6.924  -6.476  -23.634 0   82.82  ? 870  HIS   A HB2  1 1 
ATOM   2681 H  HB3  . HIS   A 1 180 ? -8.252  -5.666  -24.503 0   82.68  ? 870  HIS   A HB3  1 1 
ATOM   2682 H  HD1  . HIS   A 1 180 ? -4.669  -6.837  -24.974 0   86.37  ? 870  HIS   A HD1  1 1 
ATOM   2683 H  HD2  . HIS   A 1 180 ? -8.082  -5.746  -27.197 0   87.82  ? 870  HIS   A HD2  1 1 
ATOM   2684 H  HE1  . HIS   A 1 180 ? -4.185  -7.378  -27.411 0   89.02  ? 870  HIS   A HE1  1 1 
ATOM   2685 N  N    . ALA   A 1 181 ? -8.002  -2.724  -22.638 1   60.13  ? 871  ALA   A N    1 1 
ATOM   2686 C  CA   . ALA   A 1 181 ? -8.766  -2.223  -21.496 1   60.39  ? 871  ALA   A CA   1 1 
ATOM   2687 C  C    . ALA   A 1 181 ? -10.178 -2.825  -21.434 1   60.41  ? 871  ALA   A C    1 1 
ATOM   2688 O  O    . ALA   A 1 181 ? -10.705 -3.264  -22.457 1   60.56  ? 871  ALA   A O    1 1 
ATOM   2689 C  CB   . ALA   A 1 181 ? -8.866  -0.708  -21.583 1   60.67  ? 871  ALA   A CB   1 1 
ATOM   2690 H  H    . ALA   A 1 181 ? -7.935  -2.056  -23.399 0   74.46  ? 871  ALA   A H    1 1 
ATOM   2691 H  HA   . ALA   A 1 181 ? -8.243  -2.466  -20.572 0   74.87  ? 871  ALA   A HA   1 1 
ATOM   2692 H  HB1  . ALA   A 1 181 ? -9.37   -0.334  -20.692 0   73.39  ? 871  ALA   A HB1  1 1 
ATOM   2693 H  HB2  . ALA   A 1 181 ? -7.865  -0.286  -21.65  0   71.43  ? 871  ALA   A HB2  1 1 
ATOM   2694 H  HB3  . ALA   A 1 181 ? -9.44   -0.447  -22.47  0   73.91  ? 871  ALA   A HB3  1 1 
ATOM   2695 N  N    . GLU   A 1 182 ? -10.796 -2.819  -20.236 1   60.07  ? 872  GLU   A N    1 1 
ATOM   2696 C  CA   . GLU   A 1 182 ? -12.17  -3.287  -20.047 1   60.24  ? 872  GLU   A CA   1 1 
ATOM   2697 C  C    . GLU   A 1 182 ? -13.133 -2.039  -20.153 1   59.88  ? 872  GLU   A C    1 1 
ATOM   2698 O  O    . GLU   A 1 182 ? -12.912 -1.231  -21.055 1   60.17  ? 872  GLU   A O    1 1 
ATOM   2699 C  CB   . GLU   A 1 182 ? -12.263 -4.136  -18.745 1   62.7   ? 872  GLU   A CB   1 1 
ATOM   2700 C  CG   . GLU   A 1 182 ? -13.439 -5.107  -18.676 1   68.14  ? 872  GLU   A CG   1 1 
ATOM   2701 C  CD   . GLU   A 1 182 ? -13.516 -6.138  -19.785 1   74.87  ? 872  GLU   A CD   1 1 
ATOM   2702 O  OE1  . GLU   A 1 182 ? -12.451 -6.633  -20.221 1   75.98  ? 872  GLU   A OE1  1 1 
ATOM   2703 O  OE2  . GLU   A 1 182 ? -14.649 -6.45   -20.221 1   77.08  ? 872  GLU   A OE2  1 1 
ATOM   2704 H  H    . GLU   A 1 182 ? -10.35  -2.524  -19.373 0   77.01  ? 872  GLU   A H    1 1 
ATOM   2705 H  HA   . GLU   A 1 182 ? -12.431 -3.931  -20.885 0   83.71  ? 872  GLU   A HA   1 1 
ATOM   2706 H  HB2  . GLU   A 1 182 ? -11.351 -4.726  -18.657 0   84.77  ? 872  GLU   A HB2  1 1 
ATOM   2707 H  HB3  . GLU   A 1 182 ? -12.344 -3.464  -17.892 0   84.86  ? 872  GLU   A HB3  1 1 
ATOM   2708 H  HG2  . GLU   A 1 182 ? -13.38  -5.65   -17.734 0   95.98  ? 872  GLU   A HG2  1 1 
ATOM   2709 H  HG3  . GLU   A 1 182 ? -14.372 -4.547  -18.706 0   96.19  ? 872  GLU   A HG3  1 1 
ATOM   2710 N  N    . GLY   A 1 183 ? -14.152 -1.876  -19.296 1   58.99  ? 873  GLY   A N    1 1 
ATOM   2711 C  CA   . GLY   A 1 183 ? -15.109 -0.781  -19.426 1   58.63  ? 873  GLY   A CA   1 1 
ATOM   2712 C  C    . GLY   A 1 183 ? -14.855 0.46    -18.59  1   57.86  ? 873  GLY   A C    1 1 
ATOM   2713 O  O    . GLY   A 1 183 ? -15.801 1.187   -18.285 1   58.17  ? 873  GLY   A O    1 1 
ATOM   2714 H  H    . GLY   A 1 183 ? -14.336 -2.439  -18.473 0   81.45  ? 873  GLY   A H    1 1 
ATOM   2715 H  HA2  . GLY   A 1 183 ? -15.192 -0.473  -20.467 0   81.2   ? 873  GLY   A HA2  1 1 
ATOM   2716 H  HA3  . GLY   A 1 183 ? -16.086 -1.163  -19.13  0   83.95  ? 873  GLY   A HA3  1 1 
ATOM   2717 N  N    . GLY   A 1 184 ? -13.599 0.734   -18.249 1   56.98  ? 874  GLY   A N    1 1 
ATOM   2718 C  CA   . GLY   A 1 184 ? -13.258 1.903   -17.445 1   56.46  ? 874  GLY   A CA   1 1 
ATOM   2719 C  C    . GLY   A 1 184 ? -13.309 3.198   -18.232 1   55.7   ? 874  GLY   A C    1 1 
ATOM   2720 O  O    . GLY   A 1 184 ? -13.135 3.182   -19.452 1   55.72  ? 874  GLY   A O    1 1 
ATOM   2721 H  H    . GLY   A 1 184 ? -12.79  0.185   -18.523 0   74.67  ? 874  GLY   A H    1 1 
ATOM   2722 H  HA2  . GLY   A 1 184 ? -13.938 1.979   -16.596 0   73.17  ? 874  GLY   A HA2  1 1 
ATOM   2723 H  HA3  . GLY   A 1 184 ? -12.247 1.782   -17.059 0   70.42  ? 874  GLY   A HA3  1 1 
ATOM   2724 N  N    . LYS   A 1 185 ? -13.542 4.334   -17.542 1   54.68  ? 875  LYS   A N    1 1 
ATOM   2725 C  CA   . LYS   A 1 185 ? -13.592 5.651   -18.192 1   54.21  ? 875  LYS   A CA   1 1 
ATOM   2726 C  C    . LYS   A 1 185 ? -12.202 6.025   -18.732 1   53.35  ? 875  LYS   A C    1 1 
ATOM   2727 O  O    . LYS   A 1 185 ? -11.202 5.817   -18.042 1   53.43  ? 875  LYS   A O    1 1 
ATOM   2728 C  CB   . LYS   A 1 185 ? -14.112 6.739   -17.227 1   56.05  ? 875  LYS   A CB   1 1 
ATOM   2729 C  CG   . LYS   A 1 185 ? -15.631 6.772   -17.072 1   60.56  ? 875  LYS   A CG   1 1 
ATOM   2730 C  CD   . LYS   A 1 185 ? -16.126 8.07    -16.433 1   65.47  ? 875  LYS   A CD   1 1 
ATOM   2731 C  CE   . LYS   A 1 185 ? -17.608 8.283   -16.645 1   69.64  ? 875  LYS   A CE   1 1 
ATOM   2732 N  NZ   . LYS   A 1 185 ? -18.045 9.64    -16.22  1   72.31  ? 875  LYS   A NZ   1 1 
ATOM   2733 H  H    . LYS   A 1 185 ? -13.695 4.358   -16.539 0   69.06  ? 875  LYS   A H    1 1 
ATOM   2734 H  HA   . LYS   A 1 185 ? -14.265 5.584   -19.046 0   68.47  ? 875  LYS   A HA   1 1 
ATOM   2735 H  HB2  . LYS   A 1 185 ? -13.683 6.586   -16.237 0   69.34  ? 875  LYS   A HB2  1 1 
ATOM   2736 H  HB3  . LYS   A 1 185 ? -13.802 7.708   -17.61  0   68.25  ? 875  LYS   A HB3  1 1 
ATOM   2737 H  HG2  . LYS   A 1 185 ? -16.091 6.68    -18.054 0   77.91  ? 875  LYS   A HG2  1 1 
ATOM   2738 H  HG3  . LYS   A 1 185 ? -15.943 5.946   -16.435 0   78.8   ? 875  LYS   A HG3  1 1 
ATOM   2739 H  HD2  . LYS   A 1 185 ? -15.941 8.029   -15.361 0   82.47  ? 875  LYS   A HD2  1 1 
ATOM   2740 H  HD3  . LYS   A 1 185 ? -15.603 8.919   -16.872 0   81.12  ? 875  LYS   A HD3  1 1 
ATOM   2741 H  HE2  . LYS   A 1 185 ? -17.842 8.176   -17.704 0   90.88  ? 875  LYS   A HE2  1 1 
ATOM   2742 H  HE3  . LYS   A 1 185 ? -18.161 7.548   -16.062 0   91.99  ? 875  LYS   A HE3  1 1 
ATOM   2743 H  HZ1  . LYS   A 1 185 ? -19.034 9.764   -16.414 0   95.36  ? 875  LYS   A HZ1  1 1 
ATOM   2744 H  HZ2  . LYS   A 1 185 ? -17.887 9.758   -15.225 0   94.29  ? 875  LYS   A HZ2  1 1 
ATOM   2745 H  HZ3  . LYS   A 1 185 ? -17.521 10.348  -16.725 0   91.35  ? 875  LYS   A HZ3  1 1 
ATOM   2746 N  N    . VAL   A 1 186 ? -12.154 6.569   -19.97  1   52.33  ? 876  VAL   A N    1 1 
ATOM   2747 C  CA   . VAL   A 1 186 ? -10.913 6.893   -20.69  1   51.79  ? 876  VAL   A CA   1 1 
ATOM   2748 C  C    . VAL   A 1 186 ? -11.048 8.231   -21.488 1   51.08  ? 876  VAL   A C    1 1 
ATOM   2749 O  O    . VAL   A 1 186 ? -12.161 8.569   -21.89  1   51.18  ? 876  VAL   A O    1 1 
ATOM   2750 C  CB   . VAL   A 1 186 ? -10.51  5.715   -21.644 1   52.49  ? 876  VAL   A CB   1 1 
ATOM   2751 C  CG1  . VAL   A 1 186 ? -9.868  4.555   -20.892 1   53     ? 876  VAL   A CG1  1 1 
ATOM   2752 C  CG2  . VAL   A 1 186 ? -11.693 5.214   -22.475 1   52.94  ? 876  VAL   A CG2  1 1 
ATOM   2753 H  H    . VAL   A 1 186 ? -12.986 6.842   -20.482 0   63     ? 876  VAL   A H    1 1 
ATOM   2754 H  HA   . VAL   A 1 186 ? -10.125 7.034   -19.952 0   57.64  ? 876  VAL   A HA   1 1 
ATOM   2755 H  HB   . VAL   A 1 186 ? -9.765  6.088   -22.345 0   58.17  ? 876  VAL   A HB   1 1 
ATOM   2756 H  HG11 . VAL   A 1 186 ? -9.636  3.763   -21.602 0   60.61  ? 876  VAL   A HG11 1 1 
ATOM   2757 H  HG12 . VAL   A 1 186 ? -8.955  4.902   -20.413 0   58.74  ? 876  VAL   A HG12 1 1 
ATOM   2758 H  HG13 . VAL   A 1 186 ? -10.569 4.188   -20.144 0   61.71  ? 876  VAL   A HG13 1 1 
ATOM   2759 H  HG21 . VAL   A 1 186 ? -11.309 4.532   -23.232 0   62.53  ? 876  VAL   A HG21 1 1 
ATOM   2760 H  HG22 . VAL   A 1 186 ? -12.387 4.676   -21.831 0   63.99  ? 876  VAL   A HG22 1 1 
ATOM   2761 H  HG23 . VAL   A 1 186 ? -12.194 6.056   -22.949 0   62.26  ? 876  VAL   A HG23 1 1 
ATOM   2762 N  N    . PRO   A 1 187 ? -9.953  8.997   -21.76  1   50.12  ? 877  PRO   A N    1 1 
ATOM   2763 C  CA   . PRO   A 1 187 ? -10.111 10.252  -22.529 1   49.38  ? 877  PRO   A CA   1 1 
ATOM   2764 C  C    . PRO   A 1 187 ? -10.19  10.03   -24.042 1   48.28  ? 877  PRO   A C    1 1 
ATOM   2765 O  O    . PRO   A 1 187 ? -9.178  9.771   -24.685 1   48.57  ? 877  PRO   A O    1 1 
ATOM   2766 C  CB   . PRO   A 1 187 ? -8.876  11.063  -22.139 1   50.21  ? 877  PRO   A CB   1 1 
ATOM   2767 C  CG   . PRO   A 1 187 ? -7.85   10.05   -21.772 1   50.84  ? 877  PRO   A CG   1 1 
ATOM   2768 C  CD   . PRO   A 1 187 ? -8.538  8.77    -21.393 1   49.44  ? 877  PRO   A CD   1 1 
ATOM   2769 H  HA   . PRO   A 1 187 ? -10.988 10.806  -22.194 0   54.68  ? 877  PRO   A HA   1 1 
ATOM   2770 H  HB2  . PRO   A 1 187 ? -8.542  11.668  -22.98  0   51.65  ? 877  PRO   A HB2  1 1 
ATOM   2771 H  HB3  . PRO   A 1 187 ? -9.112  11.695  -21.284 0   52.64  ? 877  PRO   A HB3  1 1 
ATOM   2772 H  HG2  . PRO   A 1 187 ? -7.2    9.879   -22.629 0   51.16  ? 877  PRO   A HG2  1 1 
ATOM   2773 H  HG3  . PRO   A 1 187 ? -7.267  10.426  -20.932 0   51.29  ? 877  PRO   A HG3  1 1 
ATOM   2774 H  HD2  . PRO   A 1 187 ? -8.127  7.938   -21.962 0   51.82  ? 877  PRO   A HD2  1 1 
ATOM   2775 H  HD3  . PRO   A 1 187 ? -8.436  8.608   -20.321 0   52.07  ? 877  PRO   A HD3  1 1 
ATOM   2776 N  N    . ILE   A 1 188 ? -11.384 10.191  -24.617 1   46.89  ? 878  ILE   A N    1 1 
ATOM   2777 C  CA   . ILE   A 1 188 ? -11.627 9.933   -26.041 1   45.94  ? 878  ILE   A CA   1 1 
ATOM   2778 C  C    . ILE   A 1 188 ? -10.933 10.932  -26.995 1   44.75  ? 878  ILE   A C    1 1 
ATOM   2779 O  O    . ILE   A 1 188 ? -10.381 10.513  -28.012 1   44.72  ? 878  ILE   A O    1 1 
ATOM   2780 C  CB   . ILE   A 1 188 ? -13.169 9.864   -26.311 1   46.32  ? 878  ILE   A CB   1 1 
ATOM   2781 C  CG1  . ILE   A 1 188 ? -13.885 8.763   -25.46  1   47.13  ? 878  ILE   A CG1  1 1 
ATOM   2782 C  CG2  . ILE   A 1 188 ? -13.478 9.704   -27.807 1   46.75  ? 878  ILE   A CG2  1 1 
ATOM   2783 C  CD1  . ILE   A 1 188 ? -13.465 7.271   -25.677 1   48.27  ? 878  ILE   A CD1  1 1 
ATOM   2784 H  H    . ILE   A 1 188 ? -12.193 10.548  -24.119 0   53.94  ? 878  ILE   A H    1 1 
ATOM   2785 H  HA   . ILE   A 1 188 ? -11.208 8.954   -26.269 0   51.88  ? 878  ILE   A HA   1 1 
ATOM   2786 H  HB   . ILE   A 1 188 ? -13.586 10.823  -26.006 0   55.63  ? 878  ILE   A HB   1 1 
ATOM   2787 H  HG12 . ILE   A 1 188 ? -13.737 8.986   -24.404 0   57.5   ? 878  ILE   A HG12 1 1 
ATOM   2788 H  HG13 . ILE   A 1 188 ? -14.951 8.819   -25.676 0   59.97  ? 878  ILE   A HG13 1 1 
ATOM   2789 H  HG21 . ILE   A 1 188 ? -14.474 9.281   -27.927 0   58.5   ? 878  ILE   A HG21 1 1 
ATOM   2790 H  HG22 . ILE   A 1 188 ? -13.447 10.682  -28.285 0   55.33  ? 878  ILE   A HG22 1 1 
ATOM   2791 H  HG23 . ILE   A 1 188 ? -12.738 9.043   -28.256 0   56.09  ? 878  ILE   A HG23 1 1 
ATOM   2792 H  HD11 . ILE   A 1 188 ? -14.088 6.646   -25.039 0   60.71  ? 878  ILE   A HD11 1 1 
ATOM   2793 H  HD12 . ILE   A 1 188 ? -13.614 6.986   -26.717 0   59.79  ? 878  ILE   A HD12 1 1 
ATOM   2794 H  HD13 . ILE   A 1 188 ? -12.42  7.136   -25.399 0   57.33  ? 878  ILE   A HD13 1 1 
ATOM   2795 N  N    . LYS   A 1 189 ? -10.946 12.235  -26.672 1   43.64  ? 879  LYS   A N    1 1 
ATOM   2796 C  CA   . LYS   A 1 189 ? -10.379 13.271  -27.547 1   43.1   ? 879  LYS   A CA   1 1 
ATOM   2797 C  C    . LYS   A 1 189 ? -8.833  13.267  -27.633 1   42.52  ? 879  LYS   A C    1 1 
ATOM   2798 O  O    . LYS   A 1 189 ? -8.272  13.946  -28.493 1   42.42  ? 879  LYS   A O    1 1 
ATOM   2799 C  CB   . LYS   A 1 189 ? -10.911 14.656  -27.138 1   44.7   ? 879  LYS   A CB   1 1 
ATOM   2800 C  CG   . LYS   A 1 189 ? -12.418 14.8    -27.397 1   48.04  ? 879  LYS   A CG   1 1 
ATOM   2801 C  CD   . LYS   A 1 189 ? -12.984 16.138  -26.983 1   51.51  ? 879  LYS   A CD   1 1 
ATOM   2802 C  CE   . LYS   A 1 189 ? -14.464 16.206  -27.287 1   54.75  ? 879  LYS   A CE   1 1 
ATOM   2803 N  NZ   . LYS   A 1 189 ? -15.021 17.581  -27.177 1   56.73  ? 879  LYS   A NZ   1 1 
ATOM   2804 H  H    . LYS   A 1 189 ? -11.323 12.592  -25.8   0   48.72  ? 879  LYS   A H    1 1 
ATOM   2805 H  HA   . LYS   A 1 189 ? -10.73  13.078  -28.56  0   47.17  ? 879  LYS   A HA   1 1 
ATOM   2806 H  HB2  . LYS   A 1 189 ? -10.731 14.815  -26.076 0   48.84  ? 879  LYS   A HB2  1 1 
ATOM   2807 H  HB3  . LYS   A 1 189 ? -10.394 15.42   -27.717 0   48.38  ? 879  LYS   A HB3  1 1 
ATOM   2808 H  HG2  . LYS   A 1 189 ? -12.6   14.674  -28.463 0   55.23  ? 879  LYS   A HG2  1 1 
ATOM   2809 H  HG3  . LYS   A 1 189 ? -12.955 14.035  -26.837 0   55.77  ? 879  LYS   A HG3  1 1 
ATOM   2810 H  HD2  . LYS   A 1 189 ? -12.844 16.276  -25.911 0   59.53  ? 879  LYS   A HD2  1 1 
ATOM   2811 H  HD3  . LYS   A 1 189 ? -12.474 16.925  -27.536 0   59.04  ? 879  LYS   A HD3  1 1 
ATOM   2812 H  HE2  . LYS   A 1 189 ? -14.641 15.856  -28.303 0   66     ? 879  LYS   A HE2  1 1 
ATOM   2813 H  HE3  . LYS   A 1 189 ? -14.997 15.573  -26.579 0   66.7   ? 879  LYS   A HE3  1 1 
ATOM   2814 H  HZ1  . LYS   A 1 189 ? -15.208 17.804  -26.205 0   70.63  ? 879  LYS   A HZ1  1 1 
ATOM   2815 H  HZ2  . LYS   A 1 189 ? -14.364 18.261  -27.547 0   68.16  ? 879  LYS   A HZ2  1 1 
ATOM   2816 H  HZ3  . LYS   A 1 189 ? -15.886 17.645  -27.705 0   70.77  ? 879  LYS   A HZ3  1 1 
ATOM   2817 N  N    . TRP   A 1 190 ? -8.161  12.483  -26.781 1   41.98  ? 880  TRP   A N    1 1 
ATOM   2818 C  CA   . TRP   A 1 190 ? -6.71   12.299  -26.802 1   41.87  ? 880  TRP   A CA   1 1 
ATOM   2819 C  C    . TRP   A 1 190 ? -6.32   10.882  -27.287 1   41.67  ? 880  TRP   A C    1 1 
ATOM   2820 O  O    . TRP   A 1 190 ? -5.17   10.674  -27.667 1   41.75  ? 880  TRP   A O    1 1 
ATOM   2821 C  CB   . TRP   A 1 190 ? -6.122  12.547  -25.408 1   41.75  ? 880  TRP   A CB   1 1 
ATOM   2822 C  CG   . TRP   A 1 190 ? -6.037  13.994  -25.027 1   41.97  ? 880  TRP   A CG   1 1 
ATOM   2823 C  CD1  . TRP   A 1 190 ? -4.93   14.788  -25.072 1   42.74  ? 880  TRP   A CD1  1 1 
ATOM   2824 C  CD2  . TRP   A 1 190 ? -7.094  14.807  -24.501 1   41.95  ? 880  TRP   A CD2  1 1 
ATOM   2825 N  NE1  . TRP   A 1 190 ? -5.235  16.05   -24.623 1   42.96  ? 880  TRP   A NE1  1 1 
ATOM   2826 C  CE2  . TRP   A 1 190 ? -6.559  16.09   -24.269 1   42.69  ? 880  TRP   A CE2  1 1 
ATOM   2827 C  CE3  . TRP   A 1 190 ? -8.442  14.578  -24.205 1   42.38  ? 880  TRP   A CE3  1 1 
ATOM   2828 C  CZ2  . TRP   A 1 190 ? -7.329  17.137  -23.767 1   43.3   ? 880  TRP   A CZ2  1 1 
ATOM   2829 C  CZ3  . TRP   A 1 190 ? -9.204  15.62   -23.72  1   43.18  ? 880  TRP   A CZ3  1 1 
ATOM   2830 C  CH2  . TRP   A 1 190 ? -8.647  16.88   -23.503 1   43.34  ? 880  TRP   A CH2  1 1 
ATOM   2831 H  H    . TRP   A 1 190 ? -8.597  11.959  -26.029 0   43.24  ? 880  TRP   A H    1 1 
ATOM   2832 H  HA   . TRP   A 1 190 ? -6.246  13.016  -27.476 0   40.39  ? 880  TRP   A HA   1 1 
ATOM   2833 H  HB2  . TRP   A 1 190 ? -6.735  12.042  -24.662 0   40.86  ? 880  TRP   A HB2  1 1 
ATOM   2834 H  HB3  . TRP   A 1 190 ? -5.111  12.142  -25.382 0   39.31  ? 880  TRP   A HB3  1 1 
ATOM   2835 H  HD1  . TRP   A 1 190 ? -3.959  14.473  -25.416 0   39.36  ? 880  TRP   A HD1  1 1 
ATOM   2836 H  HE1  . TRP   A 1 190 ? -4.568  16.845  -24.566 0   40.76  ? 880  TRP   A HE1  1 1 
ATOM   2837 H  HE3  . TRP   A 1 190 ? -8.886  13.613  -24.384 0   43.96  ? 880  TRP   A HE3  1 1 
ATOM   2838 H  HZ2  . TRP   A 1 190 ? -6.903  18.111  -23.593 0   44.1   ? 880  TRP   A HZ2  1 1 
ATOM   2839 H  HZ3  . TRP   A 1 190 ? -10.244 15.455  -23.494 0   47.13  ? 880  TRP   A HZ3  1 1 
ATOM   2840 H  HH2  . TRP   A 1 190 ? -9.266  17.667  -23.105 0   46.9   ? 880  TRP   A HH2  1 1 
ATOM   2841 N  N    . MET   A 1 191 ? -7.258  9.913   -27.259 1   41.17  ? 881  MET   A N    1 1 
ATOM   2842 C  CA   . MET   A 1 191 ? -7.008  8.537   -27.677 1   41.41  ? 881  MET   A CA   1 1 
ATOM   2843 C  C    . MET   A 1 191 ? -6.869  8.365   -29.18  1   41.75  ? 881  MET   A C    1 1 
ATOM   2844 O  O    . MET   A 1 191 ? -7.445  9.128   -29.954 1   41.99  ? 881  MET   A O    1 1 
ATOM   2845 C  CB   . MET   A 1 191 ? -8.167  7.624   -27.219 1   41.81  ? 881  MET   A CB   1 1 
ATOM   2846 C  CG   . MET   A 1 191 ? -8.05   7.124   -25.797 1   43.46  ? 881  MET   A CG   1 1 
ATOM   2847 S  SD   . MET   A 1 191 ? -9.658  6.827   -25.037 1   45.63  ? 881  MET   A SD   1 1 
ATOM   2848 C  CE   . MET   A 1 191 ? -10.223 5.443   -25.995 1   44.29  ? 881  MET   A CE   1 1 
ATOM   2849 H  H    . MET   A 1 191 ? -8.205  10.052  -26.922 0   42.55  ? 881  MET   A H    1 1 
ATOM   2850 H  HA   . MET   A 1 191 ? -6.081  8.2     -27.215 0   41.46  ? 881  MET   A HA   1 1 
ATOM   2851 H  HB2  . MET   A 1 191 ? -9.11   8.154   -27.34  0   45.36  ? 881  MET   A HB2  1 1 
ATOM   2852 H  HB3  . MET   A 1 191 ? -8.177  6.747   -27.864 0   45.38  ? 881  MET   A HB3  1 1 
ATOM   2853 H  HG2  . MET   A 1 191 ? -7.499  6.185   -25.796 0   46.29  ? 881  MET   A HG2  1 1 
ATOM   2854 H  HG3  . MET   A 1 191 ? -7.524  7.866   -25.197 0   45.05  ? 881  MET   A HG3  1 1 
ATOM   2855 H  HE1  . MET   A 1 191 ? -11.061 4.972   -25.483 0   53.08  ? 881  MET   A HE1  1 1 
ATOM   2856 H  HE2  . MET   A 1 191 ? -10.549 5.786   -26.975 0   51.33  ? 881  MET   A HE2  1 1 
ATOM   2857 H  HE3  . MET   A 1 191 ? -9.408  4.73    -26.099 0   51.16  ? 881  MET   A HE3  1 1 
ATOM   2858 N  N    . ALA   A 1 192 ? -6.15   7.305   -29.587 1   41.64  ? 882  ALA   A N    1 1 
ATOM   2859 C  CA   . ALA   A 1 192 ? -6.004  6.927   -30.987 1   42.02  ? 882  ALA   A CA   1 1 
ATOM   2860 C  C    . ALA   A 1 192 ? -7.292  6.236   -31.463 1   42.42  ? 882  ALA   A C    1 1 
ATOM   2861 O  O    . ALA   A 1 192 ? -8.074  5.753   -30.637 1   42.67  ? 882  ALA   A O    1 1 
ATOM   2862 C  CB   . ALA   A 1 192 ? -4.816  5.991   -31.149 1   42.11  ? 882  ALA   A CB   1 1 
ATOM   2863 H  H    . ALA   A 1 192 ? -5.654  6.685   -28.954 0   42.79  ? 882  ALA   A H    1 1 
ATOM   2864 H  HA   . ALA   A 1 192 ? -5.833  7.811   -31.599 0   43.15  ? 882  ALA   A HA   1 1 
ATOM   2865 H  HB1  . ALA   A 1 192 ? -4.692  5.758   -32.205 0   44.46  ? 882  ALA   A HB1  1 1 
ATOM   2866 H  HB2  . ALA   A 1 192 ? -3.922  6.484   -30.769 0   42.62  ? 882  ALA   A HB2  1 1 
ATOM   2867 H  HB3  . ALA   A 1 192 ? -5.004  5.078   -30.587 0   44.7   ? 882  ALA   A HB3  1 1 
ATOM   2868 N  N    . LEU   A 1 193 ? -7.518  6.179   -32.784 1   42.32  ? 883  LEU   A N    1 1 
ATOM   2869 C  CA   . LEU   A 1 193 ? -8.723  5.556   -33.324 1   42.73  ? 883  LEU   A CA   1 1 
ATOM   2870 C  C    . LEU   A 1 193 ? -8.844  4.072   -32.939 1   43.36  ? 883  LEU   A C    1 1 
ATOM   2871 O  O    . LEU   A 1 193 ? -9.945  3.634   -32.596 1   43.79  ? 883  LEU   A O    1 1 
ATOM   2872 C  CB   . LEU   A 1 193 ? -8.798  5.746   -34.854 1   42.76  ? 883  LEU   A CB   1 1 
ATOM   2873 C  CG   . LEU   A 1 193 ? -10.032 5.171   -35.586 1   44.04  ? 883  LEU   A CG   1 1 
ATOM   2874 C  CD1  . LEU   A 1 193 ? -11.345 5.766   -35.056 1   44.48  ? 883  LEU   A CD1  1 1 
ATOM   2875 C  CD2  . LEU   A 1 193 ? -9.921  5.392   -37.074 1   44.57  ? 883  LEU   A CD2  1 1 
ATOM   2876 H  H    . LEU   A 1 193 ? -6.891  6.552   -33.49  0   46.27  ? 883  LEU   A H    1 1 
ATOM   2877 H  HA   . LEU   A 1 193 ? -9.568  6.072   -32.871 0   50.1   ? 883  LEU   A HA   1 1 
ATOM   2878 H  HB2  . LEU   A 1 193 ? -8.78   6.815   -35.059 0   49.29  ? 883  LEU   A HB2  1 1 
ATOM   2879 H  HB3  . LEU   A 1 193 ? -7.918  5.282   -35.297 0   50.05  ? 883  LEU   A HB3  1 1 
ATOM   2880 H  HG   . LEU   A 1 193 ? -10.074 4.095   -35.43  0   55.54  ? 883  LEU   A HG   1 1 
ATOM   2881 H  HD11 . LEU   A 1 193 ? -12.155 5.539   -35.747 0   57.8   ? 883  LEU   A HD11 1 1 
ATOM   2882 H  HD12 . LEU   A 1 193 ? -11.577 5.327   -34.086 0   55.57  ? 883  LEU   A HD12 1 1 
ATOM   2883 H  HD13 . LEU   A 1 193 ? -11.229 6.843   -34.951 0   54.63  ? 883  LEU   A HD13 1 1 
ATOM   2884 H  HD21 . LEU   A 1 193 ? -10.779 4.939   -37.569 0   57.32  ? 883  LEU   A HD21 1 1 
ATOM   2885 H  HD22 . LEU   A 1 193 ? -9.899  6.462   -37.272 0   54.1   ? 883  LEU   A HD22 1 1 
ATOM   2886 H  HD23 . LEU   A 1 193 ? -9.002  4.929   -37.43  0   54.95  ? 883  LEU   A HD23 1 1 
ATOM   2887 N  N    . GLU   A 1 194 ? -7.735  3.307   -32.961 1   43.36  ? 884  GLU   A N    1 1 
ATOM   2888 C  CA   . GLU   A 1 194 ? -7.78   1.89    -32.57  1   43.83  ? 884  GLU   A CA   1 1 
ATOM   2889 C  C    . GLU   A 1 194 ? -8.122  1.706   -31.084 1   44.11  ? 884  GLU   A C    1 1 
ATOM   2890 O  O    . GLU   A 1 194 ? -8.717  0.697   -30.726 1   44.21  ? 884  GLU   A O    1 1 
ATOM   2891 C  CB   . GLU   A 1 194 ? -6.488  1.125   -32.953 1   45.91  ? 884  GLU   A CB   1 1 
ATOM   2892 C  CG   . GLU   A 1 194 ? -5.215  1.49    -32.195 1   49.99  ? 884  GLU   A CG   1 1 
ATOM   2893 C  CD   . GLU   A 1 194 ? -4.456  2.703   -32.697 1   54.76  ? 884  GLU   A CD   1 1 
ATOM   2894 O  OE1  . GLU   A 1 194 ? -3.332  2.937   -32.197 1   55.31  ? 884  GLU   A OE1  1 1 
ATOM   2895 O  OE2  . GLU   A 1 194 ? -4.971  3.415   -33.589 1   56.48  ? 884  GLU   A OE2  1 1 
ATOM   2896 H  H    . GLU   A 1 194 ? -6.824  3.634   -33.265 0   50.46  ? 884  GLU   A H    1 1 
ATOM   2897 H  HA   . GLU   A 1 194 ? -8.586  1.419   -33.133 0   56     ? 884  GLU   A HA   1 1 
ATOM   2898 H  HB2  . GLU   A 1 194 ? -6.666  0.068   -32.765 0   58.06  ? 884  GLU   A HB2  1 1 
ATOM   2899 H  HB3  . GLU   A 1 194 ? -6.304  1.265   -34.017 0   56.34  ? 884  GLU   A HB3  1 1 
ATOM   2900 H  HG2  . GLU   A 1 194 ? -5.442  1.667   -31.145 0   57.67  ? 884  GLU   A HG2  1 1 
ATOM   2901 H  HG3  . GLU   A 1 194 ? -4.534  0.643   -32.268 0   59.07  ? 884  GLU   A HG3  1 1 
ATOM   2902 N  N    . SER   A 1 195 ? -7.751  2.667   -30.225 1   44.08  ? 885  SER   A N    1 1 
ATOM   2903 C  CA   . SER   A 1 195 ? -8.088  2.61    -28.804 1   44.5   ? 885  SER   A CA   1 1 
ATOM   2904 C  C    . SER   A 1 195 ? -9.584  2.878   -28.588 1   44.85  ? 885  SER   A C    1 1 
ATOM   2905 O  O    . SER   A 1 195 ? -10.173 2.311   -27.674 1   45     ? 885  SER   A O    1 1 
ATOM   2906 C  CB   . SER   A 1 195 ? -7.264  3.625   -28.021 1   45.47  ? 885  SER   A CB   1 1 
ATOM   2907 O  OG   . SER   A 1 195 ? -5.878  3.34    -28.141 1   47.27  ? 885  SER   A OG   1 1 
ATOM   2908 H  H    . SER   A 1 195 ? -7.199  3.482   -30.47  0   50.62  ? 885  SER   A H    1 1 
ATOM   2909 H  HA   . SER   A 1 195 ? -7.856  1.621   -28.412 0   53.58  ? 885  SER   A HA   1 1 
ATOM   2910 H  HB2  . SER   A 1 195 ? -7.45   4.616   -28.432 0   50.31  ? 885  SER   A HB2  1 1 
ATOM   2911 H  HB3  . SER   A 1 195 ? -7.579  3.597   -26.979 0   51.23  ? 885  SER   A HB3  1 1 
ATOM   2912 H  HG   . SER   A 1 195 ? -5.461  3.113   -27.268 0   51.74  ? 885  SER   A HG   1 1 
ATOM   2913 N  N    . ILE   A 1 196 ? -10.201 3.732   -29.419 1   44.98  ? 886  ILE   A N    1 1 
ATOM   2914 C  CA   . ILE   A 1 196 ? -11.629 4.029   -29.304 1   45.54  ? 886  ILE   A CA   1 1 
ATOM   2915 C  C    . ILE   A 1 196 ? -12.432 2.828   -29.846 1   46.07  ? 886  ILE   A C    1 1 
ATOM   2916 O  O    . ILE   A 1 196 ? -13.372 2.373   -29.192 1   46.09  ? 886  ILE   A O    1 1 
ATOM   2917 C  CB   . ILE   A 1 196 ? -12.011 5.356   -30.046 1   46.1   ? 886  ILE   A CB   1 1 
ATOM   2918 C  CG1  . ILE   A 1 196 ? -11.257 6.59    -29.461 1   46.94  ? 886  ILE   A CG1  1 1 
ATOM   2919 C  CG2  . ILE   A 1 196 ? -13.537 5.576   -29.986 1   46.52  ? 886  ILE   A CG2  1 1 
ATOM   2920 C  CD1  . ILE   A 1 196 ? -11.133 7.8     -30.406 1   48     ? 886  ILE   A CD1  1 1 
ATOM   2921 H  H    . ILE   A 1 196 ? -9.747  4.218   -30.186 0   53.49  ? 886  ILE   A H    1 1 
ATOM   2922 H  HA   . ILE   A 1 196 ? -11.888 4.159   -28.255 0   56.83  ? 886  ILE   A HA   1 1 
ATOM   2923 H  HB   . ILE   A 1 196 ? -11.728 5.252   -31.093 0   56.77  ? 886  ILE   A HB   1 1 
ATOM   2924 H  HG12 . ILE   A 1 196 ? -11.786 6.93    -28.572 0   55.53  ? 886  ILE   A HG12 1 1 
ATOM   2925 H  HG13 . ILE   A 1 196 ? -10.239 6.304   -29.2   0   53.85  ? 886  ILE   A HG13 1 1 
ATOM   2926 H  HG21 . ILE   A 1 196 ? -13.779 6.603   -30.254 0   59.49  ? 886  ILE   A HG21 1 1 
ATOM   2927 H  HG22 . ILE   A 1 196 ? -14.031 4.906   -30.689 0   61.69  ? 886  ILE   A HG22 1 1 
ATOM   2928 H  HG23 . ILE   A 1 196 ? -13.881 5.369   -28.974 0   60     ? 886  ILE   A HG23 1 1 
ATOM   2929 H  HD11 . ILE   A 1 196 ? -10.492 8.545   -29.937 0   53.8   ? 886  ILE   A HD11 1 1 
ATOM   2930 H  HD12 . ILE   A 1 196 ? -10.695 7.474   -31.348 0   54.94  ? 886  ILE   A HD12 1 1 
ATOM   2931 H  HD13 . ILE   A 1 196 ? -12.12  8.225   -30.581 0   56.73  ? 886  ILE   A HD13 1 1 
ATOM   2932 N  N    . LEU   A 1 197 ? -12.042 2.295   -31.022 1   46.07  ? 887  LEU   A N    1 1 
ATOM   2933 C  CA   . LEU   A 1 197 ? -12.764 1.188   -31.655 1   46.61  ? 887  LEU   A CA   1 1 
ATOM   2934 C  C    . LEU   A 1 197 ? -12.555 -0.187  -31     1   47.09  ? 887  LEU   A C    1 1 
ATOM   2935 O  O    . LEU   A 1 197 ? -13.527 -0.927  -30.841 1   47.49  ? 887  LEU   A O    1 1 
ATOM   2936 C  CB   . LEU   A 1 197 ? -12.375 1.06    -33.148 1   46.67  ? 887  LEU   A CB   1 1 
ATOM   2937 C  CG   . LEU   A 1 197 ? -12.668 2.228   -34.094 1   47.98  ? 887  LEU   A CG   1 1 
ATOM   2938 C  CD1  . LEU   A 1 197 ? -11.998 1.999   -35.438 1   48.55  ? 887  LEU   A CD1  1 1 
ATOM   2939 C  CD2  . LEU   A 1 197 ? -14.165 2.435   -34.295 1   48.39  ? 887  LEU   A CD2  1 1 
ATOM   2940 H  H    . LEU   A 1 197 ? -11.225 2.599   -31.542 0   59.38  ? 887  LEU   A H    1 1 
ATOM   2941 H  HA   . LEU   A 1 197 ? -13.829 1.414   -31.604 0   65.99  ? 887  LEU   A HA   1 1 
ATOM   2942 H  HB2  . LEU   A 1 197 ? -11.303 0.872   -33.191 0   63.48  ? 887  LEU   A HB2  1 1 
ATOM   2943 H  HB3  . LEU   A 1 197 ? -12.897 0.192   -33.549 0   67.38  ? 887  LEU   A HB3  1 1 
ATOM   2944 H  HG   . LEU   A 1 197 ? -12.257 3.141   -33.667 0   63.15  ? 887  LEU   A HG   1 1 
ATOM   2945 H  HD11 . LEU   A 1 197 ? -12.195 2.853   -36.084 0   65.4   ? 887  LEU   A HD11 1 1 
ATOM   2946 H  HD12 . LEU   A 1 197 ? -10.924 1.892   -35.288 0   64.29  ? 887  LEU   A HD12 1 1 
ATOM   2947 H  HD13 . LEU   A 1 197 ? -12.404 1.093   -35.885 0   68.28  ? 887  LEU   A HD13 1 1 
ATOM   2948 H  HD21 . LEU   A 1 197 ? -14.321 3.152   -35.099 0   67.72  ? 887  LEU   A HD21 1 1 
ATOM   2949 H  HD22 . LEU   A 1 197 ? -14.624 1.481   -34.554 0   70.69  ? 887  LEU   A HD22 1 1 
ATOM   2950 H  HD23 . LEU   A 1 197 ? -14.605 2.822   -33.377 0   68.37  ? 887  LEU   A HD23 1 1 
ATOM   2951 N  N    . HIS   A 1 198 ? -11.294 -0.565  -30.707 1   47.03  ? 888  HIS   A N    1 1 
ATOM   2952 C  CA   . HIS   A 1 198 ? -10.958 -1.901  -30.203 1   47.42  ? 888  HIS   A CA   1 1 
ATOM   2953 C  C    . HIS   A 1 198 ? -10.343 -1.956  -28.791 1   47.51  ? 888  HIS   A C    1 1 
ATOM   2954 O  O    . HIS   A 1 198 ? -9.938  -3.041  -28.37  1   47.64  ? 888  HIS   A O    1 1 
ATOM   2955 C  CB   . HIS   A 1 198 ? -9.996  -2.589  -31.195 1   48.48  ? 888  HIS   A CB   1 1 
ATOM   2956 C  CG   . HIS   A 1 198 ? -10.417 -2.491  -32.632 1   51.06  ? 888  HIS   A CG   1 1 
ATOM   2957 N  ND1  . HIS   A 1 198 ? -11.428 -3.285  -33.145 1   52.96  ? 888  HIS   A ND1  1 1 
ATOM   2958 C  CD2  . HIS   A 1 198 ? -9.942  -1.698  -33.621 1   52.35  ? 888  HIS   A CD2  1 1 
ATOM   2959 C  CE1  . HIS   A 1 198 ? -11.539 -2.95   -34.421 1   53.5   ? 888  HIS   A CE1  1 1 
ATOM   2960 N  NE2  . HIS   A 1 198 ? -10.666 -1.998  -34.751 1   53.48  ? 888  HIS   A NE2  1 1 
ATOM   2961 H  H    . HIS   A 1 198 ? -10.484 0.038   -30.814 0   62.73  ? 888  HIS   A H    1 1 
ATOM   2962 H  HA   . HIS   A 1 198 ? -11.855 -2.518  -30.172 0   69.48  ? 888  HIS   A HA   1 1 
ATOM   2963 H  HB2  . HIS   A 1 198 ? -9.013  -2.127  -31.108 0   66.28  ? 888  HIS   A HB2  1 1 
ATOM   2964 H  HB3  . HIS   A 1 198 ? -9.93   -3.648  -30.95  0   70.38  ? 888  HIS   A HB3  1 1 
ATOM   2965 H  HD2  . HIS   A 1 198 ? -9.149  -0.974  -33.54  0   69.47  ? 888  HIS   A HD2  1 1 
ATOM   2966 H  HE1  . HIS   A 1 198 ? -12.243 -3.391  -35.107 0   80.98  ? 888  HIS   A HE1  1 1 
ATOM   2967 H  HE2  . HIS   A 1 198 ? -10.556 -1.572  -35.666 0   75     ? 888  HIS   A HE2  1 1 
ATOM   2968 N  N    . ARG   A 1 199 ? -10.281 -0.821  -28.061 1   47.02  ? 889  ARG   A N    1 1 
ATOM   2969 C  CA   . ARG   A 1 199 ? -9.697  -0.733  -26.71  1   47.02  ? 889  ARG   A CA   1 1 
ATOM   2970 C  C    . ARG   A 1 199 ? -8.242  -1.234  -26.643 1   46.21  ? 889  ARG   A C    1 1 
ATOM   2971 O  O    . ARG   A 1 199 ? -7.824  -1.761  -25.614 1   46.31  ? 889  ARG   A O    1 1 
ATOM   2972 C  CB   . ARG   A 1 199 ? -10.575 -1.457  -25.669 1   48.61  ? 889  ARG   A CB   1 1 
ATOM   2973 C  CG   . ARG   A 1 199 ? -12.055 -1.119  -25.794 1   51.44  ? 889  ARG   A CG   1 1 
ATOM   2974 C  CD   . ARG   A 1 199 ? -12.814 -1.307  -24.5   1   54.39  ? 889  ARG   A CD   1 1 
ATOM   2975 N  NE   . ARG   A 1 199 ? -14.242 -1.038  -24.7   1   57.57  ? 889  ARG   A NE   1 1 
ATOM   2976 C  CZ   . ARG   A 1 199 ? -15.267 -1.705  -24.164 1   59.67  ? 889  ARG   A CZ   1 1 
ATOM   2977 N  NH1  . ARG   A 1 199 ? -15.054 -2.739  -23.351 1   59.4   ? 889  ARG   A NH1  1 1 
ATOM   2978 N  NH2  . ARG   A 1 199 ? -16.516 -1.345  -24.438 1   59.44  ? 889  ARG   A NH2  1 1 
ATOM   2979 H  H    . ARG   A 1 199 ? -10.641 0.075   -28.371 0   61.81  ? 889  ARG   A H    1 1 
ATOM   2980 H  HA   . ARG   A 1 199 ? -9.677  0.317   -26.424 0   59.75  ? 889  ARG   A HA   1 1 
ATOM   2981 H  HB2  . ARG   A 1 199 ? -10.465 -2.532  -25.801 0   67.23  ? 889  ARG   A HB2  1 1 
ATOM   2982 H  HB3  . ARG   A 1 199 ? -10.248 -1.17   -24.671 0   64.47  ? 889  ARG   A HB3  1 1 
ATOM   2983 H  HG2  . ARG   A 1 199 ? -12.167 -0.082  -26.109 0   69     ? 889  ARG   A HG2  1 1 
ATOM   2984 H  HG3  . ARG   A 1 199 ? -12.498 -1.78   -26.538 0   72.53  ? 889  ARG   A HG3  1 1 
ATOM   2985 H  HD2  . ARG   A 1 199 ? -12.619 -2.324  -24.168 0   75.17  ? 889  ARG   A HD2  1 1 
ATOM   2986 H  HD3  . ARG   A 1 199 ? -12.439 -0.593  -23.768 0   71.79  ? 889  ARG   A HD3  1 1 
ATOM   2987 H  HE   . ARG   A 1 199 ? -14.468 -0.259  -25.311 0   78.78  ? 889  ARG   A HE   1 1 
ATOM   2988 H  HH11 . ARG   A 1 199 ? -14.14  -3.082  -23.077 0   84.15  ? 889  ARG   A HH11 1 1 
ATOM   2989 H  HH12 . ARG   A 1 199 ? -15.86  -3.222  -22.969 0   87.96  ? 889  ARG   A HH12 1 1 
ATOM   2990 H  HH21 . ARG   A 1 199 ? -16.695 -0.562  -25.059 0   85.43  ? 889  ARG   A HH21 1 1 
ATOM   2991 H  HH22 . ARG   A 1 199 ? -17.3   -1.851  -24.038 0   88.78  ? 889  ARG   A HH22 1 1 
ATOM   2992 N  N    . ILE   A 1 200 ? -7.474  -1.044  -27.726 1   45.3   ? 890  ILE   A N    1 1 
ATOM   2993 C  CA   . ILE   A 1 200 ? -6.082  -1.482  -27.817 1   44.98  ? 890  ILE   A CA   1 1 
ATOM   2994 C  C    . ILE   A 1 200 ? -5.175  -0.286  -27.5   1   44.16  ? 890  ILE   A C    1 1 
ATOM   2995 O  O    . ILE   A 1 200 ? -5.359  0.786   -28.074 1   44.41  ? 890  ILE   A O    1 1 
ATOM   2996 C  CB   . ILE   A 1 200 ? -5.819  -2.108  -29.225 1   45.79  ? 890  ILE   A CB   1 1 
ATOM   2997 C  CG1  . ILE   A 1 200 ? -6.595  -3.451  -29.344 1   47.03  ? 890  ILE   A CG1  1 1 
ATOM   2998 C  CG2  . ILE   A 1 200 ? -4.312  -2.306  -29.488 1   46.31  ? 890  ILE   A CG2  1 1 
ATOM   2999 C  CD1  . ILE   A 1 200 ? -6.562  -4.165  -30.71  1   48.59  ? 890  ILE   A CD1  1 1 
ATOM   3000 H  H    . ILE   A 1 200 ? -7.787  -0.564  -28.563 0   57.9   ? 890  ILE   A H    1 1 
ATOM   3001 H  HA   . ILE   A 1 200 ? -5.887  -2.258  -27.079 0   57.99  ? 890  ILE   A HA   1 1 
ATOM   3002 H  HB   . ILE   A 1 200 ? -6.193  -1.433  -29.994 0   58.63  ? 890  ILE   A HB   1 1 
ATOM   3003 H  HG12 . ILE   A 1 200 ? -6.186  -4.144  -28.61  0   64.72  ? 890  ILE   A HG12 1 1 
ATOM   3004 H  HG13 . ILE   A 1 200 ? -7.645  -3.271  -29.117 0   64.5   ? 890  ILE   A HG13 1 1 
ATOM   3005 H  HG21 . ILE   A 1 200 ? -4.156  -2.654  -30.508 0   60.48  ? 890  ILE   A HG21 1 1 
ATOM   3006 H  HG22 . ILE   A 1 200 ? -3.778  -1.365  -29.369 0   57.08  ? 890  ILE   A HG22 1 1 
ATOM   3007 H  HG23 . ILE   A 1 200 ? -3.929  -3.044  -28.786 0   59.96  ? 890  ILE   A HG23 1 1 
ATOM   3008 H  HD11 . ILE   A 1 200 ? -7.408  -4.848  -30.769 0   70     ? 890  ILE   A HD11 1 1 
ATOM   3009 H  HD12 . ILE   A 1 200 ? -6.623  -3.425  -31.506 0   66.69  ? 890  ILE   A HD12 1 1 
ATOM   3010 H  HD13 . ILE   A 1 200 ? -5.635  -4.731  -30.795 0   67.11  ? 890  ILE   A HD13 1 1 
ATOM   3011 N  N    . TYR   A 1 201 ? -4.209  -0.472  -26.577 1   42.9   ? 891  TYR   A N    1 1 
ATOM   3012 C  CA   . TYR   A 1 201 ? -3.283  0.575   -26.149 1   42.06  ? 891  TYR   A CA   1 1 
ATOM   3013 C  C    . TYR   A 1 201 ? -1.836  0.12    -26.288 1   41.16  ? 891  TYR   A C    1 1 
ATOM   3014 O  O    . TYR   A 1 201 ? -1.427  -0.847  -25.648 1   41.39  ? 891  TYR   A O    1 1 
ATOM   3015 C  CB   . TYR   A 1 201 ? -3.551  0.948   -24.692 1   41.91  ? 891  TYR   A CB   1 1 
ATOM   3016 C  CG   . TYR   A 1 201 ? -4.896  1.603   -24.491 1   42.51  ? 891  TYR   A CG   1 1 
ATOM   3017 C  CD1  . TYR   A 1 201 ? -6.01   0.853   -24.147 1   43.45  ? 891  TYR   A CD1  1 1 
ATOM   3018 C  CD2  . TYR   A 1 201 ? -5.05   2.974   -24.627 1   43.22  ? 891  TYR   A CD2  1 1 
ATOM   3019 C  CE1  . TYR   A 1 201 ? -7.25   1.448   -23.966 1   44.25  ? 891  TYR   A CE1  1 1 
ATOM   3020 C  CE2  . TYR   A 1 201 ? -6.284  3.583   -24.436 1   44.06  ? 891  TYR   A CE2  1 1 
ATOM   3021 C  CZ   . TYR   A 1 201 ? -7.382  2.815   -24.097 1   45     ? 891  TYR   A CZ   1 1 
ATOM   3022 O  OH   . TYR   A 1 201 ? -8.614  3.387   -23.901 1   46.43  ? 891  TYR   A OH   1 1 
ATOM   3023 H  H    . TYR   A 1 201 ? -4.044  -1.353  -26.1   0   52.59  ? 891  TYR   A H    1 1 
ATOM   3024 H  HA   . TYR   A 1 201 ? -3.424  1.474   -26.747 0   47.11  ? 891  TYR   A HA   1 1 
ATOM   3025 H  HB2  . TYR   A 1 201 ? -3.529  0.041   -24.089 0   48.33  ? 891  TYR   A HB2  1 1 
ATOM   3026 H  HB3  . TYR   A 1 201 ? -2.782  1.64    -24.353 0   45.71  ? 891  TYR   A HB3  1 1 
ATOM   3027 H  HD1  . TYR   A 1 201 ? -5.914  -0.214  -24.037 0   52.15  ? 891  TYR   A HD1  1 1 
ATOM   3028 H  HD2  . TYR   A 1 201 ? -4.198  3.578   -24.887 0   45.59  ? 891  TYR   A HD2  1 1 
ATOM   3029 H  HE1  . TYR   A 1 201 ? -8.102  0.846   -23.698 0   53.69  ? 891  TYR   A HE1  1 1 
ATOM   3030 H  HE2  . TYR   A 1 201 ? -6.373  4.65    -24.548 0   47.13  ? 891  TYR   A HE2  1 1 
ATOM   3031 H  HH   . TYR   A 1 201 ? -8.561  4.375   -23.976 0   52.16  ? 891  TYR   A HH   1 1 
ATOM   3032 N  N    . THR   A 1 202 ? -1.071  0.816   -27.134 1   40.05  ? 892  THR   A N    1 1 
ATOM   3033 C  CA   . THR   A 1 202 ? 0.346   0.552   -27.391 1   39.35  ? 892  THR   A CA   1 1 
ATOM   3034 C  C    . THR   A 1 202 ? 1.155   1.859   -27.174 1   38.39  ? 892  THR   A C    1 1 
ATOM   3035 O  O    . THR   A 1 202 ? 0.561   2.915   -26.94  1   38.4   ? 892  THR   A O    1 1 
ATOM   3036 C  CB   . THR   A 1 202 ? 0.49    0.049   -28.853 1   40.74  ? 892  THR   A CB   1 1 
ATOM   3037 O  OG1  . THR   A 1 202 ? 0.01    1.064   -29.738 1   42.06  ? 892  THR   A OG1  1 1 
ATOM   3038 C  CG2  . THR   A 1 202 ? -0.259  -1.244  -29.107 1   40.9   ? 892  THR   A CG2  1 1 
ATOM   3039 H  H    . THR   A 1 202 ? -1.419  1.581   -27.703 0   44.02  ? 892  THR   A H    1 1 
ATOM   3040 H  HA   . THR   A 1 202 ? 0.737   -0.211  -26.72  0   45.36  ? 892  THR   A HA   1 1 
ATOM   3041 H  HB   . THR   A 1 202 ? 1.544   -0.127  -29.063 0   47.57  ? 892  THR   A HB   1 1 
ATOM   3042 H  HG1  . THR   A 1 202 ? 0.213   0.824   -30.68  0   48.04  ? 892  THR   A HG1  1 1 
ATOM   3043 H  HG21 . THR   A 1 202 ? -0.04   -1.604  -30.111 0   50.74  ? 892  THR   A HG21 1 1 
ATOM   3044 H  HG22 . THR   A 1 202 ? 0.05    -1.996  -28.384 0   50.83  ? 892  THR   A HG22 1 1 
ATOM   3045 H  HG23 . THR   A 1 202 ? -1.333  -1.086  -29.018 0   49.62  ? 892  THR   A HG23 1 1 
ATOM   3046 N  N    . HIS   A 1 203 ? 2.5     1.803   -27.27  1   37.15  ? 893  HIS   A N    1 1 
ATOM   3047 C  CA   . HIS   A 1 203 ? 3.319   3.015   -27.2   1   36.35  ? 893  HIS   A CA   1 1 
ATOM   3048 C  C    . HIS   A 1 203 ? 2.983   3.945   -28.394 1   35.16  ? 893  HIS   A C    1 1 
ATOM   3049 O  O    . HIS   A 1 203 ? 3.117   5.157   -28.261 1   35.3   ? 893  HIS   A O    1 1 
ATOM   3050 C  CB   . HIS   A 1 203 ? 4.82    2.678   -27.197 1   37.2   ? 893  HIS   A CB   1 1 
ATOM   3051 C  CG   . HIS   A 1 203 ? 5.251   1.844   -26.03  1   39.43  ? 893  HIS   A CG   1 1 
ATOM   3052 N  ND1  . HIS   A 1 203 ? 5.095   2.285   -24.729 1   41.38  ? 893  HIS   A ND1  1 1 
ATOM   3053 C  CD2  . HIS   A 1 203 ? 5.829   0.623   -26.009 1   40.4   ? 893  HIS   A CD2  1 1 
ATOM   3054 C  CE1  . HIS   A 1 203 ? 5.568   1.319   -23.959 1   41.8   ? 893  HIS   A CE1  1 1 
ATOM   3055 N  NE2  . HIS   A 1 203 ? 6.022   0.298   -24.685 1   41.57  ? 893  HIS   A NE2  1 1 
ATOM   3056 H  H    . HIS   A 1 203 ? 3.028   0.947   -27.405 0   41.68  ? 893  HIS   A H    1 1 
ATOM   3057 H  HA   . HIS   A 1 203 ? 3.093   3.55    -26.279 0   37.07  ? 893  HIS   A HA   1 1 
ATOM   3058 H  HB2  . HIS   A 1 203 ? 5.058   2.126   -28.105 0   40.83  ? 893  HIS   A HB2  1 1 
ATOM   3059 H  HB3  . HIS   A 1 203 ? 5.39    3.606   -27.17  0   38.82  ? 893  HIS   A HB3  1 1 
ATOM   3060 H  HD1  . HIS   A 1 203 ? 4.704   3.17    -24.424 0   42.65  ? 893  HIS   A HD1  1 1 
ATOM   3061 H  HD2  . HIS   A 1 203 ? 6.092   0.021   -26.863 0   47.33  ? 893  HIS   A HD2  1 1 
ATOM   3062 H  HE1  . HIS   A 1 203 ? 5.583   1.354   -22.882 0   45.56  ? 893  HIS   A HE1  1 1 
ATOM   3063 N  N    . GLN   A 1 204 ? 2.516   3.391   -29.539 1   33.98  ? 894  GLN   A N    1 1 
ATOM   3064 C  CA   . GLN   A 1 204 ? 2.124   4.184   -30.705 1   33.26  ? 894  GLN   A CA   1 1 
ATOM   3065 C  C    . GLN   A 1 204 ? 0.777   4.89    -30.508 1   32.27  ? 894  GLN   A C    1 1 
ATOM   3066 O  O    . GLN   A 1 204 ? 0.543   5.92    -31.135 1   32.34  ? 894  GLN   A O    1 1 
ATOM   3067 C  CB   . GLN   A 1 204 ? 2.141   3.329   -31.984 1   34.38  ? 894  GLN   A CB   1 1 
ATOM   3068 C  CG   . GLN   A 1 204 ? 3.542   2.832   -32.373 1   36.68  ? 894  GLN   A CG   1 1 
ATOM   3069 C  CD   . GLN   A 1 204 ? 4.539   3.957   -32.562 1   39.79  ? 894  GLN   A CD   1 1 
ATOM   3070 O  OE1  . GLN   A 1 204 ? 5.364   4.237   -31.687 1   40.82  ? 894  GLN   A OE1  1 1 
ATOM   3071 N  NE2  . GLN   A 1 204 ? 4.473   4.642   -33.695 1   40.06  ? 894  GLN   A NE2  1 1 
ATOM   3072 H  H    . GLN   A 1 204 ? 2.395   2.393   -29.681 0   37.17  ? 894  GLN   A H    1 1 
ATOM   3073 H  HA   . GLN   A 1 204 ? 2.851   4.984   -30.832 0   33.73  ? 894  GLN   A HA   1 1 
ATOM   3074 H  HB2  . GLN   A 1 204 ? 1.502   2.459   -31.844 0   38.36  ? 894  GLN   A HB2  1 1 
ATOM   3075 H  HB3  . GLN   A 1 204 ? 1.764   3.932   -32.809 0   36.88  ? 894  GLN   A HB3  1 1 
ATOM   3076 H  HG2  . GLN   A 1 204 ? 3.919   2.176   -31.59  0   41.38  ? 894  GLN   A HG2  1 1 
ATOM   3077 H  HG3  . GLN   A 1 204 ? 3.473   2.286   -33.313 0   41.99  ? 894  GLN   A HG3  1 1 
ATOM   3078 H  HE21 . GLN   A 1 204 ? 3.786   4.4     -34.401 0   43.13  ? 894  GLN   A HE21 1 1 
ATOM   3079 H  HE22 . GLN   A 1 204 ? 5.122   5.404   -33.862 0   42.12  ? 894  GLN   A HE22 1 1 
ATOM   3080 N  N    . SER   A 1 205 ? -0.09   4.375   -29.628 1   31.29  ? 895  SER   A N    1 1 
ATOM   3081 C  CA   . SER   A 1 205 ? -1.33   5.053   -29.263 1   30.82  ? 895  SER   A CA   1 1 
ATOM   3082 C  C    . SER   A 1 205 ? -0.979  6.28    -28.379 1   29.93  ? 895  SER   A C    1 1 
ATOM   3083 O  O    . SER   A 1 205 ? -1.639  7.312   -28.49  1   29.94  ? 895  SER   A O    1 1 
ATOM   3084 C  CB   . SER   A 1 205 ? -2.275  4.097   -28.54  1   32.37  ? 895  SER   A CB   1 1 
ATOM   3085 O  OG   . SER   A 1 205 ? -1.804  3.691   -27.264 1   35.11  ? 895  SER   A OG   1 1 
ATOM   3086 H  H    . SER   A 1 205 ? 0.014   3.478   -29.164 0   32.9   ? 895  SER   A H    1 1 
ATOM   3087 H  HA   . SER   A 1 205 ? -1.835  5.409   -30.16  0   31.12  ? 895  SER   A HA   1 1 
ATOM   3088 H  HB2  . SER   A 1 205 ? -3.236  4.594   -28.412 0   33.73  ? 895  SER   A HB2  1 1 
ATOM   3089 H  HB3  . SER   A 1 205 ? -2.405  3.21    -29.159 0   35.13  ? 895  SER   A HB3  1 1 
ATOM   3090 H  HG   . SER   A 1 205 ? -0.843  3.444   -27.282 0   35.98  ? 895  SER   A HG   1 1 
ATOM   3091 N  N    . ASP   A 1 206 ? 0.077   6.179   -27.532 1   28.94  ? 896  ASP   A N    1 1 
ATOM   3092 C  CA   . ASP   A 1 206 ? 0.593   7.299   -26.733 1   28.61  ? 896  ASP   A CA   1 1 
ATOM   3093 C  C    . ASP   A 1 206 ? 1.171   8.408   -27.629 1   28.01  ? 896  ASP   A C    1 1 
ATOM   3094 O  O    . ASP   A 1 206 ? 1.167   9.569   -27.225 1   28.05  ? 896  ASP   A O    1 1 
ATOM   3095 C  CB   . ASP   A 1 206 ? 1.702   6.835   -25.772 1   29.9   ? 896  ASP   A CB   1 1 
ATOM   3096 C  CG   . ASP   A 1 206 ? 1.232   6.183   -24.49  1   33.72  ? 896  ASP   A CG   1 1 
ATOM   3097 O  OD1  . ASP   A 1 206 ? 0.023   6.277   -24.181 1   34.23  ? 896  ASP   A OD1  1 1 
ATOM   3098 O  OD2  . ASP   A 1 206 ? 2.078   5.598   -23.78  1   35.49  ? 896  ASP   A OD2  1 1 
ATOM   3099 H  H    . ASP   A 1 206 ? 0.575   5.312   -27.358 0   27.92  ? 896  ASP   A H    1 1 
ATOM   3100 H  HA   . ASP   A 1 206 ? -0.222  7.741   -26.161 0   25.51  ? 896  ASP   A HA   1 1 
ATOM   3101 H  HB2  . ASP   A 1 206 ? 2.355   6.13    -26.284 0   27.87  ? 896  ASP   A HB2  1 1 
ATOM   3102 H  HB3  . ASP   A 1 206 ? 2.282   7.713   -25.492 0   26.53  ? 896  ASP   A HB3  1 1 
ATOM   3103 N  N    . VAL   A 1 207 ? 1.684   8.05    -28.823 1   27.43  ? 897  VAL   A N    1 1 
ATOM   3104 C  CA   . VAL   A 1 207 ? 2.213   9.001   -29.802 1   27.39  ? 897  VAL   A CA   1 1 
ATOM   3105 C  C    . VAL   A 1 207 ? 1.053   9.872   -30.323 1   27.4   ? 897  VAL   A C    1 1 
ATOM   3106 O  O    . VAL   A 1 207 ? 1.235   11.08   -30.474 1   27.71  ? 897  VAL   A O    1 1 
ATOM   3107 C  CB   . VAL   A 1 207 ? 2.988   8.277   -30.944 1   28     ? 897  VAL   A CB   1 1 
ATOM   3108 C  CG1  . VAL   A 1 207 ? 3.321   9.236   -32.086 1   28.5   ? 897  VAL   A CG1  1 1 
ATOM   3109 C  CG2  . VAL   A 1 207 ? 4.26    7.619   -30.406 1   28.33  ? 897  VAL   A CG2  1 1 
ATOM   3110 H  H    . VAL   A 1 207 ? 1.733   7.088   -29.143 0   25.18  ? 897  VAL   A H    1 1 
ATOM   3111 H  HA   . VAL   A 1 207 ? 2.912   9.666   -29.297 0   23.53  ? 897  VAL   A HA   1 1 
ATOM   3112 H  HB   . VAL   A 1 207 ? 2.358   7.491   -31.356 0   26.12  ? 897  VAL   A HB   1 1 
ATOM   3113 H  HG11 . VAL   A 1 207 ? 4.106   8.808   -32.708 0   26.56  ? 897  VAL   A HG11 1 1 
ATOM   3114 H  HG12 . VAL   A 1 207 ? 2.432   9.387   -32.696 0   25.48  ? 897  VAL   A HG12 1 1 
ATOM   3115 H  HG13 . VAL   A 1 207 ? 3.652   10.186  -31.668 0   25.3   ? 897  VAL   A HG13 1 1 
ATOM   3116 H  HG21 . VAL   A 1 207 ? 4.792   7.143   -31.228 0   27.37  ? 897  VAL   A HG21 1 1 
ATOM   3117 H  HG22 . VAL   A 1 207 ? 4.888   8.381   -29.947 0   26.01  ? 897  VAL   A HG22 1 1 
ATOM   3118 H  HG23 . VAL   A 1 207 ? 3.987   6.867   -29.666 0   26.77  ? 897  VAL   A HG23 1 1 
ATOM   3119 N  N    . TRP   A 1 208 ? -0.156  9.292   -30.52  1   26.97  ? 898  TRP   A N    1 1 
ATOM   3120 C  CA   . TRP   A 1 208 ? -1.351  10.051  -30.913 1   27.01  ? 898  TRP   A CA   1 1 
ATOM   3121 C  C    . TRP   A 1 208 ? -1.665  11.09   -29.829 1   27.02  ? 898  TRP   A C    1 1 
ATOM   3122 O  O    . TRP   A 1 208 ? -1.872  12.256  -30.156 1   27.42  ? 898  TRP   A O    1 1 
ATOM   3123 C  CB   . TRP   A 1 208 ? -2.563  9.113   -31.119 1   26.72  ? 898  TRP   A CB   1 1 
ATOM   3124 C  CG   . TRP   A 1 208 ? -3.794  9.789   -31.66  1   26.91  ? 898  TRP   A CG   1 1 
ATOM   3125 C  CD1  . TRP   A 1 208 ? -4.561  10.724  -31.03  1   27.58  ? 898  TRP   A CD1  1 1 
ATOM   3126 C  CD2  . TRP   A 1 208 ? -4.466  9.484   -32.889 1   26.92  ? 898  TRP   A CD2  1 1 
ATOM   3127 N  NE1  . TRP   A 1 208 ? -5.629  11.07   -31.82  1   27.74  ? 898  TRP   A NE1  1 1 
ATOM   3128 C  CE2  . TRP   A 1 208 ? -5.611  10.303  -32.954 1   27.53  ? 898  TRP   A CE2  1 1 
ATOM   3129 C  CE3  . TRP   A 1 208 ? -4.262  8.536   -33.898 1   27.52  ? 898  TRP   A CE3  1 1 
ATOM   3130 C  CZ2  . TRP   A 1 208 ? -6.473  10.288  -34.046 1   28.18  ? 898  TRP   A CZ2  1 1 
ATOM   3131 C  CZ3  . TRP   A 1 208 ? -5.127  8.514   -34.973 1   28.32  ? 898  TRP   A CZ3  1 1 
ATOM   3132 C  CH2  . TRP   A 1 208 ? -6.221  9.378   -35.037 1   28.38  ? 898  TRP   A CH2  1 1 
ATOM   3133 H  H    . TRP   A 1 208 ? -0.334  8.296   -30.434 0   24.33  ? 898  TRP   A H    1 1 
ATOM   3134 H  HA   . TRP   A 1 208 ? -1.156  10.576  -31.847 0   23.65  ? 898  TRP   A HA   1 1 
ATOM   3135 H  HB2  . TRP   A 1 208 ? -2.273  8.323   -31.81  0   25.15  ? 898  TRP   A HB2  1 1 
ATOM   3136 H  HB3  . TRP   A 1 208 ? -2.826  8.675   -30.157 0   24.69  ? 898  TRP   A HB3  1 1 
ATOM   3137 H  HD1  . TRP   A 1 208 ? -4.305  11.204  -30.1   0   25.19  ? 898  TRP   A HD1  1 1 
ATOM   3138 H  HE1  . TRP   A 1 208 ? -6.331  11.807  -31.601 0   27.12  ? 898  TRP   A HE1  1 1 
ATOM   3139 H  HE3  . TRP   A 1 208 ? -3.395  7.897   -33.881 0   27.7   ? 898  TRP   A HE3  1 1 
ATOM   3140 H  HZ2  . TRP   A 1 208 ? -7.341  10.925  -34.08  0   29.62  ? 898  TRP   A HZ2  1 1 
ATOM   3141 H  HZ3  . TRP   A 1 208 ? -4.94   7.837   -35.79  0   30.45  ? 898  TRP   A HZ3  1 1 
ATOM   3142 H  HH2  . TRP   A 1 208 ? -6.881  9.329   -35.887 0   31.05  ? 898  TRP   A HH2  1 1 
ATOM   3143 N  N    . SER   A 1 209 ? -1.662  10.677  -28.548 1   26.53  ? 899  SER   A N    1 1 
ATOM   3144 C  CA   . SER   A 1 209 ? -1.897  11.577  -27.42  1   26.6   ? 899  SER   A CA   1 1 
ATOM   3145 C  C    . SER   A 1 209 ? -0.827  12.662  -27.344 1   26.48  ? 899  SER   A C    1 1 
ATOM   3146 O  O    . SER   A 1 209 ? -1.148  13.799  -27.014 1   26.75  ? 899  SER   A O    1 1 
ATOM   3147 C  CB   . SER   A 1 209 ? -1.923  10.799  -26.112 1   27.97  ? 899  SER   A CB   1 1 
ATOM   3148 O  OG   . SER   A 1 209 ? -3.016  9.898   -26.079 1   30.58  ? 899  SER   A OG   1 1 
ATOM   3149 H  H    . SER   A 1 209 ? -1.515  9.713   -28.265 0   22.87  ? 899  SER   A H    1 1 
ATOM   3150 H  HA   . SER   A 1 209 ? -2.865  12.061  -27.546 0   22.65  ? 899  SER   A HA   1 1 
ATOM   3151 H  HB2  . SER   A 1 209 ? -0.995  10.237  -26.011 0   23.65  ? 899  SER   A HB2  1 1 
ATOM   3152 H  HB3  . SER   A 1 209 ? -2.022  11.502  -25.287 0   23.64  ? 899  SER   A HB3  1 1 
ATOM   3153 H  HG   . SER   A 1 209 ? -3.058  9.447   -25.195 0   27.5   ? 899  SER   A HG   1 1 
ATOM   3154 N  N    . TYR   A 1 210 ? 0.439   12.321  -27.656 1   25.93  ? 900  TYR   A N    1 1 
ATOM   3155 C  CA   . TYR   A 1 210 ? 1.547   13.274  -27.705 1   25.68  ? 900  TYR   A CA   1 1 
ATOM   3156 C  C    . TYR   A 1 210 ? 1.241   14.365  -28.737 1   26.14  ? 900  TYR   A C    1 1 
ATOM   3157 O  O    . TYR   A 1 210 ? 1.44    15.539  -28.444 1   26.41  ? 900  TYR   A O    1 1 
ATOM   3158 C  CB   . TYR   A 1 210 ? 2.869   12.552  -28.045 1   25.17  ? 900  TYR   A CB   1 1 
ATOM   3159 C  CG   . TYR   A 1 210 ? 4.046   13.485  -28.222 1   25.09  ? 900  TYR   A CG   1 1 
ATOM   3160 C  CD1  . TYR   A 1 210 ? 4.396   13.964  -29.476 1   25.71  ? 900  TYR   A CD1  1 1 
ATOM   3161 C  CD2  . TYR   A 1 210 ? 4.799   13.899  -27.136 1   25.47  ? 900  TYR   A CD2  1 1 
ATOM   3162 C  CE1  . TYR   A 1 210 ? 5.457   14.841  -29.643 1   26.34  ? 900  TYR   A CE1  1 1 
ATOM   3163 C  CE2  . TYR   A 1 210 ? 5.858   14.782  -27.287 1   26.19  ? 900  TYR   A CE2  1 1 
ATOM   3164 C  CZ   . TYR   A 1 210 ? 6.192   15.245  -28.546 1   27     ? 900  TYR   A CZ   1 1 
ATOM   3165 O  OH   . TYR   A 1 210 ? 7.246   16.107  -28.73  1   28.1   ? 900  TYR   A OH   1 1 
ATOM   3166 H  H    . TYR   A 1 210 ? 0.734   11.372  -27.858 0   21.02  ? 900  TYR   A H    1 1 
ATOM   3167 H  HA   . TYR   A 1 210 ? 1.657   13.748  -26.73  0   20.26  ? 900  TYR   A HA   1 1 
ATOM   3168 H  HB2  . TYR   A 1 210 ? 3.111   11.863  -27.237 0   20.15  ? 900  TYR   A HB2  1 1 
ATOM   3169 H  HB3  . TYR   A 1 210 ? 2.741   12.001  -28.975 0   20.26  ? 900  TYR   A HB3  1 1 
ATOM   3170 H  HD1  . TYR   A 1 210 ? 3.822   13.66   -30.335 0   20.95  ? 900  TYR   A HD1  1 1 
ATOM   3171 H  HD2  . TYR   A 1 210 ? 4.535   13.542  -26.156 0   20.55  ? 900  TYR   A HD2  1 1 
ATOM   3172 H  HE1  . TYR   A 1 210 ? 5.712   15.2    -30.626 0   22.35  ? 900  TYR   A HE1  1 1 
ATOM   3173 H  HE2  . TYR   A 1 210 ? 6.426   15.084  -26.423 0   22.24  ? 900  TYR   A HE2  1 1 
ATOM   3174 H  HH   . TYR   A 1 210 ? 7.783   16.191  -27.9   0   25.31  ? 900  TYR   A HH   1 1 
ATOM   3175 N  N    . GLY   A 1 211 ? 0.734   13.976  -29.904 1   26.08  ? 901  GLY   A N    1 1 
ATOM   3176 C  CA   . GLY   A 1 211 ? 0.342   14.917  -30.944 1   26.77  ? 901  GLY   A CA   1 1 
ATOM   3177 C  C    . GLY   A 1 211 ? -0.75   15.865  -30.488 1   27.52  ? 901  GLY   A C    1 1 
ATOM   3178 O  O    . GLY   A 1 211 ? -0.681  17.063  -30.774 1   28.05  ? 901  GLY   A O    1 1 
ATOM   3179 H  H    . GLY   A 1 211 ? 0.594   13.008  -30.176 0   21.11  ? 901  GLY   A H    1 1 
ATOM   3180 H  HA2  . GLY   A 1 211 ? 1.207   15.506  -31.243 0   21.86  ? 901  GLY   A HA2  1 1 
ATOM   3181 H  HA3  . GLY   A 1 211 ? -0.019  14.368  -31.812 0   22.08  ? 901  GLY   A HA3  1 1 
ATOM   3182 N  N    . VAL   A 1 212 ? -1.754  15.348  -29.747 1   27.36  ? 902  VAL   A N    1 1 
ATOM   3183 C  CA   . VAL   A 1 212 ? -2.85   16.164  -29.215 1   27.82  ? 902  VAL   A CA   1 1 
ATOM   3184 C  C    . VAL   A 1 212 ? -2.297  17.124  -28.146 1   28.31  ? 902  VAL   A C    1 1 
ATOM   3185 O  O    . VAL   A 1 212 ? -2.667  18.297  -28.139 1   28.78  ? 902  VAL   A O    1 1 
ATOM   3186 C  CB   . VAL   A 1 212 ? -4.033  15.298  -28.691 1   28.51  ? 902  VAL   A CB   1 1 
ATOM   3187 C  CG1  . VAL   A 1 212 ? -5.098  16.163  -28.012 1   28.95  ? 902  VAL   A CG1  1 1 
ATOM   3188 C  CG2  . VAL   A 1 212 ? -4.652  14.477  -29.826 1   28.94  ? 902  VAL   A CG2  1 1 
ATOM   3189 H  H    . VAL   A 1 212 ? -1.811  14.369  -29.484 0   22.84  ? 902  VAL   A H    1 1 
ATOM   3190 H  HA   . VAL   A 1 212 ? -3.244  16.778  -30.024 0   24.44  ? 902  VAL   A HA   1 1 
ATOM   3191 H  HB   . VAL   A 1 212 ? -3.651  14.599  -27.948 0   24.87  ? 902  VAL   A HB   1 1 
ATOM   3192 H  HG11 . VAL   A 1 212 ? -6.021  15.595  -27.91  0   27.24  ? 902  VAL   A HG11 1 1 
ATOM   3193 H  HG12 . VAL   A 1 212 ? -4.751  16.449  -27.02  0   26.47  ? 902  VAL   A HG12 1 1 
ATOM   3194 H  HG13 . VAL   A 1 212 ? -5.273  17.052  -28.617 0   27.2   ? 902  VAL   A HG13 1 1 
ATOM   3195 H  HG21 . VAL   A 1 212 ? -5.551  13.978  -29.47  0   26.79  ? 902  VAL   A HG21 1 1 
ATOM   3196 H  HG22 . VAL   A 1 212 ? -4.899  15.144  -30.65  0   26.57  ? 902  VAL   A HG22 1 1 
ATOM   3197 H  HG23 . VAL   A 1 212 ? -3.931  13.731  -30.157 0   25.67  ? 902  VAL   A HG23 1 1 
ATOM   3198 N  N    . THR   A 1 213 ? -1.368  16.654  -27.297 1   28.1   ? 903  THR   A N    1 1 
ATOM   3199 C  CA   . THR   A 1 213 ? -0.712  17.484  -26.276 1   28.4   ? 903  THR   A CA   1 1 
ATOM   3200 C  C    . THR   A 1 213 ? 0.101   18.609  -26.933 1   29.04  ? 903  THR   A C    1 1 
ATOM   3201 O  O    . THR   A 1 213 ? 0.052   19.74   -26.458 1   29.27  ? 903  THR   A O    1 1 
ATOM   3202 C  CB   . THR   A 1 213 ? 0.169   16.614  -25.36  1   29.21  ? 903  THR   A CB   1 1 
ATOM   3203 O  OG1  . THR   A 1 213 ? -0.622  15.514  -24.896 1   30.01  ? 903  THR   A OG1  1 1 
ATOM   3204 C  CG2  . THR   A 1 213 ? 0.768   17.408  -24.186 1   29.43  ? 903  THR   A CG2  1 1 
ATOM   3205 H  H    . THR   A 1 213 ? -1.058  15.687  -27.282 0   23.33  ? 903  THR   A H    1 1 
ATOM   3206 H  HA   . THR   A 1 213 ? -1.478  17.948  -25.656 0   24.72  ? 903  THR   A HA   1 1 
ATOM   3207 H  HB   . THR   A 1 213 ? 0.997   16.221  -25.948 0   24.19  ? 903  THR   A HB   1 1 
ATOM   3208 H  HG1  . THR   A 1 213 ? -0.25   15.077  -24.085 0   25.13  ? 903  THR   A HG1  1 1 
ATOM   3209 H  HG21 . THR   A 1 213 ? 1.269   16.732  -23.494 0   24.87  ? 903  THR   A HG21 1 1 
ATOM   3210 H  HG22 . THR   A 1 213 ? 1.498   18.132  -24.547 0   25.4   ? 903  THR   A HG22 1 1 
ATOM   3211 H  HG23 . THR   A 1 213 ? -0.022  17.936  -23.654 0   25.58  ? 903  THR   A HG23 1 1 
ATOM   3212 N  N    . VAL   A 1 214 ? 0.815   18.314  -28.036 1   29.16  ? 904  VAL   A N    1 1 
ATOM   3213 C  CA   . VAL   A 1 214 ? 1.587   19.318  -28.778 1   29.62  ? 904  VAL   A CA   1 1 
ATOM   3214 C  C    . VAL   A 1 214 ? 0.607   20.352  -29.363 1   30.23  ? 904  VAL   A C    1 1 
ATOM   3215 O  O    . VAL   A 1 214 ? 0.849   21.553  -29.241 1   30.42  ? 904  VAL   A O    1 1 
ATOM   3216 C  CB   . VAL   A 1 214 ? 2.5     18.659  -29.867 1   30.02  ? 904  VAL   A CB   1 1 
ATOM   3217 C  CG1  . VAL   A 1 214 ? 2.959   19.67   -30.917 1   30.43  ? 904  VAL   A CG1  1 1 
ATOM   3218 C  CG2  . VAL   A 1 214 ? 3.702   17.961  -29.234 1   30.31  ? 904  VAL   A CG2  1 1 
ATOM   3219 H  H    . VAL   A 1 214 ? 0.873   17.381  -28.432 0   24.46  ? 904  VAL   A H    1 1 
ATOM   3220 H  HA   . VAL   A 1 214 ? 2.222   19.849  -28.07  0   26.19  ? 904  VAL   A HA   1 1 
ATOM   3221 H  HB   . VAL   A 1 214 ? 1.926   17.9    -30.397 0   25.57  ? 904  VAL   A HB   1 1 
ATOM   3222 H  HG11 . VAL   A 1 214 ? 3.818   19.277  -31.459 0   26.91  ? 904  VAL   A HG11 1 1 
ATOM   3223 H  HG12 . VAL   A 1 214 ? 2.138   19.82   -31.615 0   27.18  ? 904  VAL   A HG12 1 1 
ATOM   3224 H  HG13 . VAL   A 1 214 ? 3.223   20.61   -30.434 0   27.57  ? 904  VAL   A HG13 1 1 
ATOM   3225 H  HG21 . VAL   A 1 214 ? 4.288   17.479  -30.016 0   26.13  ? 904  VAL   A HG21 1 1 
ATOM   3226 H  HG22 . VAL   A 1 214 ? 4.311   18.7    -28.716 0   26.58  ? 904  VAL   A HG22 1 1 
ATOM   3227 H  HG23 . VAL   A 1 214 ? 3.342   17.213  -28.529 0   25.68  ? 904  VAL   A HG23 1 1 
ATOM   3228 N  N    . TRP   A 1 215 ? -0.518  19.895  -29.942 1   30.42  ? 905  TRP   A N    1 1 
ATOM   3229 C  CA   . TRP   A 1 215 ? -1.553  20.789  -30.466 1   31.15  ? 905  TRP   A CA   1 1 
ATOM   3230 C  C    . TRP   A 1 215 ? -2.104  21.701  -29.359 1   32.08  ? 905  TRP   A C    1 1 
ATOM   3231 O  O    . TRP   A 1 215 ? -2.368  22.871  -29.624 1   32.28  ? 905  TRP   A O    1 1 
ATOM   3232 C  CB   . TRP   A 1 215 ? -2.695  19.973  -31.095 1   30.99  ? 905  TRP   A CB   1 1 
ATOM   3233 C  CG   . TRP   A 1 215 ? -3.775  20.811  -31.712 1   31.3   ? 905  TRP   A CG   1 1 
ATOM   3234 C  CD1  . TRP   A 1 215 ? -3.83   21.262  -32.999 1   32.14  ? 905  TRP   A CD1  1 1 
ATOM   3235 C  CD2  . TRP   A 1 215 ? -4.983  21.255  -31.079 1   31.33  ? 905  TRP   A CD2  1 1 
ATOM   3236 N  NE1  . TRP   A 1 215 ? -4.978  21.993  -33.194 1   32.4   ? 905  TRP   A NE1  1 1 
ATOM   3237 C  CE2  . TRP   A 1 215 ? -5.708  21.998  -32.032 1   32.11  ? 905  TRP   A CE2  1 1 
ATOM   3238 C  CE3  . TRP   A 1 215 ? -5.51   21.12   -29.789 1   31.81  ? 905  TRP   A CE3  1 1 
ATOM   3239 C  CZ2  . TRP   A 1 215 ? -6.927  22.602  -31.734 1   32.67  ? 905  TRP   A CZ2  1 1 
ATOM   3240 C  CZ3  . TRP   A 1 215 ? -6.703  21.742  -29.49  1   32.67  ? 905  TRP   A CZ3  1 1 
ATOM   3241 C  CH2  . TRP   A 1 215 ? -7.409  22.456  -30.461 1   32.78  ? 905  TRP   A CH2  1 1 
ATOM   3242 H  H    . TRP   A 1 215 ? -0.735  18.913  -30.08  0   26.75  ? 905  TRP   A H    1 1 
ATOM   3243 H  HA   . TRP   A 1 215 ? -1.12   21.42   -31.241 0   29.27  ? 905  TRP   A HA   1 1 
ATOM   3244 H  HB2  . TRP   A 1 215 ? -2.281  19.338  -31.876 0   28.27  ? 905  TRP   A HB2  1 1 
ATOM   3245 H  HB3  . TRP   A 1 215 ? -3.151  19.356  -30.322 0   28.64  ? 905  TRP   A HB3  1 1 
ATOM   3246 H  HD1  . TRP   A 1 215 ? -3.076  21.085  -33.747 0   31.16  ? 905  TRP   A HD1  1 1 
ATOM   3247 H  HE1  . TRP   A 1 215 ? -5.262  22.445  -34.088 0   34.08  ? 905  TRP   A HE1  1 1 
ATOM   3248 H  HE3  . TRP   A 1 215 ? -4.969  20.577  -29.032 0   31.57  ? 905  TRP   A HE3  1 1 
ATOM   3249 H  HZ2  . TRP   A 1 215 ? -7.469  23.165  -32.476 0   37.08  ? 905  TRP   A HZ2  1 1 
ATOM   3250 H  HZ3  . TRP   A 1 215 ? -7.126  21.626  -28.506 0   35.43  ? 905  TRP   A HZ3  1 1 
ATOM   3251 H  HH2  . TRP   A 1 215 ? -8.354  22.903  -30.201 0   38.03  ? 905  TRP   A HH2  1 1 
ATOM   3252 N  N    . GLU   A 1 216 ? -2.289  21.167  -28.134 1   32.42  ? 906  GLU   A N    1 1 
ATOM   3253 C  CA   . GLU   A 1 216 ? -2.766  21.946  -26.987 1   33.43  ? 906  GLU   A CA   1 1 
ATOM   3254 C  C    . GLU   A 1 216 ? -1.777  23.061  -26.632 1   34.41  ? 906  GLU   A C    1 1 
ATOM   3255 O  O    . GLU   A 1 216 ? -2.207  24.168  -26.33  1   34.92  ? 906  GLU   A O    1 1 
ATOM   3256 C  CB   . GLU   A 1 216 ? -2.963  21.058  -25.744 1   35.29  ? 906  GLU   A CB   1 1 
ATOM   3257 C  CG   . GLU   A 1 216 ? -4.201  20.182  -25.762 1   39.05  ? 906  GLU   A CG   1 1 
ATOM   3258 C  CD   . GLU   A 1 216 ? -4.318  19.308  -24.528 1   43.69  ? 906  GLU   A CD   1 1 
ATOM   3259 O  OE1  . GLU   A 1 216 ? -5.072  19.688  -23.603 1   44.83  ? 906  GLU   A OE1  1 1 
ATOM   3260 O  OE2  . GLU   A 1 216 ? -3.651  18.25   -24.479 1   44.36  ? 906  GLU   A OE2  1 1 
ATOM   3261 H  H    . GLU   A 1 216 ? -2.125  20.189  -27.918 0   30.13  ? 906  GLU   A H    1 1 
ATOM   3262 H  HA   . GLU   A 1 216 ? -3.721  22.405  -27.238 0   34.02  ? 906  GLU   A HA   1 1 
ATOM   3263 H  HB2  . GLU   A 1 216 ? -2.097  20.408  -25.627 0   33.46  ? 906  GLU   A HB2  1 1 
ATOM   3264 H  HB3  . GLU   A 1 216 ? -3.043  21.708  -24.874 0   35.24  ? 906  GLU   A HB3  1 1 
ATOM   3265 H  HG2  . GLU   A 1 216 ? -5.084  20.817  -25.81  0   39.49  ? 906  GLU   A HG2  1 1 
ATOM   3266 H  HG3  . GLU   A 1 216 ? -4.162  19.529  -26.634 0   37.67  ? 906  GLU   A HG3  1 1 
ATOM   3267 N  N    . LEU   A 1 217 ? -0.466  22.78   -26.661 1   34.66  ? 907  LEU   A N    1 1 
ATOM   3268 C  CA   . LEU   A 1 217 ? 0.542   23.79   -26.325 1   35.37  ? 907  LEU   A CA   1 1 
ATOM   3269 C  C    . LEU   A 1 217 ? 0.64    24.844  -27.422 1   36.38  ? 907  LEU   A C    1 1 
ATOM   3270 O  O    . LEU   A 1 217 ? 0.718   26.038  -27.122 1   36.47  ? 907  LEU   A O    1 1 
ATOM   3271 C  CB   . LEU   A 1 217 ? 1.932   23.155  -26.096 1   35.51  ? 907  LEU   A CB   1 1 
ATOM   3272 C  CG   . LEU   A 1 217 ? 2.023   21.96   -25.126 1   36.77  ? 907  LEU   A CG   1 1 
ATOM   3273 C  CD1  . LEU   A 1 217 ? 3.446   21.449  -25.031 1   37.24  ? 907  LEU   A CD1  1 1 
ATOM   3274 C  CD2  . LEU   A 1 217 ? 1.465   22.299  -23.753 1   37.31  ? 907  LEU   A CD2  1 1 
ATOM   3275 H  H    . LEU   A 1 217 ? -0.086  21.882  -26.944 0   33.16  ? 907  LEU   A H    1 1 
ATOM   3276 H  HA   . LEU   A 1 217 ? 0.243   24.304  -25.413 0   36.72  ? 907  LEU   A HA   1 1 
ATOM   3277 H  HB2  . LEU   A 1 217 ? 2.309   22.813  -27.059 0   34.69  ? 907  LEU   A HB2  1 1 
ATOM   3278 H  HB3  . LEU   A 1 217 ? 2.594   23.928  -25.71  0   36.22  ? 907  LEU   A HB3  1 1 
ATOM   3279 H  HG   . LEU   A 1 217 ? 1.421   21.145  -25.526 0   34.66  ? 907  LEU   A HG   1 1 
ATOM   3280 H  HD11 . LEU   A 1 217 ? 3.474   20.59   -24.362 0   35.07  ? 907  LEU   A HD11 1 1 
ATOM   3281 H  HD12 . LEU   A 1 217 ? 3.782   21.154  -26.024 0   35.23  ? 907  LEU   A HD12 1 1 
ATOM   3282 H  HD13 . LEU   A 1 217 ? 4.083   22.243  -24.644 0   36.65  ? 907  LEU   A HD13 1 1 
ATOM   3283 H  HD21 . LEU   A 1 217 ? 1.734   21.504  -23.059 0   36.07  ? 907  LEU   A HD21 1 1 
ATOM   3284 H  HD22 . LEU   A 1 217 ? 1.891   23.243  -23.418 0   37.77  ? 907  LEU   A HD22 1 1 
ATOM   3285 H  HD23 . LEU   A 1 217 ? 0.379   22.371  -23.797 0   37.14  ? 907  LEU   A HD23 1 1 
ATOM   3286 N  N    . MET   A 1 218 ? 0.576   24.418  -28.69  1   36.74  ? 908  MET   A N    1 1 
ATOM   3287 C  CA   . MET   A 1 218 ? 0.665   25.339  -29.822 1   37.38  ? 908  MET   A CA   1 1 
ATOM   3288 C  C    . MET   A 1 218 ? -0.565  26.258  -29.918 1   38.22  ? 908  MET   A C    1 1 
ATOM   3289 O  O    . MET   A 1 218 ? -0.439  27.367  -30.431 1   38.23  ? 908  MET   A O    1 1 
ATOM   3290 C  CB   . MET   A 1 218 ? 0.878   24.562  -31.132 1   37.69  ? 908  MET   A CB   1 1 
ATOM   3291 C  CG   . MET   A 1 218 ? 2.156   23.722  -31.173 1   38.92  ? 908  MET   A CG   1 1 
ATOM   3292 S  SD   . MET   A 1 218 ? 3.69    24.627  -30.883 1   40.71  ? 908  MET   A SD   1 1 
ATOM   3293 C  CE   . MET   A 1 218 ? 4.854   23.281  -30.857 1   38.77  ? 908  MET   A CE   1 1 
ATOM   3294 H  H    . MET   A 1 218 ? 0.441   23.448  -28.956 0   36.42  ? 908  MET   A H    1 1 
ATOM   3295 H  HA   . MET   A 1 218 ? 1.529   25.984  -29.67  0   39.94  ? 908  MET   A HA   1 1 
ATOM   3296 H  HB2  . MET   A 1 218 ? 0.036   23.886  -31.272 0   37.8   ? 908  MET   A HB2  1 1 
ATOM   3297 H  HB3  . MET   A 1 218 ? 0.921   25.273  -31.956 0   39.22  ? 908  MET   A HB3  1 1 
ATOM   3298 H  HG2  . MET   A 1 218 ? 2.089   22.937  -30.422 0   37.91  ? 908  MET   A HG2  1 1 
ATOM   3299 H  HG3  . MET   A 1 218 ? 2.232   23.268  -32.16  0   38.21  ? 908  MET   A HG3  1 1 
ATOM   3300 H  HE1  . MET   A 1 218 ? 5.854   23.679  -30.695 0   39.58  ? 908  MET   A HE1  1 1 
ATOM   3301 H  HE2  . MET   A 1 218 ? 4.59    22.6    -30.049 0   37.98  ? 908  MET   A HE2  1 1 
ATOM   3302 H  HE3  . MET   A 1 218 ? 4.812   22.758  -31.812 0   38.22  ? 908  MET   A HE3  1 1 
ATOM   3303 N  N    . THR   A 1 219 ? -1.738  25.812  -29.426 1   38.77  ? 909  THR   A N    1 1 
ATOM   3304 C  CA   . THR   A 1 219 ? -2.955  26.635  -29.385 1   39.84  ? 909  THR   A CA   1 1 
ATOM   3305 C  C    . THR   A 1 219 ? -3.138  27.36   -28.015 1   41.1   ? 909  THR   A C    1 1 
ATOM   3306 O  O    . THR   A 1 219 ? -4.182  27.973  -27.796 1   41.37  ? 909  THR   A O    1 1 
ATOM   3307 C  CB   . THR   A 1 219 ? -4.188  25.76   -29.707 1   40.94  ? 909  THR   A CB   1 1 
ATOM   3308 O  OG1  . THR   A 1 219 ? -4.17   24.571  -28.908 1   42.09  ? 909  THR   A OG1  1 1 
ATOM   3309 C  CG2  . THR   A 1 219 ? -4.261  25.37   -31.173 1   41.12  ? 909  THR   A CG2  1 1 
ATOM   3310 H  H    . THR   A 1 219 ? -1.892  24.875  -29.069 0   40.89  ? 909  THR   A H    1 1 
ATOM   3311 H  HA   . THR   A 1 219 ? -2.895  27.417  -30.141 0   45.77  ? 909  THR   A HA   1 1 
ATOM   3312 H  HB   . THR   A 1 219 ? -5.094  26.321  -29.486 0   47     ? 909  THR   A HB   1 1 
ATOM   3313 H  HG1  . THR   A 1 219 ? -4.022  24.762  -27.944 0   45.13  ? 909  THR   A HG1  1 1 
ATOM   3314 H  HG21 . THR   A 1 219 ? -5.176  24.815  -31.375 0   44.96  ? 909  THR   A HG21 1 1 
ATOM   3315 H  HG22 . THR   A 1 219 ? -4.239  26.261  -31.8   0   46.19  ? 909  THR   A HG22 1 1 
ATOM   3316 H  HG23 . THR   A 1 219 ? -3.404  24.744  -31.411 0   43.71  ? 909  THR   A HG23 1 1 
ATOM   3317 N  N    . PHE   A 1 220 ? -2.135  27.29   -27.112 1   41.58  ? 910  PHE   A N    1 1 
ATOM   3318 C  CA   . PHE   A 1 220 ? -2.146  27.911  -25.788 1   42.61  ? 910  PHE   A CA   1 1 
ATOM   3319 C  C    . PHE   A 1 220 ? -3.347  27.492  -24.924 1   43.57  ? 910  PHE   A C    1 1 
ATOM   3320 O  O    . PHE   A 1 220 ? -3.965  28.33   -24.269 1   43.85  ? 910  PHE   A O    1 1 
ATOM   3321 C  CB   . PHE   A 1 220 ? -2.027  29.442  -25.886 1   42.52  ? 910  PHE   A CB   1 1 
ATOM   3322 C  CG   . PHE   A 1 220 ? -0.841  29.913  -26.696 1   43.14  ? 910  PHE   A CG   1 1 
ATOM   3323 C  CD1  . PHE   A 1 220 ? 0.408   30.042  -26.116 1   43.89  ? 910  PHE   A CD1  1 1 
ATOM   3324 C  CD2  . PHE   A 1 220 ? -0.979  30.232  -28.036 1   43.87  ? 910  PHE   A CD2  1 1 
ATOM   3325 C  CE1  . PHE   A 1 220 ? 1.499   30.469  -26.864 1   44.56  ? 910  PHE   A CE1  1 1 
ATOM   3326 C  CE2  . PHE   A 1 220 ? 0.114   30.658  -28.782 1   44.53  ? 910  PHE   A CE2  1 1 
ATOM   3327 C  CZ   . PHE   A 1 220 ? 1.343   30.78   -28.19  1   44.35  ? 910  PHE   A CZ   1 1 
ATOM   3328 H  H    . PHE   A 1 220 ? -1.261  26.8    -27.272 0   46.46  ? 910  PHE   A H    1 1 
ATOM   3329 H  HA   . PHE   A 1 220 ? -1.258  27.564  -25.262 0   49.31  ? 910  PHE   A HA   1 1 
ATOM   3330 H  HB2  . PHE   A 1 220 ? -2.932  29.85   -26.333 0   53.64  ? 910  PHE   A HB2  1 1 
ATOM   3331 H  HB3  . PHE   A 1 220 ? -1.892  29.833  -24.878 0   53.81  ? 910  PHE   A HB3  1 1 
ATOM   3332 H  HD1  . PHE   A 1 220 ? 0.54    29.8    -25.075 0   54.05  ? 910  PHE   A HD1  1 1 
ATOM   3333 H  HD2  . PHE   A 1 220 ? -1.942  30.138  -28.509 0   54.25  ? 910  PHE   A HD2  1 1 
ATOM   3334 H  HE1  . PHE   A 1 220 ? 2.466   30.565  -26.4   0   55.42  ? 910  PHE   A HE1  1 1 
ATOM   3335 H  HE2  . PHE   A 1 220 ? -0.007  30.901  -29.824 0   55.18  ? 910  PHE   A HE2  1 1 
ATOM   3336 H  HZ   . PHE   A 1 220 ? 2.188   31.114  -28.768 0   55.45  ? 910  PHE   A HZ   1 1 
ATOM   3337 N  N    . GLY   A 1 221 ? -3.638  26.194  -24.914 1   43.92  ? 911  GLY   A N    1 1 
ATOM   3338 C  CA   . GLY   A 1 221 ? -4.693  25.607  -24.1   1   44.7   ? 911  GLY   A CA   1 1 
ATOM   3339 C  C    . GLY   A 1 221 ? -6.081  25.536  -24.697 1   45.38  ? 911  GLY   A C    1 1 
ATOM   3340 O  O    . GLY   A 1 221 ? -7.059  25.6    -23.95  1   45.48  ? 911  GLY   A O    1 1 
ATOM   3341 H  H    . GLY   A 1 221 ? -3.144  25.5    -25.466 0   48.35  ? 911  GLY   A H    1 1 
ATOM   3342 H  HA2  . GLY   A 1 221 ? -4.402  24.585  -23.86  0   49.28  ? 911  GLY   A HA2  1 1 
ATOM   3343 H  HA3  . GLY   A 1 221 ? -4.773  26.15   -23.161 0   52.09  ? 911  GLY   A HA3  1 1 
ATOM   3344 N  N    . SER   A 1 222 ? -6.197  25.376  -26.023 1   45.74  ? 912  SER   A N    1 1 
ATOM   3345 C  CA   . SER   A 1 222 ? -7.509  25.224  -26.655 1   46.71  ? 912  SER   A CA   1 1 
ATOM   3346 C  C    . SER   A 1 222 ? -8.029  23.809  -26.386 1   47.48  ? 912  SER   A C    1 1 
ATOM   3347 O  O    . SER   A 1 222 ? -7.237  22.869  -26.275 1   47.51  ? 912  SER   A O    1 1 
ATOM   3348 C  CB   . SER   A 1 222 ? -7.425  25.466  -28.159 1   48.02  ? 912  SER   A CB   1 1 
ATOM   3349 O  OG   . SER   A 1 222 ? -7.159  26.829  -28.442 1   50.28  ? 912  SER   A OG   1 1 
ATOM   3350 H  H    . SER   A 1 222 ? -5.419  25.355  -26.673 0   51.22  ? 912  SER   A H    1 1 
ATOM   3351 H  HA   . SER   A 1 222 ? -8.211  25.941  -26.234 0   56.16  ? 912  SER   A HA   1 1 
ATOM   3352 H  HB2  . SER   A 1 222 ? -6.635  24.845  -28.577 0   53.65  ? 912  SER   A HB2  1 1 
ATOM   3353 H  HB3  . SER   A 1 222 ? -8.378  25.193  -28.609 0   55.93  ? 912  SER   A HB3  1 1 
ATOM   3354 H  HG   . SER   A 1 222 ? -7.156  26.979  -29.424 0   59.12  ? 912  SER   A HG   1 1 
ATOM   3355 N  N    . LYS   A 1 223 ? -9.352  23.656  -26.263 1   47.98  ? 913  LYS   A N    1 1 
ATOM   3356 C  CA   . LYS   A 1 223 ? -9.946  22.346  -26.002 1   48.93  ? 913  LYS   A CA   1 1 
ATOM   3357 C  C    . LYS   A 1 223 ? -10.04  21.584  -27.331 1   49.45  ? 913  LYS   A C    1 1 
ATOM   3358 O  O    . LYS   A 1 223 ? -10.561 22.154  -28.289 1   49.56  ? 913  LYS   A O    1 1 
ATOM   3359 C  CB   . LYS   A 1 223 ? -11.337 22.493  -25.361 1   51.08  ? 913  LYS   A CB   1 1 
ATOM   3360 C  CG   . LYS   A 1 223 ? -11.285 23.018  -23.925 1   55.44  ? 913  LYS   A CG   1 1 
ATOM   3361 C  CD   . LYS   A 1 223 ? -12.676 23.321  -23.331 1   60.19  ? 913  LYS   A CD   1 1 
ATOM   3362 C  CE   . LYS   A 1 223 ? -12.817 24.717  -22.749 1   64.43  ? 913  LYS   A CE   1 1 
ATOM   3363 N  NZ   . LYS   A 1 223 ? -12.193 24.853  -21.401 1   66.79  ? 913  LYS   A NZ   1 1 
ATOM   3364 H  H    . LYS   A 1 223 ? -10.023 24.414  -26.352 0   57.82  ? 913  LYS   A H    1 1 
ATOM   3365 H  HA   . LYS   A 1 223 ? -9.316  21.811  -25.293 0   55.15  ? 913  LYS   A HA   1 1 
ATOM   3366 H  HB2  . LYS   A 1 223 ? -11.937 23.183  -25.954 0   62.59  ? 913  LYS   A HB2  1 1 
ATOM   3367 H  HB3  . LYS   A 1 223 ? -11.817 21.516  -25.34  0   60.9   ? 913  LYS   A HB3  1 1 
ATOM   3368 H  HG2  . LYS   A 1 223 ? -10.82  22.26   -23.297 0   64.92  ? 913  LYS   A HG2  1 1 
ATOM   3369 H  HG3  . LYS   A 1 223 ? -10.682 23.925  -23.905 0   66.56  ? 913  LYS   A HG3  1 1 
ATOM   3370 H  HD2  . LYS   A 1 223 ? -13.439 23.212  -24.1   0   74.96  ? 913  LYS   A HD2  1 1 
ATOM   3371 H  HD3  . LYS   A 1 223 ? -12.867 22.613  -22.527 0   73.81  ? 913  LYS   A HD3  1 1 
ATOM   3372 H  HE2  . LYS   A 1 223 ? -12.352 25.441  -23.416 0   80.68  ? 913  LYS   A HE2  1 1 
ATOM   3373 H  HE3  . LYS   A 1 223 ? -13.877 24.943  -22.644 0   82.94  ? 913  LYS   A HE3  1 1 
ATOM   3374 H  HZ1  . LYS   A 1 223 ? -12.199 25.828  -21.118 0   83.59  ? 913  LYS   A HZ1  1 1 
ATOM   3375 H  HZ2  . LYS   A 1 223 ? -12.724 24.317  -20.722 0   83.57  ? 913  LYS   A HZ2  1 1 
ATOM   3376 H  HZ3  . LYS   A 1 223 ? -11.234 24.522  -21.405 0   80.23  ? 913  LYS   A HZ3  1 1 
ATOM   3377 N  N    . PRO   A 1 224 ? -9.524  20.335  -27.451 1   49.6   ? 914  PRO   A N    1 1 
ATOM   3378 C  CA   . PRO   A 1 224 ? -9.616  19.641  -28.747 1   49.87  ? 914  PRO   A CA   1 1 
ATOM   3379 C  C    . PRO   A 1 224 ? -11.047 19.254  -29.106 1   50.42  ? 914  PRO   A C    1 1 
ATOM   3380 O  O    . PRO   A 1 224 ? -11.792 18.836  -28.224 1   50.56  ? 914  PRO   A O    1 1 
ATOM   3381 C  CB   . PRO   A 1 224 ? -8.705  18.418  -28.576 1   50.42  ? 914  PRO   A CB   1 1 
ATOM   3382 C  CG   . PRO   A 1 224 ? -8.584  18.204  -27.131 1   50.74  ? 914  PRO   A CG   1 1 
ATOM   3383 C  CD   . PRO   A 1 224 ? -8.857  19.499  -26.43  1   49.14  ? 914  PRO   A CD   1 1 
ATOM   3384 H  HA   . PRO   A 1 224 ? -9.201  20.268  -29.535 0   54.14  ? 914  PRO   A HA   1 1 
ATOM   3385 H  HB2  . PRO   A 1 224 ? -9.167  17.555  -29.053 0   53     ? 914  PRO   A HB2  1 1 
ATOM   3386 H  HB3  . PRO   A 1 224 ? -7.731  18.624  -29.017 0   51.7   ? 914  PRO   A HB3  1 1 
ATOM   3387 H  HG2  . PRO   A 1 224 ? -9.306  17.451  -26.819 0   53.28  ? 914  PRO   A HG2  1 1 
ATOM   3388 H  HG3  . PRO   A 1 224 ? -7.573  17.867  -26.908 0   51.52  ? 914  PRO   A HG3  1 1 
ATOM   3389 H  HD2  . PRO   A 1 224 ? -9.522  19.326  -25.585 0   53.52  ? 914  PRO   A HD2  1 1 
ATOM   3390 H  HD3  . PRO   A 1 224 ? -7.922  19.958  -26.112 0   51.93  ? 914  PRO   A HD3  1 1 
ATOM   3391 N  N    . TYR   A 1 225 ? -11.433 19.426  -30.389 1   50.65  ? 915  TYR   A N    1 1 
ATOM   3392 C  CA   . TYR   A 1 225 ? -12.775 19.114  -30.907 1   51.41  ? 915  TYR   A CA   1 1 
ATOM   3393 C  C    . TYR   A 1 225 ? -13.876 19.77   -30.047 1   52.18  ? 915  TYR   A C    1 1 
ATOM   3394 O  O    . TYR   A 1 225 ? -14.845 19.113  -29.664 1   52.32  ? 915  TYR   A O    1 1 
ATOM   3395 C  CB   . TYR   A 1 225 ? -13     17.587  -31.006 1   51.41  ? 915  TYR   A CB   1 1 
ATOM   3396 C  CG   . TYR   A 1 225 ? -11.812 16.798  -31.509 1   52.12  ? 915  TYR   A CG   1 1 
ATOM   3397 C  CD1  . TYR   A 1 225 ? -10.993 16.103  -30.631 1   52.99  ? 915  TYR   A CD1  1 1 
ATOM   3398 C  CD2  . TYR   A 1 225 ? -11.553 16.682  -32.866 1   53.03  ? 915  TYR   A CD2  1 1 
ATOM   3399 C  CE1  . TYR   A 1 225 ? -9.912  15.363  -31.085 1   53.84  ? 915  TYR   A CE1  1 1 
ATOM   3400 C  CE2  . TYR   A 1 225 ? -10.481 15.934  -33.334 1   53.92  ? 915  TYR   A CE2  1 1 
ATOM   3401 C  CZ   . TYR   A 1 225 ? -9.658  15.278  -32.439 1   54.71  ? 915  TYR   A CZ   1 1 
ATOM   3402 O  OH   . TYR   A 1 225 ? -8.605  14.511  -32.876 1   56.05  ? 915  TYR   A OH   1 1 
ATOM   3403 H  H    . TYR   A 1 225 ? -10.819 19.787  -31.112 0   56.76  ? 915  TYR   A H    1 1 
ATOM   3404 H  HA   . TYR   A 1 225 ? -12.859 19.523  -31.913 0   60.74  ? 915  TYR   A HA   1 1 
ATOM   3405 H  HB2  . TYR   A 1 225 ? -13.243 17.194  -30.019 0   60.36  ? 915  TYR   A HB2  1 1 
ATOM   3406 H  HB3  . TYR   A 1 225 ? -13.828 17.402  -31.688 0   61.62  ? 915  TYR   A HB3  1 1 
ATOM   3407 H  HD1  . TYR   A 1 225 ? -11.177 16.173  -29.573 0   58.07  ? 915  TYR   A HD1  1 1 
ATOM   3408 H  HD2  . TYR   A 1 225 ? -12.187 17.194  -33.569 0   60.55  ? 915  TYR   A HD2  1 1 
ATOM   3409 H  HE1  . TYR   A 1 225 ? -9.278  14.848  -30.383 0   56.01  ? 915  TYR   A HE1  1 1 
ATOM   3410 H  HE2  . TYR   A 1 225 ? -10.296 15.872  -34.394 0   58.43  ? 915  TYR   A HE2  1 1 
ATOM   3411 H  HH   . TYR   A 1 225 ? -8.395  14.714  -33.825 0   57.21  ? 915  TYR   A HH   1 1 
ATOM   3412 N  N    . ASP   A 1 226 ? -13.713 21.064  -29.739 1   52.45  ? 916  ASP   A N    1 1 
ATOM   3413 C  CA   . ASP   A 1 226 ? -14.644 21.795  -28.885 1   53.16  ? 916  ASP   A CA   1 1 
ATOM   3414 C  C    . ASP   A 1 226 ? -16.037 21.864  -29.514 1   53.55  ? 916  ASP   A C    1 1 
ATOM   3415 O  O    . ASP   A 1 226 ? -16.164 22.197  -30.69  1   53.74  ? 916  ASP   A O    1 1 
ATOM   3416 C  CB   . ASP   A 1 226 ? -14.102 23.206  -28.608 1   54.98  ? 916  ASP   A CB   1 1 
ATOM   3417 C  CG   . ASP   A 1 226 ? -14.833 23.947  -27.511 1   59.65  ? 916  ASP   A CG   1 1 
ATOM   3418 O  OD1  . ASP   A 1 226 ? -15.054 23.348  -26.435 1   60.34  ? 916  ASP   A OD1  1 1 
ATOM   3419 O  OD2  . ASP   A 1 226 ? -15.165 25.133  -27.718 1   61.99  ? 916  ASP   A OD2  1 1 
ATOM   3420 H  H    . ASP   A 1 226 ? -12.951 21.636  -30.089 0   63.45  ? 916  ASP   A H    1 1 
ATOM   3421 H  HA   . ASP   A 1 226 ? -14.716 21.263  -27.938 0   67.55  ? 916  ASP   A HA   1 1 
ATOM   3422 H  HB2  . ASP   A 1 226 ? -13.058 23.131  -28.307 0   67.87  ? 916  ASP   A HB2  1 1 
ATOM   3423 H  HB3  . ASP   A 1 226 ? -14.182 23.797  -29.519 0   70.61  ? 916  ASP   A HB3  1 1 
ATOM   3424 N  N    . GLY   A 1 227 ? -17.057 21.511  -28.736 1   53.59  ? 917  GLY   A N    1 1 
ATOM   3425 C  CA   . GLY   A 1 227 ? -18.438 21.484  -29.201 1   54.14  ? 917  GLY   A CA   1 1 
ATOM   3426 C  C    . GLY   A 1 227 ? -18.871 20.151  -29.789 1   54.45  ? 917  GLY   A C    1 1 
ATOM   3427 O  O    . GLY   A 1 227 ? -20.071 19.887  -29.886 1   54.67  ? 917  GLY   A O    1 1 
ATOM   3428 H  H    . GLY   A 1 227 ? -16.964 21.238  -27.763 0   72.83  ? 917  GLY   A H    1 1 
ATOM   3429 H  HA2  . GLY   A 1 227 ? -19.093 21.701  -28.358 0   78.93  ? 917  GLY   A HA2  1 1 
ATOM   3430 H  HA3  . GLY   A 1 227 ? -18.599 22.257  -29.951 0   77.88  ? 917  GLY   A HA3  1 1 
ATOM   3431 N  N    . ILE   A 1 228 ? -17.907 19.294  -30.184 1   54.3   ? 918  ILE   A N    1 1 
ATOM   3432 C  CA   . ILE   A 1 228 ? -18.193 17.986  -30.778 1   54.63  ? 918  ILE   A CA   1 1 
ATOM   3433 C  C    . ILE   A 1 228 ? -18.33  16.942  -29.654 1   54.99  ? 918  ILE   A C    1 1 
ATOM   3434 O  O    . ILE   A 1 228 ? -17.408 16.853  -28.842 1   55.11  ? 918  ILE   A O    1 1 
ATOM   3435 C  CB   . ILE   A 1 228 ? -17.051 17.593  -31.766 1   55.01  ? 918  ILE   A CB   1 1 
ATOM   3436 C  CG1  . ILE   A 1 228 ? -17.03  18.535  -33.008 1   55.9   ? 918  ILE   A CG1  1 1 
ATOM   3437 C  CG2  . ILE   A 1 228 ? -17.184 16.128  -32.199 1   55.4   ? 918  ILE   A CG2  1 1 
ATOM   3438 C  CD1  . ILE   A 1 228 ? -15.643 18.724  -33.652 1   57.27  ? 918  ILE   A CD1  1 1 
ATOM   3439 H  H    . ILE   A 1 228 ? -16.913 19.477  -30.103 0   71.89  ? 918  ILE   A H    1 1 
ATOM   3440 H  HA   . ILE   A 1 228 ? -19.108 18.055  -31.363 0   76.83  ? 918  ILE   A HA   1 1 
ATOM   3441 H  HB   . ILE   A 1 228 ? -16.102 17.684  -31.24  0   69.91  ? 918  ILE   A HB   1 1 
ATOM   3442 H  HG12 . ILE   A 1 228 ? -17.689 18.125  -33.772 0   74.9   ? 918  ILE   A HG12 1 1 
ATOM   3443 H  HG13 . ILE   A 1 228 ? -17.385 19.526  -32.729 0   74.73  ? 918  ILE   A HG13 1 1 
ATOM   3444 H  HG21 . ILE   A 1 228 ? -16.574 15.962  -33.085 0   70.62  ? 918  ILE   A HG21 1 1 
ATOM   3445 H  HG22 . ILE   A 1 228 ? -16.826 15.475  -31.404 0   72.05  ? 918  ILE   A HG22 1 1 
ATOM   3446 H  HG23 . ILE   A 1 228 ? -18.227 15.915  -32.425 0   74.7   ? 918  ILE   A HG23 1 1 
ATOM   3447 H  HD11 . ILE   A 1 228 ? -15.732 19.421  -34.484 0   72.48  ? 918  ILE   A HD11 1 1 
ATOM   3448 H  HD12 . ILE   A 1 228 ? -14.957 19.12   -32.905 0   70.55  ? 918  ILE   A HD12 1 1 
ATOM   3449 H  HD13 . ILE   A 1 228 ? -15.283 17.762  -34.013 0   70.73  ? 918  ILE   A HD13 1 1 
ATOM   3450 N  N    . PRO   A 1 229 ? -19.419 16.13   -29.57  1   55     ? 919  PRO   A N    1 1 
ATOM   3451 C  CA   . PRO   A 1 229 ? -19.482 15.121  -28.495 1   55.06  ? 919  PRO   A CA   1 1 
ATOM   3452 C  C    . PRO   A 1 229 ? -18.517 13.954  -28.729 1   55.21  ? 919  PRO   A C    1 1 
ATOM   3453 O  O    . PRO   A 1 229 ? -18.166 13.662  -29.872 1   55.22  ? 919  PRO   A O    1 1 
ATOM   3454 C  CB   . PRO   A 1 229 ? -20.95  14.682  -28.493 1   55.73  ? 919  PRO   A CB   1 1 
ATOM   3455 C  CG   . PRO   A 1 229 ? -21.452 14.976  -29.85  1   56.14  ? 919  PRO   A CG   1 1 
ATOM   3456 C  CD   . PRO   A 1 229 ? -20.612 16.071  -30.442 1   54.54  ? 919  PRO   A CD   1 1 
ATOM   3457 H  HA   . PRO   A 1 229 ? -19.262 15.578  -27.532 0   76.63  ? 919  PRO   A HA   1 1 
ATOM   3458 H  HB2  . PRO   A 1 229 ? -21.011 13.615  -28.283 0   82.05  ? 919  PRO   A HB2  1 1 
ATOM   3459 H  HB3  . PRO   A 1 229 ? -21.5   15.254  -27.747 0   83.58  ? 919  PRO   A HB3  1 1 
ATOM   3460 H  HG2  . PRO   A 1 229 ? -21.372 14.079  -30.461 0   83.64  ? 919  PRO   A HG2  1 1 
ATOM   3461 H  HG3  . PRO   A 1 229 ? -22.492 15.295  -29.785 0   86.84  ? 919  PRO   A HG3  1 1 
ATOM   3462 H  HD2  . PRO   A 1 229 ? -20.332 15.807  -31.461 0   79.32  ? 919  PRO   A HD2  1 1 
ATOM   3463 H  HD3  . PRO   A 1 229 ? -21.151 17.017  -30.412 0   81.76  ? 919  PRO   A HD3  1 1 
ATOM   3464 N  N    . ALA   A 1 230 ? -18.074 13.304  -27.638 1   55.19  ? 920  ALA   A N    1 1 
ATOM   3465 C  CA   . ALA   A 1 230 ? -17.118 12.189  -27.683 1   55.49  ? 920  ALA   A CA   1 1 
ATOM   3466 C  C    . ALA   A 1 230 ? -17.548 11.014  -28.57  1   55.76  ? 920  ALA   A C    1 1 
ATOM   3467 O  O    . ALA   A 1 230 ? -16.689 10.352  -29.148 1   55.89  ? 920  ALA   A O    1 1 
ATOM   3468 C  CB   . ALA   A 1 230 ? -16.849 11.686  -26.28  1   55.69  ? 920  ALA   A CB   1 1 
ATOM   3469 H  H    . ALA   A 1 230 ? -18.373 13.538  -26.697 0   74.53  ? 920  ALA   A H    1 1 
ATOM   3470 H  HA   . ALA   A 1 230 ? -16.173 12.564  -28.07  0   69.84  ? 920  ALA   A HA   1 1 
ATOM   3471 H  HB1  . ALA   A 1 230 ? -16.125 10.874  -26.324 0   70.17  ? 920  ALA   A HB1  1 1 
ATOM   3472 H  HB2  . ALA   A 1 230 ? -16.457 12.506  -25.679 0   70.53  ? 920  ALA   A HB2  1 1 
ATOM   3473 H  HB3  . ALA   A 1 230 ? -17.787 11.328  -25.859 0   73.81  ? 920  ALA   A HB3  1 1 
ATOM   3474 N  N    . SER   A 1 231 ? -18.859 10.741  -28.668 1   55.57  ? 921  SER   A N    1 1 
ATOM   3475 C  CA   . SER   A 1 231 ? -19.373 9.648   -29.494 1   55.98  ? 921  SER   A CA   1 1 
ATOM   3476 C  C    . SER   A 1 231 ? -19.202 9.89    -31.006 1   56.14  ? 921  SER   A C    1 1 
ATOM   3477 O  O    . SER   A 1 231 ? -19.183 8.926   -31.77  1   56.55  ? 921  SER   A O    1 1 
ATOM   3478 C  CB   . SER   A 1 231 ? -20.841 9.392   -29.173 1   57.21  ? 921  SER   A CB   1 1 
ATOM   3479 O  OG   . SER   A 1 231 ? -21.594 10.593  -29.209 1   59.66  ? 921  SER   A OG   1 1 
ATOM   3480 H  H    . SER   A 1 231 ? -19.591 11.246  -28.179 0   78.28  ? 921  SER   A H    1 1 
ATOM   3481 H  HA   . SER   A 1 231 ? -18.825 8.74    -29.245 0   77.85  ? 921  SER   A HA   1 1 
ATOM   3482 H  HB2  . SER   A 1 231 ? -21.247 8.698   -29.908 0   85.83  ? 921  SER   A HB2  1 1 
ATOM   3483 H  HB3  . SER   A 1 231 ? -20.914 8.961   -28.175 0   84.52  ? 921  SER   A HB3  1 1 
ATOM   3484 H  HG   . SER   A 1 231 ? -22.535 10.414  -28.947 0   90.95  ? 921  SER   A HG   1 1 
ATOM   3485 N  N    . GLU   A 1 232 ? -19.07  11.158  -31.437 1   55.62  ? 922  GLU   A N    1 1 
ATOM   3486 C  CA   . GLU   A 1 232 ? -18.886 11.508  -32.849 1   55.41  ? 922  GLU   A CA   1 1 
ATOM   3487 C  C    . GLU   A 1 232 ? -17.397 11.534  -33.276 1   54.64  ? 922  GLU   A C    1 1 
ATOM   3488 O  O    . GLU   A 1 232 ? -17.117 11.776  -34.448 1   54.92  ? 922  GLU   A O    1 1 
ATOM   3489 C  CB   . GLU   A 1 232 ? -19.505 12.901  -33.094 1   57.89  ? 922  GLU   A CB   1 1 
ATOM   3490 C  CG   . GLU   A 1 232 ? -19.915 13.187  -34.529 1   62.79  ? 922  GLU   A CG   1 1 
ATOM   3491 C  CD   . GLU   A 1 232 ? -20.288 14.634  -34.78  1   69     ? 922  GLU   A CD   1 1 
ATOM   3492 O  OE1  . GLU   A 1 232 ? -20.806 15.287  -33.845 1   70.06  ? 922  GLU   A OE1  1 1 
ATOM   3493 O  OE2  . GLU   A 1 232 ? -20.062 15.114  -35.914 1   71.26  ? 922  GLU   A OE2  1 1 
ATOM   3494 H  H    . GLU   A 1 232 ? -19.083 11.975  -30.835 0   77.16  ? 922  GLU   A H    1 1 
ATOM   3495 H  HA   . GLU   A 1 232 ? -19.405 10.784  -33.475 0   78.71  ? 922  GLU   A HA   1 1 
ATOM   3496 H  HB2  . GLU   A 1 232 ? -20.395 13      -32.475 0   82.86  ? 922  GLU   A HB2  1 1 
ATOM   3497 H  HB3  . GLU   A 1 232 ? -18.776 13.657  -32.806 0   78.69  ? 922  GLU   A HB3  1 1 
ATOM   3498 H  HG2  . GLU   A 1 232 ? -19.085 12.94   -35.191 0   85.16  ? 922  GLU   A HG2  1 1 
ATOM   3499 H  HG3  . GLU   A 1 232 ? -20.78  12.573  -34.776 0   89.51  ? 922  GLU   A HG3  1 1 
ATOM   3500 N  N    . ILE   A 1 233 ? -16.449 11.272  -32.354 1   53.55  ? 923  ILE   A N    1 1 
ATOM   3501 C  CA   . ILE   A 1 233 ? -15.017 11.354  -32.649 1   52.87  ? 923  ILE   A CA   1 1 
ATOM   3502 C  C    . ILE   A 1 233 ? -14.528 10.205  -33.544 1   52.28  ? 923  ILE   A C    1 1 
ATOM   3503 O  O    . ILE   A 1 233 ? -13.795 10.453  -34.499 1   52.29  ? 923  ILE   A O    1 1 
ATOM   3504 C  CB   . ILE   A 1 233 ? -14.19  11.468  -31.333 1   53.18  ? 923  ILE   A CB   1 1 
ATOM   3505 C  CG1  . ILE   A 1 233 ? -14.567 12.738  -30.507 1   53.9   ? 923  ILE   A CG1  1 1 
ATOM   3506 C  CG2  . ILE   A 1 233 ? -12.68  11.396  -31.605 1   53.63  ? 923  ILE   A CG2  1 1 
ATOM   3507 C  CD1  . ILE   A 1 233 ? -14.242 14.135  -31.108 1   54.95  ? 923  ILE   A CD1  1 1 
ATOM   3508 H  H    . ILE   A 1 233 ? -16.643 10.948  -31.412 0   69.7   ? 923  ILE   A H    1 1 
ATOM   3509 H  HA   . ILE   A 1 233 ? -14.857 12.279  -33.201 0   65.23  ? 923  ILE   A HA   1 1 
ATOM   3510 H  HB   . ILE   A 1 233 ? -14.44  10.601  -30.722 0   64.69  ? 923  ILE   A HB   1 1 
ATOM   3511 H  HG12 . ILE   A 1 233 ? -15.639 12.723  -30.321 0   67.14  ? 923  ILE   A HG12 1 1 
ATOM   3512 H  HG13 . ILE   A 1 233 ? -14.045 12.678  -29.553 0   63.86  ? 923  ILE   A HG13 1 1 
ATOM   3513 H  HG21 . ILE   A 1 233 ? -12.146 11.881  -30.79  0   60.58  ? 923  ILE   A HG21 1 1 
ATOM   3514 H  HG22 . ILE   A 1 233 ? -12.379 10.35   -31.656 0   61.85  ? 923  ILE   A HG22 1 1 
ATOM   3515 H  HG23 . ILE   A 1 233 ? -12.453 11.896  -32.546 0   61.14  ? 923  ILE   A HG23 1 1 
ATOM   3516 H  HD11 . ILE   A 1 233 ? -14.562 14.894  -30.397 0   65.91  ? 923  ILE   A HD11 1 1 
ATOM   3517 H  HD12 . ILE   A 1 233 ? -13.171 14.233  -31.277 0   63.35  ? 923  ILE   A HD12 1 1 
ATOM   3518 H  HD13 . ILE   A 1 233 ? -14.783 14.28   -32.042 0   66.54  ? 923  ILE   A HD13 1 1 
ATOM   3519 N  N    . SER   A 1 234 ? -14.939 8.962   -33.264 1   51.68  ? 924  SER   A N    1 1 
ATOM   3520 C  CA   . SER   A 1 234 ? -14.537 7.813   -34.078 1   51.7   ? 924  SER   A CA   1 1 
ATOM   3521 C  C    . SER   A 1 234 ? -14.947 7.991   -35.551 1   51.47  ? 924  SER   A C    1 1 
ATOM   3522 O  O    . SER   A 1 234 ? -14.133 7.749   -36.438 1   51.59  ? 924  SER   A O    1 1 
ATOM   3523 C  CB   . SER   A 1 234 ? -15.136 6.528   -33.513 1   53.17  ? 924  SER   A CB   1 1 
ATOM   3524 O  OG   . SER   A 1 234 ? -16.553 6.588   -33.461 1   55.69  ? 924  SER   A OG   1 1 
ATOM   3525 H  H    . SER   A 1 234 ? -15.54  8.716   -32.484 0   66.89  ? 924  SER   A H    1 1 
ATOM   3526 H  HA   . SER   A 1 234 ? -13.452 7.722   -34.043 0   64.1   ? 924  SER   A HA   1 1 
ATOM   3527 H  HB2  . SER   A 1 234 ? -14.841 5.695   -34.149 0   70.23  ? 924  SER   A HB2  1 1 
ATOM   3528 H  HB3  . SER   A 1 234 ? -14.753 6.377   -32.504 0   68.61  ? 924  SER   A HB3  1 1 
ATOM   3529 H  HG   . SER   A 1 234 ? -16.915 5.759   -33.053 0   76.51  ? 924  SER   A HG   1 1 
ATOM   3530 N  N    . SER   A 1 235 ? -16.184 8.457   -35.802 1   51     ? 925  SER   A N    1 1 
ATOM   3531 C  CA   . SER   A 1 235 ? -16.687 8.71    -37.153 1   50.95  ? 925  SER   A CA   1 1 
ATOM   3532 C  C    . SER   A 1 235 ? -15.958 9.889   -37.818 1   50.45  ? 925  SER   A C    1 1 
ATOM   3533 O  O    . SER   A 1 235 ? -15.722 9.86    -39.027 1   50.67  ? 925  SER   A O    1 1 
ATOM   3534 C  CB   . SER   A 1 235 ? -18.19  8.979   -37.119 1   52.47  ? 925  SER   A CB   1 1 
ATOM   3535 O  OG   . SER   A 1 235 ? -18.501 10.226  -36.518 1   54.84  ? 925  SER   A OG   1 1 
ATOM   3536 H  H    . SER   A 1 235 ? -16.869 8.662   -35.082 0   70.02  ? 925  SER   A H    1 1 
ATOM   3537 H  HA   . SER   A 1 235 ? -16.519 7.824   -37.763 0   71.19  ? 925  SER   A HA   1 1 
ATOM   3538 H  HB2  . SER   A 1 235 ? -18.567 8.979   -38.141 0   76.79  ? 925  SER   A HB2  1 1 
ATOM   3539 H  HB3  . SER   A 1 235 ? -18.675 8.187   -36.55  0   76.88  ? 925  SER   A HB3  1 1 
ATOM   3540 H  HG   . SER   A 1 235 ? -18.131 10.28   -35.598 0   75.26  ? 925  SER   A HG   1 1 
ATOM   3541 N  N    . ILE   A 1 236 ? -15.619 10.924  -37.033 1   49.58  ? 926  ILE   A N    1 1 
ATOM   3542 C  CA   . ILE   A 1 236 ? -14.879 12.105  -37.505 1   49.31  ? 926  ILE   A CA   1 1 
ATOM   3543 C  C    . ILE   A 1 236 ? -13.454 11.694  -37.94  1   48.52  ? 926  ILE   A C    1 1 
ATOM   3544 O  O    . ILE   A 1 236 ? -12.984 12.137  -38.988 1   48.62  ? 926  ILE   A O    1 1 
ATOM   3545 C  CB   . ILE   A 1 236 ? -14.908 13.284  -36.424 1   50     ? 926  ILE   A CB   1 1 
ATOM   3546 C  CG1  . ILE   A 1 236 ? -16.073 14.272  -36.726 1   51.06  ? 926  ILE   A CG1  1 1 
ATOM   3547 C  CG2  . ILE   A 1 236 ? -13.571 14.062  -36.314 1   50.47  ? 926  ILE   A CG2  1 1 
ATOM   3548 C  CD1  . ILE   A 1 236 ? -16.57  15.074  -35.589 1   52.51  ? 926  ILE   A CD1  1 1 
ATOM   3549 H  H    . ILE   A 1 236 ? -15.869 10.981  -36.051 0   65.46  ? 926  ILE   A H    1 1 
ATOM   3550 H  HA   . ILE   A 1 236 ? -15.379 12.436  -38.415 0   64.51  ? 926  ILE   A HA   1 1 
ATOM   3551 H  HB   . ILE   A 1 236 ? -15.067 12.884  -35.423 0   63.25  ? 926  ILE   A HB   1 1 
ATOM   3552 H  HG12 . ILE   A 1 236 ? -15.74  14.97   -37.493 0   66.15  ? 926  ILE   A HG12 1 1 
ATOM   3553 H  HG13 . ILE   A 1 236 ? -16.92  13.7    -37.102 0   68.69  ? 926  ILE   A HG13 1 1 
ATOM   3554 H  HG21 . ILE   A 1 236 ? -13.648 14.793  -35.511 0   60.73  ? 926  ILE   A HG21 1 1 
ATOM   3555 H  HG22 . ILE   A 1 236 ? -12.754 13.381  -36.079 0   59.47  ? 926  ILE   A HG22 1 1 
ATOM   3556 H  HG23 . ILE   A 1 236 ? -13.383 14.582  -37.25  0   60.76  ? 926  ILE   A HG23 1 1 
ATOM   3557 H  HD11 . ILE   A 1 236 ? -17.466 15.608  -35.902 0   70.64  ? 926  ILE   A HD11 1 1 
ATOM   3558 H  HD12 . ILE   A 1 236 ? -16.807 14.396  -34.771 0   69.29  ? 926  ILE   A HD12 1 1 
ATOM   3559 H  HD13 . ILE   A 1 236 ? -15.808 15.788  -35.281 0   66.83  ? 926  ILE   A HD13 1 1 
ATOM   3560 N  N    . LEU   A 1 237 ? -12.786 10.834  -37.16  1   47.67  ? 927  LEU   A N    1 1 
ATOM   3561 C  CA   . LEU   A 1 237 ? -11.432 10.388  -37.49  1   47.43  ? 927  LEU   A CA   1 1 
ATOM   3562 C  C    . LEU   A 1 237 ? -11.433 9.411   -38.669 1   47.36  ? 927  LEU   A C    1 1 
ATOM   3563 O  O    . LEU   A 1 237 ? -10.476 9.407   -39.444 1   47.4   ? 927  LEU   A O    1 1 
ATOM   3564 C  CB   . LEU   A 1 237 ? -10.732 9.769   -36.265 1   47.38  ? 927  LEU   A CB   1 1 
ATOM   3565 C  CG   . LEU   A 1 237 ? -10.519 10.684  -35.042 1   48.43  ? 927  LEU   A CG   1 1 
ATOM   3566 C  CD1  . LEU   A 1 237 ? -10.093 9.875   -33.832 1   48.82  ? 927  LEU   A CD1  1 1 
ATOM   3567 C  CD2  . LEU   A 1 237 ? -9.513  11.8    -35.33  1   49.04  ? 927  LEU   A CD2  1 1 
ATOM   3568 H  H    . LEU   A 1 237 ? -13.161 10.422  -36.312 0   58.69  ? 927  LEU   A H    1 1 
ATOM   3569 H  HA   . LEU   A 1 237 ? -10.851 11.252  -37.811 0   54.89  ? 927  LEU   A HA   1 1 
ATOM   3570 H  HB2  . LEU   A 1 237 ? -11.338 8.928   -35.933 0   56.16  ? 927  LEU   A HB2  1 1 
ATOM   3571 H  HB3  . LEU   A 1 237 ? -9.754  9.407   -36.577 0   53.84  ? 927  LEU   A HB3  1 1 
ATOM   3572 H  HG   . LEU   A 1 237 ? -11.466 11.159  -34.791 0   55.61  ? 927  LEU   A HG   1 1 
ATOM   3573 H  HD11 . LEU   A 1 237 ? -9.979  10.542  -32.979 0   53.39  ? 927  LEU   A HD11 1 1 
ATOM   3574 H  HD12 . LEU   A 1 237 ? -10.856 9.129   -33.616 0   55.74  ? 927  LEU   A HD12 1 1 
ATOM   3575 H  HD13 . LEU   A 1 237 ? -9.145  9.386   -34.05  0   53.38  ? 927  LEU   A HD13 1 1 
ATOM   3576 H  HD21 . LEU   A 1 237 ? -9.205  12.261  -34.393 0   52.56  ? 927  LEU   A HD21 1 1 
ATOM   3577 H  HD22 . LEU   A 1 237 ? -8.647  11.377  -35.838 0   52.33  ? 927  LEU   A HD22 1 1 
ATOM   3578 H  HD23 . LEU   A 1 237 ? -9.98   12.554  -35.961 0   53.86  ? 927  LEU   A HD23 1 1 
ATOM   3579 N  N    . GLU   A 1 238 ? -12.502 8.603   -38.827 1   47.04  ? 928  GLU   A N    1 1 
ATOM   3580 C  CA   . GLU   A 1 238 ? -12.627 7.688   -39.972 1   47.21  ? 928  GLU   A CA   1 1 
ATOM   3581 C  C    . GLU   A 1 238 ? -12.868 8.465   -41.284 1   46.78  ? 928  GLU   A C    1 1 
ATOM   3582 O  O    . GLU   A 1 238 ? -12.464 7.994   -42.346 1   47.01  ? 928  GLU   A O    1 1 
ATOM   3583 C  CB   . GLU   A 1 238 ? -13.751 6.658   -39.741 1   49.54  ? 928  GLU   A CB   1 1 
ATOM   3584 C  CG   . GLU   A 1 238 ? -13.383 5.577   -38.736 1   54.69  ? 928  GLU   A CG   1 1 
ATOM   3585 C  CD   . GLU   A 1 238 ? -14.511 4.682   -38.262 1   61.4   ? 928  GLU   A CD   1 1 
ATOM   3586 O  OE1  . GLU   A 1 238 ? -15.689 4.974   -38.571 1   63.05  ? 928  GLU   A OE1  1 1 
ATOM   3587 O  OE2  . GLU   A 1 238 ? -14.211 3.685   -37.568 1   63.71  ? 928  GLU   A OE2  1 1 
ATOM   3588 H  H    . GLU   A 1 238 ? -13.279 8.55    -38.176 0   60.52  ? 928  GLU   A H    1 1 
ATOM   3589 H  HA   . GLU   A 1 238 ? -11.689 7.148   -40.091 0   60.47  ? 928  GLU   A HA   1 1 
ATOM   3590 H  HB2  . GLU   A 1 238 ? -14.64  7.178   -39.387 0   67.58  ? 928  GLU   A HB2  1 1 
ATOM   3591 H  HB3  . GLU   A 1 238 ? -13.969 6.166   -40.688 0   68.28  ? 928  GLU   A HB3  1 1 
ATOM   3592 H  HG2  . GLU   A 1 238 ? -12.627 4.935   -39.185 0   71.4   ? 928  GLU   A HG2  1 1 
ATOM   3593 H  HG3  . GLU   A 1 238 ? -12.966 6.062   -37.855 0   69.77  ? 928  GLU   A HG3  1 1 
ATOM   3594 N  N    . LYS   A 1 239 ? -13.486 9.662   -41.211 1   46.18  ? 929  LYS   A N    1 1 
ATOM   3595 C  CA   . LYS   A 1 239 ? -13.715 10.521  -42.379 1   45.94  ? 929  LYS   A CA   1 1 
ATOM   3596 C  C    . LYS   A 1 239 ? -12.434 11.312  -42.81  1   45.24  ? 929  LYS   A C    1 1 
ATOM   3597 O  O    . LYS   A 1 239 ? -12.512 12.135  -43.721 1   45.45  ? 929  LYS   A O    1 1 
ATOM   3598 C  CB   . LYS   A 1 239 ? -14.859 11.511  -42.055 1   48.3   ? 929  LYS   A CB   1 1 
ATOM   3599 C  CG   . LYS   A 1 239 ? -15.597 12.075  -43.266 1   53.03  ? 929  LYS   A CG   1 1 
ATOM   3600 C  CD   . LYS   A 1 239 ? -16.765 12.961  -42.855 1   57.76  ? 929  LYS   A CD   1 1 
ATOM   3601 C  CE   . LYS   A 1 239 ? -17.617 13.352  -44.04  1   61.94  ? 929  LYS   A CE   1 1 
ATOM   3602 N  NZ   . LYS   A 1 239 ? -18.84  14.092  -43.627 1   64.61  ? 929  LYS   A NZ   1 1 
ATOM   3603 H  H    . LYS   A 1 239 ? -13.846 10.067  -40.353 0   60.76  ? 929  LYS   A H    1 1 
ATOM   3604 H  HA   . LYS   A 1 239 ? -14.025 9.901   -43.219 0   62.86  ? 929  LYS   A HA   1 1 
ATOM   3605 H  HB2  . LYS   A 1 239 ? -15.603 11.002  -41.443 0   66.3   ? 929  LYS   A HB2  1 1 
ATOM   3606 H  HB3  . LYS   A 1 239 ? -14.446 12.353  -41.502 0   63.34  ? 929  LYS   A HB3  1 1 
ATOM   3607 H  HG2  . LYS   A 1 239 ? -14.907 12.677  -43.856 0   70.37  ? 929  LYS   A HG2  1 1 
ATOM   3608 H  HG3  . LYS   A 1 239 ? -15.984 11.252  -43.865 0   73.29  ? 929  LYS   A HG3  1 1 
ATOM   3609 H  HD2  . LYS   A 1 239 ? -17.392 12.419  -42.149 0   79.42  ? 929  LYS   A HD2  1 1 
ATOM   3610 H  HD3  . LYS   A 1 239 ? -16.38  13.871  -42.397 0   76.81  ? 929  LYS   A HD3  1 1 
ATOM   3611 H  HE2  . LYS   A 1 239 ? -17.036 13.999  -44.697 0   83.83  ? 929  LYS   A HE2  1 1 
ATOM   3612 H  HE3  . LYS   A 1 239 ? -17.925 12.454  -44.573 0   86.32  ? 929  LYS   A HE3  1 1 
ATOM   3613 H  HZ1  . LYS   A 1 239 ? -19.463 14.206  -44.421 0   92.58  ? 929  LYS   A HZ1  1 1 
ATOM   3614 H  HZ2  . LYS   A 1 239 ? -19.325 13.582  -42.896 0   90.16  ? 929  LYS   A HZ2  1 1 
ATOM   3615 H  HZ3  . LYS   A 1 239 ? -18.583 15.01   -43.278 0   89.6   ? 929  LYS   A HZ3  1 1 
ATOM   3616 N  N    . GLY   A 1 240 ? -11.285 11.062  -42.168 1   44.02  ? 930  GLY   A N    1 1 
ATOM   3617 C  CA   . GLY   A 1 240 ? -10.034 11.745  -42.48  1   43.37  ? 930  GLY   A CA   1 1 
ATOM   3618 C  C    . GLY   A 1 240 ? -9.836  13.084  -41.789 1   42.38  ? 930  GLY   A C    1 1 
ATOM   3619 O  O    . GLY   A 1 240 ? -8.8    13.723  -41.989 1   42.54  ? 930  GLY   A O    1 1 
ATOM   3620 H  H    . GLY   A 1 240 ? -11.171 10.385  -41.421 0   54.6   ? 930  GLY   A H    1 1 
ATOM   3621 H  HA2  . GLY   A 1 240 ? -9.208  11.1    -42.184 0   51.2   ? 930  GLY   A HA2  1 1 
ATOM   3622 H  HA3  . GLY   A 1 240 ? -9.957  11.902  -43.554 0   52.68  ? 930  GLY   A HA3  1 1 
ATOM   3623 N  N    . GLU   A 1 241 ? -10.804 13.523  -40.965 1   41.32  ? 931  GLU   A N    1 1 
ATOM   3624 C  CA   . GLU   A 1 241 ? -10.72  14.808  -40.272 1   40.76  ? 931  GLU   A CA   1 1 
ATOM   3625 C  C    . GLU   A 1 241 ? -9.777  14.744  -39.071 1   39.37  ? 931  GLU   A C    1 1 
ATOM   3626 O  O    . GLU   A 1 241 ? -9.752  13.744  -38.354 1   39.14  ? 931  GLU   A O    1 1 
ATOM   3627 C  CB   . GLU   A 1 241 ? -12.114 15.257  -39.795 1   43.49  ? 931  GLU   A CB   1 1 
ATOM   3628 C  CG   . GLU   A 1 241 ? -13.018 15.803  -40.883 1   49.13  ? 931  GLU   A CG   1 1 
ATOM   3629 C  CD   . GLU   A 1 241 ? -14.358 16.285  -40.363 1   56.96  ? 931  GLU   A CD   1 1 
ATOM   3630 O  OE1  . GLU   A 1 241 ? -15.397 15.883  -40.933 1   58.95  ? 931  GLU   A OE1  1 1 
ATOM   3631 O  OE2  . GLU   A 1 241 ? -14.37  17.056  -39.376 1   59.72  ? 931  GLU   A OE2  1 1 
ATOM   3632 H  H    . GLU   A 1 241 ? -11.654 13.012  -40.753 0   50.8   ? 931  GLU   A H    1 1 
ATOM   3633 H  HA   . GLU   A 1 241 ? -10.34  15.56   -40.961 0   47.77  ? 931  GLU   A HA   1 1 
ATOM   3634 H  HB2  . GLU   A 1 241 ? -12.624 14.395  -39.368 0   53.4   ? 931  GLU   A HB2  1 1 
ATOM   3635 H  HB3  . GLU   A 1 241 ? -11.986 16.029  -39.038 0   52.08  ? 931  GLU   A HB3  1 1 
ATOM   3636 H  HG2  . GLU   A 1 241 ? -12.523 16.647  -41.362 0   59.74  ? 931  GLU   A HG2  1 1 
ATOM   3637 H  HG3  . GLU   A 1 241 ? -13.205 15.018  -41.614 0   61.17  ? 931  GLU   A HG3  1 1 
ATOM   3638 N  N    . ARG   A 1 242 ? -9.018  15.832  -38.845 1   38.19  ? 932  ARG   A N    1 1 
ATOM   3639 C  CA   . ARG   A 1 242 ? -8.058  15.945  -37.742 1   37.49  ? 932  ARG   A CA   1 1 
ATOM   3640 C  C    . ARG   A 1 242 ? -8.095  17.358  -37.117 1   37.33  ? 932  ARG   A C    1 1 
ATOM   3641 O  O    . ARG   A 1 242 ? -8.757  18.249  -37.653 1   37.49  ? 932  ARG   A O    1 1 
ATOM   3642 C  CB   . ARG   A 1 242 ? -6.629  15.607  -38.238 1   37.52  ? 932  ARG   A CB   1 1 
ATOM   3643 C  CG   . ARG   A 1 242 ? -6.429  14.181  -38.75  1   38.42  ? 932  ARG   A CG   1 1 
ATOM   3644 C  CD   . ARG   A 1 242 ? -6.487  13.124  -37.659 1   39.84  ? 932  ARG   A CD   1 1 
ATOM   3645 N  NE   . ARG   A 1 242 ? -6.154  11.791  -38.161 1   41.4   ? 932  ARG   A NE   1 1 
ATOM   3646 C  CZ   . ARG   A 1 242 ? -6.984  10.964  -38.8   1   43.24  ? 932  ARG   A CZ   1 1 
ATOM   3647 N  NH1  . ARG   A 1 242 ? -8.244  11.323  -39.043 1   42.77  ? 932  ARG   A NH1  1 1 
ATOM   3648 N  NH2  . ARG   A 1 242 ? -6.559  9.776   -39.21  1   43.17  ? 932  ARG   A NH2  1 1 
ATOM   3649 H  H    . ARG   A 1 242 ? -9.053  16.669  -39.417 0   42.71  ? 932  ARG   A H    1 1 
ATOM   3650 H  HA   . ARG   A 1 242 ? -8.327  15.256  -36.943 0   40.06  ? 932  ARG   A HA   1 1 
ATOM   3651 H  HB2  . ARG   A 1 242 ? -6.378  16.285  -39.053 0   38.83  ? 932  ARG   A HB2  1 1 
ATOM   3652 H  HB3  . ARG   A 1 242 ? -5.931  15.754  -37.415 0   37.73  ? 932  ARG   A HB3  1 1 
ATOM   3653 H  HG2  . ARG   A 1 242 ? -7.199  13.945  -39.483 0   41.02  ? 932  ARG   A HG2  1 1 
ATOM   3654 H  HG3  . ARG   A 1 242 ? -5.447  14.116  -39.217 0   39.23  ? 932  ARG   A HG3  1 1 
ATOM   3655 H  HD2  . ARG   A 1 242 ? -5.747  13.377  -36.9   0   40.02  ? 932  ARG   A HD2  1 1 
ATOM   3656 H  HD3  . ARG   A 1 242 ? -7.474  13.092  -37.2   0   41.92  ? 932  ARG   A HD3  1 1 
ATOM   3657 H  HE   . ARG   A 1 242 ? -5.205  11.47   -38.001 0   42.36  ? 932  ARG   A HE   1 1 
ATOM   3658 H  HH11 . ARG   A 1 242 ? -8.627  12.221  -38.767 0   47.15  ? 932  ARG   A HH11 1 1 
ATOM   3659 H  HH12 . ARG   A 1 242 ? -8.853  10.678  -39.535 0   48.76  ? 932  ARG   A HH12 1 1 
ATOM   3660 H  HH21 . ARG   A 1 242 ? -5.604  9.483   -39.032 0   46.29  ? 932  ARG   A HH21 1 1 
ATOM   3661 H  HH22 . ARG   A 1 242 ? -7.189  9.147   -39.697 0   48.46  ? 932  ARG   A HH22 1 1 
ATOM   3662 N  N    . LEU   A 1 243 ? -7.395  17.562  -35.978 1   36.83  ? 933  LEU   A N    1 1 
ATOM   3663 C  CA   . LEU   A 1 243 ? -7.355  18.869  -35.312 1   36.76  ? 933  LEU   A CA   1 1 
ATOM   3664 C  C    . LEU   A 1 243 ? -6.758  19.932  -36.264 1   37.02  ? 933  LEU   A C    1 1 
ATOM   3665 O  O    . LEU   A 1 243 ? -5.894  19.59   -37.078 1   37.04  ? 933  LEU   A O    1 1 
ATOM   3666 C  CB   . LEU   A 1 243 ? -6.541  18.796  -34.004 1   36.7   ? 933  LEU   A CB   1 1 
ATOM   3667 C  CG   . LEU   A 1 243 ? -7.167  17.988  -32.849 1   38.05  ? 933  LEU   A CG   1 1 
ATOM   3668 C  CD1  . LEU   A 1 243 ? -6.119  17.601  -31.812 1   38.62  ? 933  LEU   A CD1  1 1 
ATOM   3669 C  CD2  . LEU   A 1 243 ? -8.304  18.747  -32.186 1   38.59  ? 933  LEU   A CD2  1 1 
ATOM   3670 H  H    . LEU   A 1 243 ? -6.847  16.841  -35.519 0   37.39  ? 933  LEU   A H    1 1 
ATOM   3671 H  HA   . LEU   A 1 243 ? -8.385  19.132  -35.078 0   39.65  ? 933  LEU   A HA   1 1 
ATOM   3672 H  HB2  . LEU   A 1 243 ? -5.574  18.352  -34.236 0   36.14  ? 933  LEU   A HB2  1 1 
ATOM   3673 H  HB3  . LEU   A 1 243 ? -6.387  19.812  -33.644 0   37.46  ? 933  LEU   A HB3  1 1 
ATOM   3674 H  HG   . LEU   A 1 243 ? -7.582  17.065  -33.25  0   38.9   ? 933  LEU   A HG   1 1 
ATOM   3675 H  HD11 . LEU   A 1 243 ? -6.596  17.023  -31.022 0   38.11  ? 933  LEU   A HD11 1 1 
ATOM   3676 H  HD12 . LEU   A 1 243 ? -5.348  17.001  -32.294 0   37.09  ? 933  LEU   A HD12 1 1 
ATOM   3677 H  HD13 . LEU   A 1 243 ? -5.681  18.508  -31.399 0   37.83  ? 933  LEU   A HD13 1 1 
ATOM   3678 H  HD21 . LEU   A 1 243 ? -8.625  18.198  -31.302 0   40.95  ? 933  LEU   A HD21 1 1 
ATOM   3679 H  HD22 . LEU   A 1 243 ? -7.955  19.738  -31.898 0   40.81  ? 933  LEU   A HD22 1 1 
ATOM   3680 H  HD23 . LEU   A 1 243 ? -9.14   18.834  -32.879 0   41.93  ? 933  LEU   A HD23 1 1 
ATOM   3681 N  N    . PRO   A 1 244 ? -7.224  21.203  -36.235 1   37.03  ? 934  PRO   A N    1 1 
ATOM   3682 C  CA   . PRO   A 1 244 ? -6.721  22.184  -37.215 1   37.09  ? 934  PRO   A CA   1 1 
ATOM   3683 C  C    . PRO   A 1 244 ? -5.288  22.667  -37     1   37.34  ? 934  PRO   A C    1 1 
ATOM   3684 O  O    . PRO   A 1 244 ? -4.705  22.427  -35.95  1   37.4   ? 934  PRO   A O    1 1 
ATOM   3685 C  CB   . PRO   A 1 244 ? -7.731  23.328  -37.107 1   37.63  ? 934  PRO   A CB   1 1 
ATOM   3686 C  CG   . PRO   A 1 244 ? -8.23   23.255  -35.722 1   38.07  ? 934  PRO   A CG   1 1 
ATOM   3687 C  CD   . PRO   A 1 244 ? -8.262  21.799  -35.367 1   36.52  ? 934  PRO   A CD   1 1 
ATOM   3688 H  HA   . PRO   A 1 244 ? -6.795  21.77   -38.22  0   40.3   ? 934  PRO   A HA   1 1 
ATOM   3689 H  HB2  . PRO   A 1 244 ? -7.232  24.278  -37.29  0   43.42  ? 934  PRO   A HB2  1 1 
ATOM   3690 H  HB3  . PRO   A 1 244 ? -8.54   23.17   -37.82  0   44     ? 934  PRO   A HB3  1 1 
ATOM   3691 H  HG2  . PRO   A 1 244 ? -7.551  23.793  -35.062 0   43.39  ? 934  PRO   A HG2  1 1 
ATOM   3692 H  HG3  . PRO   A 1 244 ? -9.23   23.684  -35.673 0   45.37  ? 934  PRO   A HG3  1 1 
ATOM   3693 H  HD2  . PRO   A 1 244 ? -8.007  21.672  -34.316 0   40.37  ? 934  PRO   A HD2  1 1 
ATOM   3694 H  HD3  . PRO   A 1 244 ? -9.239  21.375  -35.595 0   41.87  ? 934  PRO   A HD3  1 1 
ATOM   3695 N  N    . GLN   A 1 245 ? -4.717  23.336  -38.019 1   37.38  ? 935  GLN   A N    1 1 
ATOM   3696 C  CA   . GLN   A 1 245 ? -3.357  23.866  -37.956 1   37.86  ? 935  GLN   A CA   1 1 
ATOM   3697 C  C    . GLN   A 1 245 ? -3.307  25.092  -37.035 1   38.61  ? 935  GLN   A C    1 1 
ATOM   3698 O  O    . GLN   A 1 245 ? -3.946  26.09   -37.378 1   38.93  ? 935  GLN   A O    1 1 
ATOM   3699 C  CB   . GLN   A 1 245 ? -2.865  24.254  -39.361 1   38.73  ? 935  GLN   A CB   1 1 
ATOM   3700 C  CG   . GLN   A 1 245 ? -1.443  24.824  -39.378 1   40.91  ? 935  GLN   A CG   1 1 
ATOM   3701 C  CD   . GLN   A 1 245 ? -0.909  25.033  -40.776 1   44.06  ? 935  GLN   A CD   1 1 
ATOM   3702 O  OE1  . GLN   A 1 245 ? -1.664  25.124  -41.75  1   45.29  ? 935  GLN   A OE1  1 1 
ATOM   3703 N  NE2  . GLN   A 1 245 ? 0.409   25.136  -40.908 1   44.06  ? 935  GLN   A NE2  1 1 
ATOM   3704 H  H    . GLN   A 1 245 ? -5.183  23.521  -38.901 0   40.87  ? 935  GLN   A H    1 1 
ATOM   3705 H  HA   . GLN   A 1 245 ? -2.694  23.075  -37.61  0   38.95  ? 935  GLN   A HA   1 1 
ATOM   3706 H  HB2  . GLN   A 1 245 ? -2.872  23.364  -39.988 0   40.89  ? 935  GLN   A HB2  1 1 
ATOM   3707 H  HB3  . GLN   A 1 245 ? -3.534  25.004  -39.779 0   42.68  ? 935  GLN   A HB3  1 1 
ATOM   3708 H  HG2  . GLN   A 1 245 ? -1.433  25.798  -38.89  0   44.42  ? 935  GLN   A HG2  1 1 
ATOM   3709 H  HG3  . GLN   A 1 245 ? -0.777  24.138  -38.857 0   42.53  ? 935  GLN   A HG3  1 1 
ATOM   3710 H  HE21 . GLN   A 1 245 ? 1.017   25.077  -40.098 0   46.67  ? 935  GLN   A HE21 1 1 
ATOM   3711 H  HE22 . GLN   A 1 245 ? 0.811   25.279  -41.829 0   47.53  ? 935  GLN   A HE22 1 1 
ATOM   3712 N  N    . PRO   A 1 246 ? -2.567  25.091  -35.897 1   38.72  ? 936  PRO   A N    1 1 
ATOM   3713 C  CA   . PRO   A 1 246 ? -2.522  26.314  -35.071 1   38.93  ? 936  PRO   A CA   1 1 
ATOM   3714 C  C    . PRO   A 1 246 ? -1.896  27.489  -35.845 1   39.38  ? 936  PRO   A C    1 1 
ATOM   3715 O  O    . PRO   A 1 246 ? -0.943  27.245  -36.585 1   39.54  ? 936  PRO   A O    1 1 
ATOM   3716 C  CB   . PRO   A 1 246 ? -1.672  25.907  -33.862 1   39.48  ? 936  PRO   A CB   1 1 
ATOM   3717 C  CG   . PRO   A 1 246 ? -1.616  24.422  -33.894 1   39.85  ? 936  PRO   A CG   1 1 
ATOM   3718 C  CD   . PRO   A 1 246 ? -1.729  24.023  -35.314 1   38.23  ? 936  PRO   A CD   1 1 
ATOM   3719 H  HA   . PRO   A 1 246 ? -3.531  26.536  -34.729 0   43.94  ? 936  PRO   A HA   1 1 
ATOM   3720 H  HB2  . PRO   A 1 246 ? -0.674  26.33   -33.959 0   42.69  ? 936  PRO   A HB2  1 1 
ATOM   3721 H  HB3  . PRO   A 1 246 ? -2.151  26.255  -32.948 0   43.14  ? 936  PRO   A HB3  1 1 
ATOM   3722 H  HG2  . PRO   A 1 246 ? -0.665  24.087  -33.482 0   40.38  ? 936  PRO   A HG2  1 1 
ATOM   3723 H  HG3  . PRO   A 1 246 ? -2.447  23.997  -33.334 0   41.01  ? 936  PRO   A HG3  1 1 
ATOM   3724 H  HD2  . PRO   A 1 246 ? -0.747  24.003  -35.784 0   38.94  ? 936  PRO   A HD2  1 1 
ATOM   3725 H  HD3  . PRO   A 1 246 ? -2.219  23.052  -35.357 0   38.59  ? 936  PRO   A HD3  1 1 
ATOM   3726 N  N    . PRO   A 1 247 ? -2.39   28.752  -35.741 1   39.39  ? 937  PRO   A N    1 1 
ATOM   3727 C  CA   . PRO   A 1 247 ? -1.789  29.843  -36.544 1   39.35  ? 937  PRO   A CA   1 1 
ATOM   3728 C  C    . PRO   A 1 247 ? -0.28   30.077  -36.416 1   39.2   ? 937  PRO   A C    1 1 
ATOM   3729 O  O    . PRO   A 1 247 ? 0.328   30.589  -37.356 1   39.37  ? 937  PRO   A O    1 1 
ATOM   3730 C  CB   . PRO   A 1 247 ? -2.55   31.086  -36.081 1   40.04  ? 937  PRO   A CB   1 1 
ATOM   3731 C  CG   . PRO   A 1 247 ? -3.811  30.589  -35.531 1   40.46  ? 937  PRO   A CG   1 1 
ATOM   3732 C  CD   . PRO   A 1 247 ? -3.538  29.244  -34.952 1   38.84  ? 937  PRO   A CD   1 1 
ATOM   3733 H  HA   . PRO   A 1 247 ? -2.016  29.682  -37.597 0   47.99  ? 937  PRO   A HA   1 1 
ATOM   3734 H  HB2  . PRO   A 1 247 ? -1.974  31.6    -35.313 0   52.17  ? 937  PRO   A HB2  1 1 
ATOM   3735 H  HB3  . PRO   A 1 247 ? -2.732  31.74   -36.932 0   52.82  ? 937  PRO   A HB3  1 1 
ATOM   3736 H  HG2  . PRO   A 1 247 ? -4.157  31.27   -34.755 0   53.23  ? 937  PRO   A HG2  1 1 
ATOM   3737 H  HG3  . PRO   A 1 247 ? -4.55   30.516  -36.327 0   52.2   ? 937  PRO   A HG3  1 1 
ATOM   3738 H  HD2  . PRO   A 1 247 ? -3.273  29.329  -33.899 0   47.6   ? 937  PRO   A HD2  1 1 
ATOM   3739 H  HD3  . PRO   A 1 247 ? -4.421  28.623  -35.097 0   47.21  ? 937  PRO   A HD3  1 1 
ATOM   3740 N  N    . ILE   A 1 248 ? 0.319   29.733  -35.271 1   38.77  ? 938  ILE   A N    1 1 
ATOM   3741 C  CA   . ILE   A 1 248 ? 1.762   29.928  -35.055 1   38.87  ? 938  ILE   A CA   1 1 
ATOM   3742 C  C    . ILE   A 1 248 ? 2.631   28.819  -35.683 1   38.85  ? 938  ILE   A C    1 1 
ATOM   3743 O  O    . ILE   A 1 248 ? 3.845   28.988  -35.767 1   38.9   ? 938  ILE   A O    1 1 
ATOM   3744 C  CB   . ILE   A 1 248 ? 2.112   30.12   -33.546 1   39.24  ? 938  ILE   A CB   1 1 
ATOM   3745 C  CG1  . ILE   A 1 248 ? 1.841   28.837  -32.699 1   40.2   ? 938  ILE   A CG1  1 1 
ATOM   3746 C  CG2  . ILE   A 1 248 ? 1.374   31.342  -32.968 1   39.59  ? 938  ILE   A CG2  1 1 
ATOM   3747 C  CD1  . ILE   A 1 248 ? 2.732   28.671  -31.465 1   41.46  ? 938  ILE   A CD1  1 1 
ATOM   3748 H  H    . ILE   A 1 248 ? -0.177  29.308  -34.495 0   46.19  ? 938  ILE   A H    1 1 
ATOM   3749 H  HA   . ILE   A 1 248 ? 2.055   30.857  -35.541 0   48.72  ? 938  ILE   A HA   1 1 
ATOM   3750 H  HB   . ILE   A 1 248 ? 3.179   30.335  -33.499 0   48.28  ? 938  ILE   A HB   1 1 
ATOM   3751 H  HG12 . ILE   A 1 248 ? 0.812   28.875  -32.344 0   46.76  ? 938  ILE   A HG12 1 1 
ATOM   3752 H  HG13 . ILE   A 1 248 ? 1.971   27.944  -33.308 0   45.32  ? 938  ILE   A HG13 1 1 
ATOM   3753 H  HG21 . ILE   A 1 248 ? 1.694   31.507  -31.94  0   50.77  ? 938  ILE   A HG21 1 1 
ATOM   3754 H  HG22 . ILE   A 1 248 ? 1.611   32.215  -33.574 0   52.11  ? 938  ILE   A HG22 1 1 
ATOM   3755 H  HG23 . ILE   A 1 248 ? 0.301   31.158  -32.987 0   50.27  ? 938  ILE   A HG23 1 1 
ATOM   3756 H  HD11 . ILE   A 1 248 ? 2.49    27.726  -30.98  0   46.43  ? 938  ILE   A HD11 1 1 
ATOM   3757 H  HD12 . ILE   A 1 248 ? 3.775   28.67   -31.78  0   47.95  ? 938  ILE   A HD12 1 1 
ATOM   3758 H  HD13 . ILE   A 1 248 ? 2.553   29.495  -30.777 0   49.33  ? 938  ILE   A HD13 1 1 
ATOM   3759 N  N    . CYS   A 1 249 ? 2.031   27.69   -36.102 1   38.6   ? 939  CYS   A N    1 1 
ATOM   3760 C  CA   . CYS   A 1 249 ? 2.776   26.556  -36.641 1   38.65  ? 939  CYS   A CA   1 1 
ATOM   3761 C  C    . CYS   A 1 249 ? 3.076   26.641  -38.114 1   38.39  ? 939  CYS   A C    1 1 
ATOM   3762 O  O    . CYS   A 1 249 ? 2.158   26.822  -38.911 1   38.68  ? 939  CYS   A O    1 1 
ATOM   3763 C  CB   . CYS   A 1 249 ? 2.045   25.255  -36.329 1   39.37  ? 939  CYS   A CB   1 1 
ATOM   3764 S  SG   . CYS   A 1 249 ? 1.996   24.844  -34.572 1   42.35  ? 939  CYS   A SG   1 1 
ATOM   3765 H  H    . CYS   A 1 249 ? 1.03    27.525  -36.082 0   43.24  ? 939  CYS   A H    1 1 
ATOM   3766 H  HA   . CYS   A 1 249 ? 3.727   26.493  -36.114 0   42.29  ? 939  CYS   A HA   1 1 
ATOM   3767 H  HB2  . CYS   A 1 249 ? 1.02    25.32   -36.689 0   41.36  ? 939  CYS   A HB2  1 1 
ATOM   3768 H  HB3  . CYS   A 1 249 ? 2.556   24.441  -36.841 0   40.49  ? 939  CYS   A HB3  1 1 
ATOM   3769 H  HG   . CYS   A 1 249 ? 3.248   24.703  -34.121 0   43.49  ? 939  CYS   A HG   1 1 
ATOM   3770 N  N    . THR   A 1 250 ? 4.34    26.389  -38.493 1   37.73  ? 940  THR   A N    1 1 
ATOM   3771 C  CA   . THR   A 1 250 ? 4.706   26.275  -39.904 1   37.56  ? 940  THR   A CA   1 1 
ATOM   3772 C  C    . THR   A 1 250 ? 4.321   24.839  -40.342 1   37.23  ? 940  THR   A C    1 1 
ATOM   3773 O  O    . THR   A 1 250 ? 4.009   23.989  -39.501 1   37.25  ? 940  THR   A O    1 1 
ATOM   3774 C  CB   . THR   A 1 250 ? 6.203   26.574  -40.144 1   38.65  ? 940  THR   A CB   1 1 
ATOM   3775 O  OG1  . THR   A 1 250 ? 7.008   25.659  -39.4   1   39.59  ? 940  THR   A OG1  1 1 
ATOM   3776 C  CG2  . THR   A 1 250 ? 6.579   28.021  -39.832 1   38.94  ? 940  THR   A CG2  1 1 
ATOM   3777 H  H    . THR   A 1 250 ? 5.116   26.241  -37.856 0   41.79  ? 940  THR   A H    1 1 
ATOM   3778 H  HA   . THR   A 1 250 ? 4.133   26.983  -40.5   0   42.91  ? 940  THR   A HA   1 1 
ATOM   3779 H  HB   . THR   A 1 250 ? 6.407   26.418  -41.202 0   44.58  ? 940  THR   A HB   1 1 
ATOM   3780 H  HG1  . THR   A 1 250 ? 7.052   25.932  -38.446 0   44.52  ? 940  THR   A HG1  1 1 
ATOM   3781 H  HG21 . THR   A 1 250 ? 7.637   28.179  -40.033 0   47.49  ? 940  THR   A HG21 1 1 
ATOM   3782 H  HG22 . THR   A 1 250 ? 5.997   28.701  -40.454 0   47.28  ? 940  THR   A HG22 1 1 
ATOM   3783 H  HG23 . THR   A 1 250 ? 6.382   28.242  -38.784 0   46.42  ? 940  THR   A HG23 1 1 
ATOM   3784 N  N    . ILE   A 1 251 ? 4.321   24.572  -41.653 1   36.76  ? 941  ILE   A N    1 1 
ATOM   3785 C  CA   . ILE   A 1 251 ? 3.948   23.254  -42.169 1   36.6   ? 941  ILE   A CA   1 1 
ATOM   3786 C  C    . ILE   A 1 251 ? 4.753   22.091  -41.534 1   36.46  ? 941  ILE   A C    1 1 
ATOM   3787 O  O    . ILE   A 1 251 ? 4.179   21.036  -41.278 1   36.42  ? 941  ILE   A O    1 1 
ATOM   3788 C  CB   . ILE   A 1 251 ? 4.004   23.224  -43.73  1   36.95  ? 941  ILE   A CB   1 1 
ATOM   3789 C  CG1  . ILE   A 1 251 ? 3.337   21.955  -44.31  1   37.63  ? 941  ILE   A CG1  1 1 
ATOM   3790 C  CG2  . ILE   A 1 251 ? 5.436   23.359  -44.266 1   37.35  ? 941  ILE   A CG2  1 1 
ATOM   3791 C  CD1  . ILE   A 1 251 ? 1.875   21.667  -43.849 1   38.63  ? 941  ILE   A CD1  1 1 
ATOM   3792 H  H    . ILE   A 1 251 ? 4.533   25.265  -42.364 0   41.02  ? 941  ILE   A H    1 1 
ATOM   3793 H  HA   . ILE   A 1 251 ? 2.914   23.111  -41.86  0   38.3   ? 941  ILE   A HA   1 1 
ATOM   3794 H  HB   . ILE   A 1 251 ? 3.437   24.081  -44.093 0   40.62  ? 941  ILE   A HB   1 1 
ATOM   3795 H  HG12 . ILE   A 1 251 ? 3.312   22.06   -45.393 0   40.66  ? 941  ILE   A HG12 1 1 
ATOM   3796 H  HG13 . ILE   A 1 251 ? 3.943   21.088  -44.053 0   39.54  ? 941  ILE   A HG13 1 1 
ATOM   3797 H  HG21 . ILE   A 1 251 ? 5.391   23.475  -45.348 0   41.93  ? 941  ILE   A HG21 1 1 
ATOM   3798 H  HG22 . ILE   A 1 251 ? 5.909   24.235  -43.824 0   42.1   ? 941  ILE   A HG22 1 1 
ATOM   3799 H  HG23 . ILE   A 1 251 ? 6.006   22.464  -44.022 0   40.88  ? 941  ILE   A HG23 1 1 
ATOM   3800 H  HD11 . ILE   A 1 251 ? 1.429   20.946  -44.532 0   40.12  ? 941  ILE   A HD11 1 1 
ATOM   3801 H  HD12 . ILE   A 1 251 ? 1.885   21.244  -42.846 0   39.65  ? 941  ILE   A HD12 1 1 
ATOM   3802 H  HD13 . ILE   A 1 251 ? 1.308   22.596  -43.858 0   40.93  ? 941  ILE   A HD13 1 1 
ATOM   3803 N  N    . ASP   A 1 252 ? 6.047   22.288  -41.248 1   36.28  ? 942  ASP   A N    1 1 
ATOM   3804 C  CA   . ASP   A 1 252 ? 6.887   21.251  -40.647 1   36.48  ? 942  ASP   A CA   1 1 
ATOM   3805 C  C    . ASP   A 1 252 ? 6.406   20.812  -39.26  1   35.93  ? 942  ASP   A C    1 1 
ATOM   3806 O  O    . ASP   A 1 252 ? 6.492   19.627  -38.942 1   36.06  ? 942  ASP   A O    1 1 
ATOM   3807 C  CB   . ASP   A 1 252 ? 8.34    21.736  -40.551 1   38.94  ? 942  ASP   A CB   1 1 
ATOM   3808 C  CG   . ASP   A 1 252 ? 9.028   21.846  -41.889 1   44.68  ? 942  ASP   A CG   1 1 
ATOM   3809 O  OD1  . ASP   A 1 252 ? 9.271   22.99   -42.338 1   45.86  ? 942  ASP   A OD1  1 1 
ATOM   3810 O  OD2  . ASP   A 1 252 ? 9.325   20.79   -42.492 1   47.05  ? 942  ASP   A OD2  1 1 
ATOM   3811 H  H    . ASP   A 1 252 ? 6.54    23.157  -41.424 0   39.31  ? 942  ASP   A H    1 1 
ATOM   3812 H  HA   . ASP   A 1 252 ? 6.873   20.375  -41.294 0   37.98  ? 942  ASP   A HA   1 1 
ATOM   3813 H  HB2  . ASP   A 1 252 ? 8.362   22.716  -40.077 0   42.36  ? 942  ASP   A HB2  1 1 
ATOM   3814 H  HB3  . ASP   A 1 252 ? 8.905   21.026  -39.948 0   41.77  ? 942  ASP   A HB3  1 1 
ATOM   3815 N  N    . VAL   A 1 253 ? 5.904   21.751  -38.44  1   34.99  ? 943  VAL   A N    1 1 
ATOM   3816 C  CA   . VAL   A 1 253 ? 5.432   21.433  -37.089 1   34.5   ? 943  VAL   A CA   1 1 
ATOM   3817 C  C    . VAL   A 1 253 ? 4.074   20.737  -37.172 1   33.54  ? 943  VAL   A C    1 1 
ATOM   3818 O  O    . VAL   A 1 253 ? 3.855   19.74   -36.483 1   33.61  ? 943  VAL   A O    1 1 
ATOM   3819 C  CB   . VAL   A 1 253 ? 5.395   22.691  -36.18  1   35.2   ? 943  VAL   A CB   1 1 
ATOM   3820 C  CG1  . VAL   A 1 253 ? 4.818   22.364  -34.801 1   35.7   ? 943  VAL   A CG1  1 1 
ATOM   3821 C  CG2  . VAL   A 1 253 ? 6.79    23.303  -36.048 1   35.7   ? 943  VAL   A CG2  1 1 
ATOM   3822 H  H    . VAL   A 1 253 ? 5.788   22.726  -38.694 0   36.21  ? 943  VAL   A H    1 1 
ATOM   3823 H  HA   . VAL   A 1 253 ? 6.13    20.738  -36.625 0   33.9   ? 943  VAL   A HA   1 1 
ATOM   3824 H  HB   . VAL   A 1 253 ? 4.748   23.434  -36.642 0   35.89  ? 943  VAL   A HB   1 1 
ATOM   3825 H  HG11 . VAL   A 1 253 ? 5.052   23.171  -34.108 0   35.82  ? 943  VAL   A HG11 1 1 
ATOM   3826 H  HG12 . VAL   A 1 253 ? 3.736   22.267  -34.875 0   34.53  ? 943  VAL   A HG12 1 1 
ATOM   3827 H  HG13 . VAL   A 1 253 ? 5.252   21.43   -34.446 0   34.75  ? 943  VAL   A HG13 1 1 
ATOM   3828 H  HG21 . VAL   A 1 253 ? 6.759   24.126  -35.336 0   37.88  ? 943  VAL   A HG21 1 1 
ATOM   3829 H  HG22 . VAL   A 1 253 ? 7.486   22.538  -35.709 0   36.96  ? 943  VAL   A HG22 1 1 
ATOM   3830 H  HG23 . VAL   A 1 253 ? 7.098   23.681  -37.022 0   37.95  ? 943  VAL   A HG23 1 1 
ATOM   3831 N  N    . TYR   A 1 254 ? 3.173   21.242  -38.025 1   32.66  ? 944  TYR   A N    1 1 
ATOM   3832 C  CA   . TYR   A 1 254 ? 1.854   20.641  -38.19  1   32.33  ? 944  TYR   A CA   1 1 
ATOM   3833 C  C    . TYR   A 1 254 ? 1.922   19.238  -38.805 1   31.86  ? 944  TYR   A C    1 1 
ATOM   3834 O  O    . TYR   A 1 254 ? 1.141   18.373  -38.405 1   31.88  ? 944  TYR   A O    1 1 
ATOM   3835 C  CB   . TYR   A 1 254 ? 0.927   21.561  -38.996 1   32.12  ? 944  TYR   A CB   1 1 
ATOM   3836 C  CG   . TYR   A 1 254 ? -0.494  21.046  -39.101 1   32.72  ? 944  TYR   A CG   1 1 
ATOM   3837 C  CD1  . TYR   A 1 254 ? -1.272  20.854  -37.966 1   33.44  ? 944  TYR   A CD1  1 1 
ATOM   3838 C  CD2  . TYR   A 1 254 ? -1.069  20.779  -40.334 1   33.5   ? 944  TYR   A CD2  1 1 
ATOM   3839 C  CE1  . TYR   A 1 254 ? -2.569  20.362  -38.058 1   34.21  ? 944  TYR   A CE1  1 1 
ATOM   3840 C  CE2  . TYR   A 1 254 ? -2.372  20.312  -40.437 1   34.29  ? 944  TYR   A CE2  1 1 
ATOM   3841 C  CZ   . TYR   A 1 254 ? -3.136  20.148  -39.298 1   35.13  ? 944  TYR   A CZ   1 1 
ATOM   3842 O  OH   . TYR   A 1 254 ? -4.427  19.683  -39.396 1   36.67  ? 944  TYR   A OH   1 1 
ATOM   3843 H  H    . TYR   A 1 254 ? 3.313   22.069  -38.596 0   32.41  ? 944  TYR   A H    1 1 
ATOM   3844 H  HA   . TYR   A 1 254 ? 1.417   20.525  -37.2   0   30.45  ? 944  TYR   A HA   1 1 
ATOM   3845 H  HB2  . TYR   A 1 254 ? 0.892   22.534  -38.511 0   32     ? 944  TYR   A HB2  1 1 
ATOM   3846 H  HB3  . TYR   A 1 254 ? 1.328   21.667  -40.004 0   31.93  ? 944  TYR   A HB3  1 1 
ATOM   3847 H  HD1  . TYR   A 1 254 ? -0.862  21.058  -36.993 0   32.17  ? 944  TYR   A HD1  1 1 
ATOM   3848 H  HD2  . TYR   A 1 254 ? -0.489  20.922  -41.229 0   33.62  ? 944  TYR   A HD2  1 1 
ATOM   3849 H  HE1  . TYR   A 1 254 ? -3.161  20.24   -37.166 0   33.43  ? 944  TYR   A HE1  1 1 
ATOM   3850 H  HE2  . TYR   A 1 254 ? -2.795  20.114  -41.407 0   34.94  ? 944  TYR   A HE2  1 1 
ATOM   3851 H  HH   . TYR   A 1 254 ? -4.826  19.945  -40.267 0   38.02  ? 944  TYR   A HH   1 1 
ATOM   3852 N  N    . MET   A 1 255 ? 2.872   18.989  -39.725 1   31.37  ? 945  MET   A N    1 1 
ATOM   3853 C  CA   . MET   A 1 255 ? 3.033   17.653  -40.299 1   31.22  ? 945  MET   A CA   1 1 
ATOM   3854 C  C    . MET   A 1 255 ? 3.477   16.633  -39.25  1   30.93  ? 945  MET   A C    1 1 
ATOM   3855 O  O    . MET   A 1 255 ? 3.089   15.478  -39.363 1   30.99  ? 945  MET   A O    1 1 
ATOM   3856 C  CB   . MET   A 1 255 ? 4.018   17.637  -41.484 1   31.91  ? 945  MET   A CB   1 1 
ATOM   3857 C  CG   . MET   A 1 255 ? 3.45    18.185  -42.796 1   34.12  ? 945  MET   A CG   1 1 
ATOM   3858 S  SD   . MET   A 1 255 ? 1.811   17.597  -43.32  1   38.26  ? 945  MET   A SD   1 1 
ATOM   3859 C  CE   . MET   A 1 255 ? 2.068   15.818  -43.339 1   37     ? 945  MET   A CE   1 1 
ATOM   3860 H  H    . MET   A 1 255 ? 3.514   19.681  -40.097 0   30.47  ? 945  MET   A H    1 1 
ATOM   3861 H  HA   . MET   A 1 255 ? 2.055   17.33   -40.652 0   29.79  ? 945  MET   A HA   1 1 
ATOM   3862 H  HB2  . MET   A 1 255 ? 4.886   18.243  -41.229 0   31.65  ? 945  MET   A HB2  1 1 
ATOM   3863 H  HB3  . MET   A 1 255 ? 4.345   16.613  -41.653 0   31.53  ? 945  MET   A HB3  1 1 
ATOM   3864 H  HG2  . MET   A 1 255 ? 3.385   19.268  -42.707 0   34.42  ? 945  MET   A HG2  1 1 
ATOM   3865 H  HG3  . MET   A 1 255 ? 4.146   17.931  -43.593 0   34.93  ? 945  MET   A HG3  1 1 
ATOM   3866 H  HE1  . MET   A 1 255 ? 1.331   15.358  -43.995 0   37.43  ? 945  MET   A HE1  1 1 
ATOM   3867 H  HE2  . MET   A 1 255 ? 3.074   15.609  -43.698 0   37.83  ? 945  MET   A HE2  1 1 
ATOM   3868 H  HE3  . MET   A 1 255 ? 1.954   15.438  -42.325 0   36.61  ? 945  MET   A HE3  1 1 
ATOM   3869 N  N    . ILE   A 1 256 ? 4.231   17.042  -38.207 1   30.41  ? 946  ILE   A N    1 1 
ATOM   3870 C  CA   . ILE   A 1 256 ? 4.618   16.125  -37.121 1   30.38  ? 946  ILE   A CA   1 1 
ATOM   3871 C  C    . ILE   A 1 256 ? 3.341   15.682  -36.395 1   30.04  ? 946  ILE   A C    1 1 
ATOM   3872 O  O    . ILE   A 1 256 ? 3.148   14.488  -36.167 1   30.1   ? 946  ILE   A O    1 1 
ATOM   3873 C  CB   . ILE   A 1 256 ? 5.607   16.783  -36.114 1   31.01  ? 946  ILE   A CB   1 1 
ATOM   3874 C  CG1  . ILE   A 1 256 ? 6.977   17.035  -36.76  1   31.95  ? 946  ILE   A CG1  1 1 
ATOM   3875 C  CG2  . ILE   A 1 256 ? 5.757   15.911  -34.851 1   31.57  ? 946  ILE   A CG2  1 1 
ATOM   3876 C  CD1  . ILE   A 1 256 ? 7.815   18.051  -36.032 1   33.28  ? 946  ILE   A CD1  1 1 
ATOM   3877 H  H    . ILE   A 1 256 ? 4.577   17.989  -38.088 0   28.48  ? 946  ILE   A H    1 1 
ATOM   3878 H  HA   . ILE   A 1 256 ? 5.097   15.245  -37.546 0   28.25  ? 946  ILE   A HA   1 1 
ATOM   3879 H  HB   . ILE   A 1 256 ? 5.175   17.736  -35.812 0   28.43  ? 946  ILE   A HB   1 1 
ATOM   3880 H  HG12 . ILE   A 1 256 ? 7.527   16.096  -36.782 0   30.93  ? 946  ILE   A HG12 1 1 
ATOM   3881 H  HG13 . ILE   A 1 256 ? 6.838   17.401  -37.777 0   30.95  ? 946  ILE   A HG13 1 1 
ATOM   3882 H  HG21 . ILE   A 1 256 ? 6.623   16.218  -34.267 0   28.9   ? 946  ILE   A HG21 1 1 
ATOM   3883 H  HG22 . ILE   A 1 256 ? 4.873   16.019  -34.225 0   28.07  ? 946  ILE   A HG22 1 1 
ATOM   3884 H  HG23 . ILE   A 1 256 ? 5.871   14.871  -35.155 0   29.01  ? 946  ILE   A HG23 1 1 
ATOM   3885 H  HD11 . ILE   A 1 256 ? 8.599   18.396  -36.704 0   33.49  ? 946  ILE   A HD11 1 1 
ATOM   3886 H  HD12 . ILE   A 1 256 ? 7.191   18.887  -35.72  0   32.37  ? 946  ILE   A HD12 1 1 
ATOM   3887 H  HD13 . ILE   A 1 256 ? 8.276   17.587  -35.161 0   32.2   ? 946  ILE   A HD13 1 1 
ATOM   3888 N  N    . MET   A 1 257 ? 2.462   16.652  -36.068 1   29.55  ? 947  MET   A N    1 1 
ATOM   3889 C  CA   . MET   A 1 257 ? 1.19    16.391  -35.396 1   29.38  ? 947  MET   A CA   1 1 
ATOM   3890 C  C    . MET   A 1 257 ? 0.332   15.444  -36.241 1   28.55  ? 947  MET   A C    1 1 
ATOM   3891 O  O    . MET   A 1 257 ? -0.204  14.484  -35.697 1   28.58  ? 947  MET   A O    1 1 
ATOM   3892 C  CB   . MET   A 1 257 ? 0.426   17.702  -35.125 1   30.54  ? 947  MET   A CB   1 1 
ATOM   3893 C  CG   . MET   A 1 257 ? 1.076   18.597  -34.086 1   33.58  ? 947  MET   A CG   1 1 
ATOM   3894 S  SD   . MET   A 1 257 ? 0.069   20.072  -33.782 1   40.03  ? 947  MET   A SD   1 1 
ATOM   3895 C  CE   . MET   A 1 257 ? 1.265   21.36   -34.043 1   38.8   ? 947  MET   A CE   1 1 
ATOM   3896 H  H    . MET   A 1 257 ? 2.614   17.634  -36.276 0   26.32  ? 947  MET   A H    1 1 
ATOM   3897 H  HA   . MET   A 1 257 ? 1.391   15.919  -34.436 0   25.24  ? 947  MET   A HA   1 1 
ATOM   3898 H  HB2  . MET   A 1 257 ? 0.352   18.268  -36.053 0   27.42  ? 947  MET   A HB2  1 1 
ATOM   3899 H  HB3  . MET   A 1 257 ? -0.573  17.457  -34.767 0   27.02  ? 947  MET   A HB3  1 1 
ATOM   3900 H  HG2  . MET   A 1 257 ? 1.171   18.05   -33.15  0   29.58  ? 947  MET   A HG2  1 1 
ATOM   3901 H  HG3  . MET   A 1 257 ? 2.057   18.91   -34.441 0   30.18  ? 947  MET   A HG3  1 1 
ATOM   3902 H  HE1  . MET   A 1 257 ? 0.821   22.312  -33.757 0   37.47  ? 947  MET   A HE1  1 1 
ATOM   3903 H  HE2  . MET   A 1 257 ? 2.155   21.175  -33.443 0   36.53  ? 947  MET   A HE2  1 1 
ATOM   3904 H  HE3  . MET   A 1 257 ? 1.542   21.391  -35.095 0   36.84  ? 947  MET   A HE3  1 1 
ATOM   3905 N  N    A ARG   A 1 258 ? 0.234   15.688  -37.564 0.5 28.03  ? 948  ARG   A N    1 1 
ATOM   3906 N  N    B ARG   A 1 258 ? 0.223   15.697  -37.559 0.5 28.14  ? 948  ARG   A N    1 1 
ATOM   3907 C  CA   A ARG   A 1 258 ? -0.551  14.835  -38.458 0.5 28.02  ? 948  ARG   A CA   1 1 
ATOM   3908 C  CA   B ARG   A 1 258 ? -0.548  14.83   -38.45  0.5 28.24  ? 948  ARG   A CA   1 1 
ATOM   3909 C  C    A ARG   A 1 258 ? 0.069   13.445  -38.619 0.5 28.32  ? 948  ARG   A C    1 1 
ATOM   3910 C  C    B ARG   A 1 258 ? 0.067   13.439  -38.575 0.5 28.43  ? 948  ARG   A C    1 1 
ATOM   3911 O  O    A ARG   A 1 258 ? -0.671  12.483  -38.805 0.5 28.56  ? 948  ARG   A O    1 1 
ATOM   3912 O  O    B ARG   A 1 258 ? -0.676  12.472  -38.708 0.5 28.67  ? 948  ARG   A O    1 1 
ATOM   3913 C  CB   A ARG   A 1 258 ? -0.767  15.496  -39.84  0.5 28.62  ? 948  ARG   A CB   1 1 
ATOM   3914 C  CB   B ARG   A 1 258 ? -0.711  15.445  -39.858 0.5 29.17  ? 948  ARG   A CB   1 1 
ATOM   3915 C  CG   A ARG   A 1 258 ? -1.621  16.784  -39.846 0.5 30.05  ? 948  ARG   A CG   1 1 
ATOM   3916 C  CG   B ARG   A 1 258 ? -1.864  16.449  -40.004 0.5 31.26  ? 948  ARG   A CG   1 1 
ATOM   3917 C  CD   A ARG   A 1 258 ? -3.098  16.603  -39.496 0.5 31.37  ? 948  ARG   A CD   1 1 
ATOM   3918 C  CD   B ARG   A 1 258 ? -3.273  15.844  -39.984 0.5 33.21  ? 948  ARG   A CD   1 1 
ATOM   3919 N  NE   A ARG   A 1 258 ? -3.82   15.743  -40.444 0.5 32.44  ? 948  ARG   A NE   1 1 
ATOM   3920 N  NE   B ARG   A 1 258 ? -3.498  14.825  -41.023 0.5 34.67  ? 948  ARG   A NE   1 1 
ATOM   3921 C  CZ   A ARG   A 1 258 ? -4.627  16.14   -41.433 0.5 33.03  ? 948  ARG   A CZ   1 1 
ATOM   3922 C  CZ   B ARG   A 1 258 ? -3.519  13.495  -40.86  0.5 35.5   ? 948  ARG   A CZ   1 1 
ATOM   3923 N  NH1  A ARG   A 1 258 ? -5.22   15.243  -42.211 0.5 32.16  ? 948  ARG   A NH1  1 1 
ATOM   3924 N  NH1  B ARG   A 1 258 ? -3.74   12.697  -41.899 0.5 35.03  ? 948  ARG   A NH1  1 1 
ATOM   3925 N  NH2  A ARG   A 1 258 ? -4.851  17.435  -41.649 0.5 32.55  ? 948  ARG   A NH2  1 1 
ATOM   3926 N  NH2  B ARG   A 1 258 ? -3.316  12.954  -39.659 0.5 34.25  ? 948  ARG   A NH2  1 1 
ATOM   3927 H  H    A ARG   A 1 258 ? 0.696   16.46   -38.034 0   25.26  ? 948  ARG   A H    1 1 
ATOM   3928 H  H    B ARG   A 1 258 ? 0.641   16.499  -38.019 0   25.37  ? 948  ARG   A H    1 1 
ATOM   3929 H  HA   A ARG   A 1 258 ? -1.521  14.669  -37.993 0   25.79  ? 948  ARG   A HA   1 1 
ATOM   3930 H  HA   B ARG   A 1 258 ? -1.531  14.692  -38.003 0   26.02  ? 948  ARG   A HA   1 1 
ATOM   3931 H  HB2  A ARG   A 1 258 ? 0.207   15.756  -40.253 0   26.99  ? 948  ARG   A HB2  1 1 
ATOM   3932 H  HB2  B ARG   A 1 258 ? 0.209   15.958  -40.135 0   27.44  ? 948  ARG   A HB2  1 1 
ATOM   3933 H  HB3  A ARG   A 1 258 ? -1.253  14.775  -40.496 0   27.57  ? 948  ARG   A HB3  1 1 
ATOM   3934 H  HB3  B ARG   A 1 258 ? -0.883  14.632  -40.562 0   28.07  ? 948  ARG   A HB3  1 1 
ATOM   3935 H  HG2  A ARG   A 1 258 ? -1.198  17.482  -39.125 0   28.25  ? 948  ARG   A HG2  1 1 
ATOM   3936 H  HG2  B ARG   A 1 258 ? -1.804  17.162  -39.184 0   29.67  ? 948  ARG   A HG2  1 1 
ATOM   3937 H  HG3  A ARG   A 1 258 ? -1.574  17.221  -40.842 0   29.16  ? 948  ARG   A HG3  1 1 
ATOM   3938 H  HG3  B ARG   A 1 258 ? -1.748  16.975  -40.951 0   30.49  ? 948  ARG   A HG3  1 1 
ATOM   3939 H  HD2  A ARG   A 1 258 ? -3.186  16.131  -38.52  0   30.04  ? 948  ARG   A HD2  1 1 
ATOM   3940 H  HD2  B ARG   A 1 258 ? -3.509  15.477  -38.987 0   32.31  ? 948  ARG   A HD2  1 1 
ATOM   3941 H  HD3  A ARG   A 1 258 ? -3.559  17.584  -39.407 0   30.84  ? 948  ARG   A HD3  1 1 
ATOM   3942 H  HD3  B ARG   A 1 258 ? -3.966  16.654  -40.206 0   33.17  ? 948  ARG   A HD3  1 1 
ATOM   3943 H  HE   A ARG   A 1 258 ? -3.698  14.742  -40.325 0   32.44  ? 948  ARG   A HE   1 1 
ATOM   3944 H  HE   B ARG   A 1 258 ? -3.669  15.175  -41.961 0   35.51  ? 948  ARG   A HE   1 1 
ATOM   3945 H  HH11 A ARG   A 1 258 ? -5.071  14.251  -42.056 0   34.23  ? 948  ARG   A HH11 1 1 
ATOM   3946 H  HH11 B ARG   A 1 258 ? -3.903  13.087  -42.822 0   37.18  ? 948  ARG   A HH11 1 1 
ATOM   3947 H  HH12 A ARG   A 1 258 ? -5.836  15.541  -42.961 0   35.17  ? 948  ARG   A HH12 1 1 
ATOM   3948 H  HH12 B ARG   A 1 258 ? -3.757  11.689  -41.777 0   37.07  ? 948  ARG   A HH12 1 1 
ATOM   3949 H  HH21 A ARG   A 1 258 ? -4.428  18.192  -41.124 0   33.42  ? 948  ARG   A HH21 1 1 
ATOM   3950 H  HH21 B ARG   A 1 258 ? -3.126  13.483  -38.816 0   33.42  ? 948  ARG   A HH21 1 1 
ATOM   3951 H  HH22 A ARG   A 1 258 ? -5.47   17.694  -42.41  0   34.89  ? 948  ARG   A HH22 1 1 
ATOM   3952 H  HH22 B ARG   A 1 258 ? -3.333  11.942  -39.577 0   34.52  ? 948  ARG   A HH22 1 1 
ATOM   3953 N  N    . LYS   A 1 259 ? 1.401   13.32   -38.526 1   28.3   ? 949  LYS   A N    1 1 
ATOM   3954 C  CA   . LYS   A 1 259 ? 2.055   12.01   -38.594 1   28.57  ? 949  LYS   A CA   1 1 
ATOM   3955 C  C    . LYS   A 1 259 ? 1.757   11.215  -37.3   1   28.18  ? 949  LYS   A C    1 1 
ATOM   3956 O  O    . LYS   A 1 259 ? 1.616   9.999   -37.369 1   28.1   ? 949  LYS   A O    1 1 
ATOM   3957 C  CB   . LYS   A 1 259 ? 3.571   12.14   -38.863 1   30.9   ? 949  LYS   A CB   1 1 
ATOM   3958 C  CG   . LYS   A 1 259 ? 3.897   12.497  -40.317 1   35.42  ? 949  LYS   A CG   1 1 
ATOM   3959 C  CD   . LYS   A 1 259 ? 5.316   13.009  -40.502 1   39.82  ? 949  LYS   A CD   1 1 
ATOM   3960 C  CE   . LYS   A 1 259 ? 5.625   13.251  -41.961 1   43.47  ? 949  LYS   A CE   1 1 
ATOM   3961 N  NZ   . LYS   A 1 259 ? 7       13.783  -42.157 1   45.87  ? 949  LYS   A NZ   1 1 
ATOM   3962 H  H    A LYS   A 1 259 ? 2.049   14.092  -38.42  0   25.9   ? 949  LYS   A H    1 1 
ATOM   3963 H  H    B LYS   A 1 259 ? 2.048   14.097  -38.451 0   25.92  ? 949  LYS   A H    1 1 
ATOM   3964 H  HA   . LYS   A 1 259 ? 1.629   11.439  -39.417 0   27.74  ? 949  LYS   A HA   1 1 
ATOM   3965 H  HB2  . LYS   A 1 259 ? 4.007   12.897  -38.213 0   29.15  ? 949  LYS   A HB2  1 1 
ATOM   3966 H  HB3  . LYS   A 1 259 ? 4.041   11.178  -38.669 0   30.19  ? 949  LYS   A HB3  1 1 
ATOM   3967 H  HG2  . LYS   A 1 259 ? 3.78    11.607  -40.933 0   35.84  ? 949  LYS   A HG2  1 1 
ATOM   3968 H  HG3  . LYS   A 1 259 ? 3.214   13.275  -40.652 0   34.73  ? 949  LYS   A HG3  1 1 
ATOM   3969 H  HD2  . LYS   A 1 259 ? 5.433   13.951  -39.968 0   39.31  ? 949  LYS   A HD2  1 1 
ATOM   3970 H  HD3  . LYS   A 1 259 ? 6.021   12.27   -40.122 0   40.37  ? 949  LYS   A HD3  1 1 
ATOM   3971 H  HE2  . LYS   A 1 259 ? 5.546   12.31   -42.504 0   45.31  ? 949  LYS   A HE2  1 1 
ATOM   3972 H  HE3  . LYS   A 1 259 ? 4.918   13.977  -42.361 0   44.2   ? 949  LYS   A HE3  1 1 
ATOM   3973 H  HZ1  . LYS   A 1 259 ? 7.243   13.761  -43.142 0   48.82  ? 949  LYS   A HZ1  1 1 
ATOM   3974 H  HZ2  . LYS   A 1 259 ? 7.048   14.742  -41.828 0   47.47  ? 949  LYS   A HZ2  1 1 
ATOM   3975 H  HZ3  . LYS   A 1 259 ? 7.665   13.22   -41.636 0   47.85  ? 949  LYS   A HZ3  1 1 
ATOM   3976 N  N    . CYS   A 1 260 ? 1.595   11.897  -36.144 1   28     ? 950  CYS   A N    1 1 
ATOM   3977 C  CA   . CYS   A 1 260 ? 1.204   11.261  -34.88  1   28.26  ? 950  CYS   A CA   1 1 
ATOM   3978 C  C    . CYS   A 1 260 ? -0.238  10.724  -34.926 1   28.73  ? 950  CYS   A C    1 1 
ATOM   3979 O  O    . CYS   A 1 260 ? -0.573  9.87    -34.111 1   28.91  ? 950  CYS   A O    1 1 
ATOM   3980 C  CB   . CYS   A 1 260 ? 1.376   12.229  -33.71  1   28.43  ? 950  CYS   A CB   1 1 
ATOM   3981 S  SG   . CYS   A 1 260 ? 3.088   12.728  -33.394 1   30.11  ? 950  CYS   A SG   1 1 
ATOM   3982 H  H    . CYS   A 1 260 ? 1.754   12.894  -36.042 0   24.81  ? 950  CYS   A H    1 1 
ATOM   3983 H  HA   . CYS   A 1 260 ? 1.864   10.412  -34.705 0   25.59  ? 950  CYS   A HA   1 1 
ATOM   3984 H  HB2  . CYS   A 1 260 ? 0.796   13.129  -33.907 0   24.38  ? 950  CYS   A HB2  1 1 
ATOM   3985 H  HB3  . CYS   A 1 260 ? 1.005   11.746  -32.807 0   24.42  ? 950  CYS   A HB3  1 1 
ATOM   3986 H  HG   . CYS   A 1 260 ? 3.115   13.552  -32.34  0   25.65  ? 950  CYS   A HG   1 1 
ATOM   3987 N  N    . TRP   A 1 261 ? -1.099  11.251  -35.826 1   28.91  ? 951  TRP   A N    1 1 
ATOM   3988 C  CA   . TRP   A 1 261 ? -2.495  10.844  -35.947 1   29.57  ? 951  TRP   A CA   1 1 
ATOM   3989 C  C    . TRP   A 1 261 ? -2.804  10.038  -37.226 1   31.11  ? 951  TRP   A C    1 1 
ATOM   3990 O  O    . TRP   A 1 261 ? -3.924  10.118  -37.729 1   31.38  ? 951  TRP   A O    1 1 
ATOM   3991 C  CB   . TRP   A 1 261 ? -3.42   12.07   -35.871 1   28.83  ? 951  TRP   A CB   1 1 
ATOM   3992 C  CG   . TRP   A 1 261 ? -3.122  13.02   -34.749 1   28.55  ? 951  TRP   A CG   1 1 
ATOM   3993 C  CD1  . TRP   A 1 261 ? -2.818  12.705  -33.456 1   29.12  ? 951  TRP   A CD1  1 1 
ATOM   3994 C  CD2  . TRP   A 1 261 ? -3.206  14.447  -34.806 1   28.35  ? 951  TRP   A CD2  1 1 
ATOM   3995 N  NE1  . TRP   A 1 261 ? -2.658  13.852  -32.717 1   29.31  ? 951  TRP   A NE1  1 1 
ATOM   3996 C  CE2  . TRP   A 1 261 ? -2.89   14.938  -33.523 1   28.96  ? 951  TRP   A CE2  1 1 
ATOM   3997 C  CE3  . TRP   A 1 261 ? -3.485  15.361  -35.826 1   28.7   ? 951  TRP   A CE3  1 1 
ATOM   3998 C  CZ2  . TRP   A 1 261 ? -2.86   16.301  -33.235 1   29.36  ? 951  TRP   A CZ2  1 1 
ATOM   3999 C  CZ3  . TRP   A 1 261 ? -3.437  16.711  -35.542 1   29.49  ? 951  TRP   A CZ3  1 1 
ATOM   4000 C  CH2  . TRP   A 1 261 ? -3.131  17.168  -34.259 1   29.52  ? 951  TRP   A CH2  1 1 
ATOM   4001 H  H    . TRP   A 1 261 ? -0.862  11.985  -36.486 0   26.54  ? 951  TRP   A H    1 1 
ATOM   4002 H  HA   . TRP   A 1 261 ? -2.764  10.207  -35.107 0   28.22  ? 951  TRP   A HA   1 1 
ATOM   4003 H  HB2  . TRP   A 1 261 ? -3.343  12.616  -36.81  0   27.44  ? 951  TRP   A HB2  1 1 
ATOM   4004 H  HB3  . TRP   A 1 261 ? -4.445  11.729  -35.73  0   28.05  ? 951  TRP   A HB3  1 1 
ATOM   4005 H  HD1  . TRP   A 1 261 ? -2.697  11.708  -33.067 0   26.28  ? 951  TRP   A HD1  1 1 
ATOM   4006 H  HE1  . TRP   A 1 261 ? -2.402  13.892  -31.709 0   25.45  ? 951  TRP   A HE1  1 1 
ATOM   4007 H  HE3  . TRP   A 1 261 ? -3.739  15.007  -36.809 0   27.03  ? 951  TRP   A HE3  1 1 
ATOM   4008 H  HZ2  . TRP   A 1 261 ? -2.608  16.659  -32.251 0   25.88  ? 951  TRP   A HZ2  1 1 
ATOM   4009 H  HZ3  . TRP   A 1 261 ? -3.662  17.423  -36.318 0   27.78  ? 951  TRP   A HZ3  1 1 
ATOM   4010 H  HH2  . TRP   A 1 261 ? -3.11   18.228  -34.069 0   27.1   ? 951  TRP   A HH2  1 1 
ATOM   4011 N  N    . MET   A 1 262 ? -1.852  9.235   -37.73  1   31.97  ? 952  MET   A N    1 1 
ATOM   4012 C  CA   . MET   A 1 262 ? -2.11   8.408   -38.916 1   33.31  ? 952  MET   A CA   1 1 
ATOM   4013 C  C    . MET   A 1 262 ? -2.903  7.164   -38.521 1   34.86  ? 952  MET   A C    1 1 
ATOM   4014 O  O    . MET   A 1 262 ? -2.816  6.713   -37.38  1   35.11  ? 952  MET   A O    1 1 
ATOM   4015 C  CB   . MET   A 1 262 ? -0.801  8.007   -39.613 1   33.87  ? 952  MET   A CB   1 1 
ATOM   4016 C  CG   . MET   A 1 262 ? -0.15   9.145   -40.36  1   35.85  ? 952  MET   A CG   1 1 
ATOM   4017 S  SD   . MET   A 1 262 ? 1.559   8.779   -40.793 1   40.98  ? 952  MET   A SD   1 1 
ATOM   4018 C  CE   . MET   A 1 262 ? 1.311   7.877   -42.305 1   39.44  ? 952  MET   A CE   1 1 
ATOM   4019 H  H    . MET   A 1 262 ? -0.922  9.12    -37.339 0   31.74  ? 952  MET   A H    1 1 
ATOM   4020 H  HA   . MET   A 1 262 ? -2.71   8.973   -39.629 0   35.25  ? 952  MET   A HA   1 1 
ATOM   4021 H  HB2  . MET   A 1 262 ? -0.093  7.633   -38.876 0   35.73  ? 952  MET   A HB2  1 1 
ATOM   4022 H  HB3  . MET   A 1 262 ? -1.023  7.224   -40.337 0   37.36  ? 952  MET   A HB3  1 1 
ATOM   4023 H  HG2  . MET   A 1 262 ? -0.699  9.32    -41.284 0   37.94  ? 952  MET   A HG2  1 1 
ATOM   4024 H  HG3  . MET   A 1 262 ? -0.17   10.039  -39.739 0   36.25  ? 952  MET   A HG3  1 1 
ATOM   4025 H  HE1  . MET   A 1 262 ? 2.279   7.544   -42.676 0   44.2   ? 952  MET   A HE1  1 1 
ATOM   4026 H  HE2  . MET   A 1 262 ? 0.672   7.016   -42.112 0   44.27  ? 952  MET   A HE2  1 1 
ATOM   4027 H  HE3  . MET   A 1 262 ? 0.841   8.536   -43.033 0   43.43  ? 952  MET   A HE3  1 1 
ATOM   4028 N  N    . ILE   A 1 263 ? -3.676  6.606   -39.463 1   35.58  ? 953  ILE   A N    1 1 
ATOM   4029 C  CA   . ILE   A 1 263 ? -4.505  5.425   -39.19  1   36.86  ? 953  ILE   A CA   1 1 
ATOM   4030 C  C    . ILE   A 1 263 ? -3.612  4.239   -38.8   1   37.71  ? 953  ILE   A C    1 1 
ATOM   4031 O  O    . ILE   A 1 263 ? -3.862  3.596   -37.78  1   38.01  ? 953  ILE   A O    1 1 
ATOM   4032 C  CB   . ILE   A 1 263 ? -5.437  5.081   -40.398 1   37.56  ? 953  ILE   A CB   1 1 
ATOM   4033 C  CG1  . ILE   A 1 263 ? -6.487  6.202   -40.685 1   38.56  ? 953  ILE   A CG1  1 1 
ATOM   4034 C  CG2  . ILE   A 1 263 ? -6.109  3.704   -40.225 1   38.12  ? 953  ILE   A CG2  1 1 
ATOM   4035 C  CD1  . ILE   A 1 263 ? -7.61   6.448   -39.645 1   39.76  ? 953  ILE   A CD1  1 1 
ATOM   4036 H  H    . ILE   A 1 263 ? -3.713  6.939   -40.421 0   40.59  ? 953  ILE   A H    1 1 
ATOM   4037 H  HA   . ILE   A 1 263 ? -5.133  5.654   -38.33  0   42.86  ? 953  ILE   A HA   1 1 
ATOM   4038 H  HB   . ILE   A 1 263 ? -4.801  5.011   -41.279 0   46.25  ? 953  ILE   A HB   1 1 
ATOM   4039 H  HG12 . ILE   A 1 263 ? -5.958  7.146   -40.807 0   45.26  ? 953  ILE   A HG12 1 1 
ATOM   4040 H  HG13 . ILE   A 1 263 ? -6.981  5.957   -41.624 0   48.16  ? 953  ILE   A HG13 1 1 
ATOM   4041 H  HG21 . ILE   A 1 263 ? -7.025  3.675   -40.814 0   50.43  ? 953  ILE   A HG21 1 1 
ATOM   4042 H  HG22 . ILE   A 1 263 ? -5.431  2.932   -40.586 0   49.3   ? 953  ILE   A HG22 1 1 
ATOM   4043 H  HG23 . ILE   A 1 263 ? -6.339  3.537   -39.174 0   48.69  ? 953  ILE   A HG23 1 1 
ATOM   4044 H  HD11 . ILE   A 1 263 ? -8.226  7.273   -40     0   48.1   ? 953  ILE   A HD11 1 1 
ATOM   4045 H  HD12 . ILE   A 1 263 ? -8.232  5.56    -39.546 0   49.66  ? 953  ILE   A HD12 1 1 
ATOM   4046 H  HD13 . ILE   A 1 263 ? -7.176  6.711   -38.682 0   46.62  ? 953  ILE   A HD13 1 1 
ATOM   4047 N  N    . ASP   A 1 264 ? -2.555  3.975   -39.582 1   38.16  ? 954  ASP   A N    1 1 
ATOM   4048 C  CA   . ASP   A 1 264 ? -1.622  2.897   -39.27  1   38.97  ? 954  ASP   A CA   1 1 
ATOM   4049 C  C    . ASP   A 1 264 ? -0.735  3.356   -38.111 1   39.37  ? 954  ASP   A C    1 1 
ATOM   4050 O  O    . ASP   A 1 264 ? -0.007  4.336   -38.256 1   39.55  ? 954  ASP   A O    1 1 
ATOM   4051 C  CB   . ASP   A 1 264 ? -0.768  2.556   -40.5   1   40.91  ? 954  ASP   A CB   1 1 
ATOM   4052 C  CG   . ASP   A 1 264 ? 0.204   1.418   -40.268 1   45.97  ? 954  ASP   A CG   1 1 
ATOM   4053 O  OD1  . ASP   A 1 264 ? -0.192  0.421   -39.628 1   46.74  ? 954  ASP   A OD1  1 1 
ATOM   4054 O  OD2  . ASP   A 1 264 ? 1.36    1.519   -40.737 1   48.36  ? 954  ASP   A OD2  1 1 
ATOM   4055 H  H    . ASP   A 1 264 ? -2.326  4.478   -40.433 0   45.5   ? 954  ASP   A H    1 1 
ATOM   4056 H  HA   . ASP   A 1 264 ? -2.176  2.006   -38.978 0   48.86  ? 954  ASP   A HA   1 1 
ATOM   4057 H  HB2  . ASP   A 1 264 ? -1.431  2.263   -41.313 0   51.94  ? 954  ASP   A HB2  1 1 
ATOM   4058 H  HB3  . ASP   A 1 264 ? -0.196  3.435   -40.792 0   49.43  ? 954  ASP   A HB3  1 1 
ATOM   4059 N  N    . ALA   A 1 265 ? -0.83   2.684   -36.952 1   39.35  ? 955  ALA   A N    1 1 
ATOM   4060 C  CA   . ALA   A 1 265 ? -0.063  3.049   -35.76  1   39.8   ? 955  ALA   A CA   1 1 
ATOM   4061 C  C    . ALA   A 1 265 ? 1.449   2.892   -35.934 1   40.11  ? 955  ALA   A C    1 1 
ATOM   4062 O  O    . ALA   A 1 265 ? 2.204   3.666   -35.352 1   40.06  ? 955  ALA   A O    1 1 
ATOM   4063 C  CB   . ALA   A 1 265 ? -0.533  2.23    -34.569 1   39.99  ? 955  ALA   A CB   1 1 
ATOM   4064 H  H    . ALA   A 1 265 ? -1.431  1.879   -36.808 0   47.55  ? 955  ALA   A H    1 1 
ATOM   4065 H  HA   . ALA   A 1 265 ? -0.26   4.096   -35.534 0   43.67  ? 955  ALA   A HA   1 1 
ATOM   4066 H  HB1  . ALA   A 1 265 ? 0.04    2.524   -33.691 0   44.96  ? 955  ALA   A HB1  1 1 
ATOM   4067 H  HB2  . ALA   A 1 265 ? -1.592  2.422   -34.404 0   45.88  ? 955  ALA   A HB2  1 1 
ATOM   4068 H  HB3  . ALA   A 1 265 ? -0.374  1.173   -34.779 0   47.75  ? 955  ALA   A HB3  1 1 
ATOM   4069 N  N    . ASP   A 1 266 ? 1.895   1.905   -36.721 1   40.2   ? 956  ASP   A N    1 1 
ATOM   4070 C  CA   . ASP   A 1 266 ? 3.325   1.691   -36.95  1   40.8   ? 956  ASP   A CA   1 1 
ATOM   4071 C  C    . ASP   A 1 266 ? 3.93    2.785   -37.846 1   40.64  ? 956  ASP   A C    1 1 
ATOM   4072 O  O    . ASP   A 1 266 ? 5.112   3.095   -37.703 1   40.8   ? 956  ASP   A O    1 1 
ATOM   4073 C  CB   . ASP   A 1 266 ? 3.567   0.291   -37.534 1   42.92  ? 956  ASP   A CB   1 1 
ATOM   4074 C  CG   . ASP   A 1 266 ? 3.06    -0.84   -36.651 1   47.95  ? 956  ASP   A CG   1 1 
ATOM   4075 O  OD1  . ASP   A 1 266 ? 2.819   -0.595  -35.445 1   48.57  ? 956  ASP   A OD1  1 1 
ATOM   4076 O  OD2  . ASP   A 1 266 ? 2.899   -1.969  -37.168 1   50.43  ? 956  ASP   A OD2  1 1 
ATOM   4077 H  H    . ASP   A 1 266 ? 1.3     1.25    -37.218 0   49.31  ? 956  ASP   A H    1 1 
ATOM   4078 H  HA   . ASP   A 1 266 ? 3.847   1.738   -35.995 0   48.6   ? 956  ASP   A HA   1 1 
ATOM   4079 H  HB2  . ASP   A 1 266 ? 3.058   0.217   -38.494 0   55.07  ? 956  ASP   A HB2  1 1 
ATOM   4080 H  HB3  . ASP   A 1 266 ? 4.638   0.149   -37.673 0   55.04  ? 956  ASP   A HB3  1 1 
ATOM   4081 N  N    . SER   A 1 267 ? 3.127   3.385   -38.743 1   40.25  ? 957  SER   A N    1 1 
ATOM   4082 C  CA   . SER   A 1 267 ? 3.582   4.491   -39.589 1   40.27  ? 957  SER   A CA   1 1 
ATOM   4083 C  C    . SER   A 1 267 ? 3.758   5.805   -38.799 1   39.81  ? 957  SER   A C    1 1 
ATOM   4084 O  O    . SER   A 1 267 ? 4.418   6.716   -39.299 1   40.01  ? 957  SER   A O    1 1 
ATOM   4085 C  CB   . SER   A 1 267 ? 2.607   4.723   -40.739 1   41.95  ? 957  SER   A CB   1 1 
ATOM   4086 O  OG   . SER   A 1 267 ? 2.614   3.638   -41.654 1   44.76  ? 957  SER   A OG   1 1 
ATOM   4087 H  H    . SER   A 1 267 ? 2.167   3.114   -38.929 0   47.71  ? 957  SER   A H    1 1 
ATOM   4088 H  HA   . SER   A 1 267 ? 4.549   4.234   -40.021 0   47.64  ? 957  SER   A HA   1 1 
ATOM   4089 H  HB2  . SER   A 1 267 ? 1.601   4.849   -40.341 0   48.01  ? 957  SER   A HB2  1 1 
ATOM   4090 H  HB3  . SER   A 1 267 ? 2.903   5.626   -41.27  0   47.93  ? 957  SER   A HB3  1 1 
ATOM   4091 H  HG   . SER   A 1 267 ? 2.247   2.819   -41.229 0   54.61  ? 957  SER   A HG   1 1 
ATOM   4092 N  N    . ARG   A 1 268 ? 3.175   5.917   -37.586 1   39.03  ? 958  ARG   A N    1 1 
ATOM   4093 C  CA   . ARG   A 1 268 ? 3.319   7.122   -36.76  1   38.73  ? 958  ARG   A CA   1 1 
ATOM   4094 C  C    . ARG   A 1 268 ? 4.79    7.273   -36.303 1   38.38  ? 958  ARG   A C    1 1 
ATOM   4095 O  O    . ARG   A 1 268 ? 5.492   6.256   -36.244 1   38.41  ? 958  ARG   A O    1 1 
ATOM   4096 C  CB   . ARG   A 1 268 ? 2.414   7.048   -35.512 1   39.68  ? 958  ARG   A CB   1 1 
ATOM   4097 C  CG   . ARG   A 1 268 ? 0.921   7.121   -35.8   1   42.03  ? 958  ARG   A CG   1 1 
ATOM   4098 C  CD   . ARG   A 1 268 ? 0.096   6.67    -34.612 1   44.51  ? 958  ARG   A CD   1 1 
ATOM   4099 N  NE   . ARG   A 1 268 ? -1.271  6.319   -35     1   46.76  ? 958  ARG   A NE   1 1 
ATOM   4100 C  CZ   . ARG   A 1 268 ? -2.146  5.683   -34.226 1   48.44  ? 958  ARG   A CZ   1 1 
ATOM   4101 N  NH1  . ARG   A 1 268 ? -3.363  5.408   -34.678 1   48.06  ? 958  ARG   A NH1  1 1 
ATOM   4102 N  NH2  . ARG   A 1 268 ? -1.81   5.31    -32.993 1   48.1   ? 958  ARG   A NH2  1 1 
ATOM   4103 H  H    . ARG   A 1 268 ? 2.612   5.193   -37.151 0   42.5   ? 958  ARG   A H    1 1 
ATOM   4104 H  HA   . ARG   A 1 268 ? 3.015   7.975   -37.364 0   39.4   ? 958  ARG   A HA   1 1 
ATOM   4105 H  HB2  . ARG   A 1 268 ? 2.62    6.113   -34.995 0   40.77  ? 958  ARG   A HB2  1 1 
ATOM   4106 H  HB3  . ARG   A 1 268 ? 2.661   7.885   -34.861 0   39.01  ? 958  ARG   A HB3  1 1 
ATOM   4107 H  HG2  . ARG   A 1 268 ? 0.652   8.151   -36.028 0   41.67  ? 958  ARG   A HG2  1 1 
ATOM   4108 H  HG3  . ARG   A 1 268 ? 0.681   6.474   -36.642 0   43.58  ? 958  ARG   A HG3  1 1 
ATOM   4109 H  HD2  . ARG   A 1 268 ? 0.561   5.792   -34.164 0   45.42  ? 958  ARG   A HD2  1 1 
ATOM   4110 H  HD3  . ARG   A 1 268 ? 0.046   7.478   -33.884 0   43.71  ? 958  ARG   A HD3  1 1 
ATOM   4111 H  HE   . ARG   A 1 268 ? -1.58   6.585   -35.93  0   48.25  ? 958  ARG   A HE   1 1 
ATOM   4112 H  HH11 . ARG   A 1 268 ? -3.636  5.687   -35.615 0   51.33  ? 958  ARG   A HH11 1 1 
ATOM   4113 H  HH12 . ARG   A 1 268 ? -4.032  4.92    -34.09  0   51.67  ? 958  ARG   A HH12 1 1 
ATOM   4114 H  HH21 . ARG   A 1 268 ? -0.895  5.488   -32.593 0   48.92  ? 958  ARG   A HH21 1 1 
ATOM   4115 H  HH22 . ARG   A 1 268 ? -2.493  4.821   -32.423 0   50.19  ? 958  ARG   A HH22 1 1 
ATOM   4116 N  N    . PRO   A 1 269 ? 5.296   8.484   -35.951 1   37.9   ? 959  PRO   A N    1 1 
ATOM   4117 C  CA   . PRO   A 1 269 ? 6.692   8.569   -35.495 1   37.65  ? 959  PRO   A CA   1 1 
ATOM   4118 C  C    . PRO   A 1 269 ? 6.915   7.891   -34.146 1   37.46  ? 959  PRO   A C    1 1 
ATOM   4119 O  O    . PRO   A 1 269 ? 5.967   7.591   -33.429 1   37.44  ? 959  PRO   A O    1 1 
ATOM   4120 C  CB   . PRO   A 1 269 ? 6.955   10.081  -35.408 1   38.26  ? 959  PRO   A CB   1 1 
ATOM   4121 C  CG   . PRO   A 1 269 ? 5.808   10.735  -36.085 1   38.7   ? 959  PRO   A CG   1 1 
ATOM   4122 C  CD   . PRO   A 1 269 ? 4.661   9.816   -35.902 1   37.25  ? 959  PRO   A CD   1 1 
ATOM   4123 H  HA   . PRO   A 1 269 ? 7.365   8.135   -36.234 0   39.7   ? 959  PRO   A HA   1 1 
ATOM   4124 H  HB2  . PRO   A 1 269 ? 6.998   10.378  -34.361 0   37.44  ? 959  PRO   A HB2  1 1 
ATOM   4125 H  HB3  . PRO   A 1 269 ? 7.888   10.318  -35.916 0   38.84  ? 959  PRO   A HB3  1 1 
ATOM   4126 H  HG2  . PRO   A 1 269 ? 5.607   11.697  -35.616 0   36.89  ? 959  PRO   A HG2  1 1 
ATOM   4127 H  HG3  . PRO   A 1 269 ? 6.034   10.861  -37.143 0   38.28  ? 959  PRO   A HG3  1 1 
ATOM   4128 H  HD2  . PRO   A 1 269 ? 4.2     9.98    -34.929 0   35.43  ? 959  PRO   A HD2  1 1 
ATOM   4129 H  HD3  . PRO   A 1 269 ? 3.947   9.969   -36.709 0   36.24  ? 959  PRO   A HD3  1 1 
ATOM   4130 N  N    . LYS   A 1 270 ? 8.177   7.647   -33.807 1   37.17  ? 960  LYS   A N    1 1 
ATOM   4131 C  CA   . LYS   A 1 270 ? 8.544   7.058   -32.521 1   37.24  ? 960  LYS   A CA   1 1 
ATOM   4132 C  C    . LYS   A 1 270 ? 9.027   8.184   -31.602 1   37.06  ? 960  LYS   A C    1 1 
ATOM   4133 O  O    . LYS   A 1 270 ? 9.414   9.247   -32.097 1   37.08  ? 960  LYS   A O    1 1 
ATOM   4134 C  CB   . LYS   A 1 270 ? 9.636   5.985   -32.694 1   39.05  ? 960  LYS   A CB   1 1 
ATOM   4135 C  CG   . LYS   A 1 270 ? 9.361   4.947   -33.789 1   43.22  ? 960  LYS   A CG   1 1 
ATOM   4136 C  CD   . LYS   A 1 270 ? 8.198   3.993   -33.483 1   47.66  ? 960  LYS   A CD   1 1 
ATOM   4137 C  CE   . LYS   A 1 270 ? 7.809   3.15    -34.679 1   51.42  ? 960  LYS   A CE   1 1 
ATOM   4138 N  NZ   . LYS   A 1 270 ? 7.085   3.927   -35.729 1   53.54  ? 960  LYS   A NZ   1 1 
ATOM   4139 H  H    . LYS   A 1 270 ? 8.971   7.869   -34.399 0   39.8   ? 960  LYS   A H    1 1 
ATOM   4140 H  HA   . LYS   A 1 270 ? 7.687   6.587   -32.042 0   38.84  ? 960  LYS   A HA   1 1 
ATOM   4141 H  HB2  . LYS   A 1 270 ? 10.573  6.482   -32.941 0   43.87  ? 960  LYS   A HB2  1 1 
ATOM   4142 H  HB3  . LYS   A 1 270 ? 9.744   5.447   -31.753 0   43.52  ? 960  LYS   A HB3  1 1 
ATOM   4143 H  HG2  . LYS   A 1 270 ? 9.146   5.45    -34.731 0   48.69  ? 960  LYS   A HG2  1 1 
ATOM   4144 H  HG3  . LYS   A 1 270 ? 10.252  4.334   -33.911 0   50.67  ? 960  LYS   A HG3  1 1 
ATOM   4145 H  HD2  . LYS   A 1 270 ? 8.501   3.32    -32.683 0   53.76  ? 960  LYS   A HD2  1 1 
ATOM   4146 H  HD3  . LYS   A 1 270 ? 7.314   4.55    -33.178 0   51.66  ? 960  LYS   A HD3  1 1 
ATOM   4147 H  HE2  . LYS   A 1 270 ? 8.71    2.734   -35.126 0   60.15  ? 960  LYS   A HE2  1 1 
ATOM   4148 H  HE3  . LYS   A 1 270 ? 7.152   2.347   -34.346 0   59.44  ? 960  LYS   A HE3  1 1 
ATOM   4149 H  HZ1  . LYS   A 1 270 ? 6.704   3.292   -36.423 0   60.56  ? 960  LYS   A HZ1  1 1 
ATOM   4150 H  HZ2  . LYS   A 1 270 ? 6.324   4.456   -35.313 0   58.11  ? 960  LYS   A HZ2  1 1 
ATOM   4151 H  HZ3  . LYS   A 1 270 ? 7.715   4.57    -36.198 0   60.09  ? 960  LYS   A HZ3  1 1 
ATOM   4152 N  N    . PHE   A 1 271 ? 9.017   7.969   -30.274 1   36.72  ? 961  PHE   A N    1 1 
ATOM   4153 C  CA   . PHE   A 1 271 ? 9.471   9.009   -29.346 1   36.94  ? 961  PHE   A CA   1 1 
ATOM   4154 C  C    . PHE   A 1 271 ? 10.957  9.325   -29.532 1   37.45  ? 961  PHE   A C    1 1 
ATOM   4155 O  O    . PHE   A 1 271 ? 11.34   10.487  -29.399 1   37.52  ? 961  PHE   A O    1 1 
ATOM   4156 C  CB   . PHE   A 1 271 ? 9.131   8.679   -27.885 1   36.53  ? 961  PHE   A CB   1 1 
ATOM   4157 C  CG   . PHE   A 1 271 ? 7.649   8.653   -27.575 1   36.86  ? 961  PHE   A CG   1 1 
ATOM   4158 C  CD1  . PHE   A 1 271 ? 6.874   9.796   -27.701 1   37.51  ? 961  PHE   A CD1  1 1 
ATOM   4159 C  CD2  . PHE   A 1 271 ? 7.048   7.509   -27.08  1   37.43  ? 961  PHE   A CD2  1 1 
ATOM   4160 C  CE1  . PHE   A 1 271 ? 5.513   9.769   -27.419 1   38.07  ? 961  PHE   A CE1  1 1 
ATOM   4161 C  CE2  . PHE   A 1 271 ? 5.688   7.49    -26.786 1   38.1   ? 961  PHE   A CE2  1 1 
ATOM   4162 C  CZ   . PHE   A 1 271 ? 4.934   8.623   -26.945 1   37.81  ? 961  PHE   A CZ   1 1 
ATOM   4163 H  H    . PHE   A 1 271 ? 8.713   7.108   -29.829 0   37.86  ? 961  PHE   A H    1 1 
ATOM   4164 H  HA   . PHE   A 1 271 ? 8.933   9.922   -29.592 0   36.21  ? 961  PHE   A HA   1 1 
ATOM   4165 H  HB2  . PHE   A 1 271 ? 9.557   7.708   -27.635 0   37.37  ? 961  PHE   A HB2  1 1 
ATOM   4166 H  HB3  . PHE   A 1 271 ? 9.572   9.451   -27.256 0   36.26  ? 961  PHE   A HB3  1 1 
ATOM   4167 H  HD1  . PHE   A 1 271 ? 7.315   10.708  -28.067 0   34.81  ? 961  PHE   A HD1  1 1 
ATOM   4168 H  HD2  . PHE   A 1 271 ? 7.626   6.609   -26.957 0   37.33  ? 961  PHE   A HD2  1 1 
ATOM   4169 H  HE1  . PHE   A 1 271 ? 4.921   10.66   -27.536 0   33.99  ? 961  PHE   A HE1  1 1 
ATOM   4170 H  HE2  . PHE   A 1 271 ? 5.229   6.586   -26.425 0   36.48  ? 961  PHE   A HE2  1 1 
ATOM   4171 H  HZ   . PHE   A 1 271 ? 3.883   8.608   -26.711 0   34.27  ? 961  PHE   A HZ   1 1 
ATOM   4172 N  N    . ARG   A 1 272 ? 11.783  8.324   -29.915 1   37.71  ? 962  ARG   A N    1 1 
ATOM   4173 C  CA   . ARG   A 1 272 ? 13.203  8.57    -30.197 1   38.26  ? 962  ARG   A CA   1 1 
ATOM   4174 C  C    . ARG   A 1 272 ? 13.376  9.439   -31.46  1   38.15  ? 962  ARG   A C    1 1 
ATOM   4175 O  O    . ARG   A 1 272 ? 14.31   10.233  -31.517 1   38.32  ? 962  ARG   A O    1 1 
ATOM   4176 C  CB   . ARG   A 1 272 ? 14.019  7.257   -30.285 1   40.24  ? 962  ARG   A CB   1 1 
ATOM   4177 C  CG   . ARG   A 1 272 ? 13.727  6.34    -31.484 1   44.01  ? 962  ARG   A CG   1 1 
ATOM   4178 C  CD   . ARG   A 1 272 ? 14.349  4.964   -31.284 1   47.85  ? 962  ARG   A CD   1 1 
ATOM   4179 N  NE   . ARG   A 1 272 ? 13.571  4.142   -30.346 1   51.34  ? 962  ARG   A NE   1 1 
ATOM   4180 C  CZ   . ARG   A 1 272 ? 12.614  3.265   -30.662 1   53.68  ? 962  ARG   A CZ   1 1 
ATOM   4181 N  NH1  . ARG   A 1 272 ? 11.982  2.592   -29.706 1   53.18  ? 962  ARG   A NH1  1 1 
ATOM   4182 N  NH2  . ARG   A 1 272 ? 12.286  3.046   -31.935 1   53.76  ? 962  ARG   A NH2  1 1 
ATOM   4183 H  H    . ARG   A 1 272 ? 11.499  7.355   -30.014 0   41.53  ? 962  ARG   A H    1 1 
ATOM   4184 H  HA   . ARG   A 1 272 ? 13.621  9.137   -29.367 0   43.47  ? 962  ARG   A HA   1 1 
ATOM   4185 H  HB2  . ARG   A 1 272 ? 15.074  7.521   -30.342 0   49.16  ? 962  ARG   A HB2  1 1 
ATOM   4186 H  HB3  . ARG   A 1 272 ? 13.847  6.684   -29.375 0   47.45  ? 962  ARG   A HB3  1 1 
ATOM   4187 H  HG2  . ARG   A 1 272 ? 12.651  6.219   -31.595 0   50.44  ? 962  ARG   A HG2  1 1 
ATOM   4188 H  HG3  . ARG   A 1 272 ? 14.152  6.778   -32.387 0   52.42  ? 962  ARG   A HG3  1 1 
ATOM   4189 H  HD2  . ARG   A 1 272 ? 14.481  4.463   -32.242 0   58.79  ? 962  ARG   A HD2  1 1 
ATOM   4190 H  HD3  . ARG   A 1 272 ? 15.332  5.1     -30.835 0   59.74  ? 962  ARG   A HD3  1 1 
ATOM   4191 H  HE   . ARG   A 1 272 ? 13.773  4.271   -29.36  0   60.59  ? 962  ARG   A HE   1 1 
ATOM   4192 H  HH11 . ARG   A 1 272 ? 12.222  2.743   -28.732 0   62.06  ? 962  ARG   A HH11 1 1 
ATOM   4193 H  HH12 . ARG   A 1 272 ? 11.26   1.918   -29.941 0   63.12  ? 962  ARG   A HH12 1 1 
ATOM   4194 H  HH21 . ARG   A 1 272 ? 12.708  3.526   -32.722 0   65.03  ? 962  ARG   A HH21 1 1 
ATOM   4195 H  HH22 . ARG   A 1 272 ? 11.558  2.368   -32.139 0   65.05  ? 962  ARG   A HH22 1 1 
ATOM   4196 N  N    . GLU   A 1 273 ? 12.454  9.33    -32.437 1   37.74  ? 963  GLU   A N    1 1 
ATOM   4197 C  CA   . GLU   A 1 273 ? 12.462  10.148  -33.654 1   37.96  ? 963  GLU   A CA   1 1 
ATOM   4198 C  C    . GLU   A 1 273 ? 11.956  11.564  -33.341 1   37.97  ? 963  GLU   A C    1 1 
ATOM   4199 O  O    . GLU   A 1 273 ? 12.468  12.527  -33.912 1   38.21  ? 963  GLU   A O    1 1 
ATOM   4200 C  CB   . GLU   A 1 273 ? 11.573  9.523   -34.748 1   39.96  ? 963  GLU   A CB   1 1 
ATOM   4201 C  CG   . GLU   A 1 273 ? 12.134  8.25    -35.362 1   44.13  ? 963  GLU   A CG   1 1 
ATOM   4202 C  CD   . GLU   A 1 273 ? 11.168  7.467   -36.232 1   49.8   ? 963  GLU   A CD   1 1 
ATOM   4203 O  OE1  . GLU   A 1 273 ? 10.026  7.937   -36.443 1   50.68  ? 963  GLU   A OE1  1 1 
ATOM   4204 O  OE2  . GLU   A 1 273 ? 11.557  6.375   -36.704 1   52     ? 963  GLU   A OE2  1 1 
ATOM   4205 H  H    . GLU   A 1 273 ? 11.681  8.673   -32.412 0   41.67  ? 963  GLU   A H    1 1 
ATOM   4206 H  HA   . GLU   A 1 273 ? 13.476  10.222  -34.043 0   44.22  ? 963  GLU   A HA   1 1 
ATOM   4207 H  HB2  . GLU   A 1 273 ? 10.595  9.303   -34.323 0   43.08  ? 963  GLU   A HB2  1 1 
ATOM   4208 H  HB3  . GLU   A 1 273 ? 11.464  10.249  -35.553 0   44     ? 963  GLU   A HB3  1 1 
ATOM   4209 H  HG2  . GLU   A 1 273 ? 12.987  8.515   -35.984 0   51.83  ? 963  GLU   A HG2  1 1 
ATOM   4210 H  HG3  . GLU   A 1 273 ? 12.459  7.587   -34.561 0   51.15  ? 963  GLU   A HG3  1 1 
ATOM   4211 N  N    . LEU   A 1 274 ? 10.938  11.687  -32.459 1   37.6   ? 964  LEU   A N    1 1 
ATOM   4212 C  CA   . LEU   A 1 274 ? 10.374  12.982  -32.063 1   37.74  ? 964  LEU   A CA   1 1 
ATOM   4213 C  C    . LEU   A 1 274 ? 11.368  13.808  -31.236 1   38.22  ? 964  LEU   A C    1 1 
ATOM   4214 O  O    . LEU   A 1 274 ? 11.292  15.033  -31.267 1   38.51  ? 964  LEU   A O    1 1 
ATOM   4215 C  CB   . LEU   A 1 274 ? 9.051   12.809  -31.281 1   37.75  ? 964  LEU   A CB   1 1 
ATOM   4216 C  CG   . LEU   A 1 274 ? 7.849   12.249  -32.069 1   38.99  ? 964  LEU   A CG   1 1 
ATOM   4217 C  CD1  . LEU   A 1 274 ? 6.758   11.741  -31.14  1   39.37  ? 964  LEU   A CD1  1 1 
ATOM   4218 C  CD2  . LEU   A 1 274 ? 7.261   13.286  -33.012 1   39.54  ? 964  LEU   A CD2  1 1 
ATOM   4219 H  H    . LEU   A 1 274 ? 10.493  10.901  -31.998 0   38.74  ? 964  LEU   A H    1 1 
ATOM   4220 H  HA   . LEU   A 1 274 ? 10.169  13.556  -32.965 0   37.97  ? 964  LEU   A HA   1 1 
ATOM   4221 H  HB2  . LEU   A 1 274 ? 9.235   12.141  -30.441 0   36.66  ? 964  LEU   A HB2  1 1 
ATOM   4222 H  HB3  . LEU   A 1 274 ? 8.758   13.786  -30.899 0   35.99  ? 964  LEU   A HB3  1 1 
ATOM   4223 H  HG   . LEU   A 1 274 ? 8.193   11.407  -32.667 0   37.9   ? 964  LEU   A HG   1 1 
ATOM   4224 H  HD11 . LEU   A 1 274 ? 5.899   11.433  -31.734 0   36.4   ? 964  LEU   A HD11 1 1 
ATOM   4225 H  HD12 . LEU   A 1 274 ? 7.125   10.887  -30.575 0   36.99  ? 964  LEU   A HD12 1 1 
ATOM   4226 H  HD13 . LEU   A 1 274 ? 6.47    12.541  -30.459 0   35.98  ? 964  LEU   A HD13 1 1 
ATOM   4227 H  HD21 . LEU   A 1 274 ? 6.356   12.886  -33.467 0   36.94  ? 964  LEU   A HD21 1 1 
ATOM   4228 H  HD22 . LEU   A 1 274 ? 7.022   14.187  -32.447 0   36.69  ? 964  LEU   A HD22 1 1 
ATOM   4229 H  HD23 . LEU   A 1 274 ? 7.981   13.52   -33.795 0   37.98  ? 964  LEU   A HD23 1 1 
ATOM   4230 N  N    . ILE   A 1 275 ? 12.301  13.155  -30.509 1   38.17  ? 965  ILE   A N    1 1 
ATOM   4231 C  CA   . ILE   A 1 275 ? 13.336  13.864  -29.752 1   38.69  ? 965  ILE   A CA   1 1 
ATOM   4232 C  C    . ILE   A 1 275 ? 14.256  14.56   -30.765 1   39.07  ? 965  ILE   A C    1 1 
ATOM   4233 O  O    . ILE   A 1 275 ? 14.534  15.743  -30.619 1   39.12  ? 965  ILE   A O    1 1 
ATOM   4234 C  CB   . ILE   A 1 275 ? 14.154  12.901  -28.829 1   39.29  ? 965  ILE   A CB   1 1 
ATOM   4235 C  CG1  . ILE   A 1 275 ? 13.288  12.373  -27.66  1   40.15  ? 965  ILE   A CG1  1 1 
ATOM   4236 C  CG2  . ILE   A 1 275 ? 15.432  13.598  -28.294 1   39.78  ? 965  ILE   A CG2  1 1 
ATOM   4237 C  CD1  . ILE   A 1 275 ? 13.852  11.141  -26.948 1   41.25  ? 965  ILE   A CD1  1 1 
ATOM   4238 H  H    . ILE   A 1 275 ? 12.36   12.146  -30.43  0   40.61  ? 965  ILE   A H    1 1 
ATOM   4239 H  HA   . ILE   A 1 275 ? 12.876  14.628  -29.126 0   41.21  ? 965  ILE   A HA   1 1 
ATOM   4240 H  HB   . ILE   A 1 275 ? 14.472  12.052  -29.433 0   44.6   ? 965  ILE   A HB   1 1 
ATOM   4241 H  HG12 . ILE   A 1 275 ? 13.179  13.165  -26.921 0   42.89  ? 965  ILE   A HG12 1 1 
ATOM   4242 H  HG13 . ILE   A 1 275 ? 12.306  12.095  -28.041 0   42.02  ? 965  ILE   A HG13 1 1 
ATOM   4243 H  HG21 . ILE   A 1 275 ? 15.869  13.027  -27.476 0   47.12  ? 965  ILE   A HG21 1 1 
ATOM   4244 H  HG22 . ILE   A 1 275 ? 16.17   13.668  -29.092 0   47.39  ? 965  ILE   A HG22 1 1 
ATOM   4245 H  HG23 . ILE   A 1 275 ? 15.167  14.596  -27.947 0   45.61  ? 965  ILE   A HG23 1 1 
ATOM   4246 H  HD11 . ILE   A 1 275 ? 13.024  10.577  -26.523 0   44.46  ? 965  ILE   A HD11 1 1 
ATOM   4247 H  HD12 . ILE   A 1 275 ? 14.405  10.527  -27.656 0   46.04  ? 965  ILE   A HD12 1 1 
ATOM   4248 H  HD13 . ILE   A 1 275 ? 14.516  11.473  -26.151 0   46.85  ? 965  ILE   A HD13 1 1 
ATOM   4249 N  N    . ILE   A 1 276 ? 14.7    13.824  -31.797 1   39.26  ? 966  ILE   A N    1 1 
ATOM   4250 C  CA   . ILE   A 1 276 ? 15.605  14.342  -32.832 1   40.04  ? 966  ILE   A CA   1 1 
ATOM   4251 C  C    . ILE   A 1 276 ? 14.933  15.45   -33.658 1   40.44  ? 966  ILE   A C    1 1 
ATOM   4252 O  O    . ILE   A 1 276 ? 15.519  16.515  -33.843 1   40.54  ? 966  ILE   A O    1 1 
ATOM   4253 C  CB   . ILE   A 1 276 ? 16.14   13.175  -33.731 1   40.67  ? 966  ILE   A CB   1 1 
ATOM   4254 C  CG1  . ILE   A 1 276 ? 17.133  12.272  -32.938 1   41.84  ? 966  ILE   A CG1  1 1 
ATOM   4255 C  CG2  . ILE   A 1 276 ? 16.806  13.71   -35.021 1   41.07  ? 966  ILE   A CG2  1 1 
ATOM   4256 C  CD1  . ILE   A 1 276 ? 17.177  10.799  -33.386 1   43.36  ? 966  ILE   A CD1  1 1 
ATOM   4257 H  H    . ILE   A 1 276 ? 14.435  12.855  -31.944 0   45     ? 966  ILE   A H    1 1 
ATOM   4258 H  HA   . ILE   A 1 276 ? 16.466  14.786  -32.335 0   49.08  ? 966  ILE   A HA   1 1 
ATOM   4259 H  HB   . ILE   A 1 276 ? 15.29   12.568  -34.042 0   48.62  ? 966  ILE   A HB   1 1 
ATOM   4260 H  HG12 . ILE   A 1 276 ? 18.138  12.676  -33.05  0   54.74  ? 966  ILE   A HG12 1 1 
ATOM   4261 H  HG13 . ILE   A 1 276 ? 16.866  12.27   -31.882 0   51.97  ? 966  ILE   A HG13 1 1 
ATOM   4262 H  HG21 . ILE   A 1 276 ? 17.451  12.941  -35.443 0   53.06  ? 966  ILE   A HG21 1 1 
ATOM   4263 H  HG22 . ILE   A 1 276 ? 16.034  13.958  -35.748 0   50.64  ? 966  ILE   A HG22 1 1 
ATOM   4264 H  HG23 . ILE   A 1 276 ? 17.398  14.593  -34.784 0   53.26  ? 966  ILE   A HG23 1 1 
ATOM   4265 H  HD11 . ILE   A 1 276 ? 17.872  10.256  -32.747 0   56.79  ? 966  ILE   A HD11 1 1 
ATOM   4266 H  HD12 . ILE   A 1 276 ? 16.18   10.372  -33.296 0   53.65  ? 966  ILE   A HD12 1 1 
ATOM   4267 H  HD13 . ILE   A 1 276 ? 17.51   10.748  -34.422 0   56.39  ? 966  ILE   A HD13 1 1 
ATOM   4268 N  N    . GLU   A 1 277 ? 13.716  15.195  -34.147 1   40.51  ? 967  GLU   A N    1 1 
ATOM   4269 C  CA   . GLU   A 1 277 ? 12.976  16.151  -34.967 1   41.17  ? 967  GLU   A CA   1 1 
ATOM   4270 C  C    . GLU   A 1 277 ? 12.727  17.479  -34.231 1   41.21  ? 967  GLU   A C    1 1 
ATOM   4271 O  O    . GLU   A 1 277 ? 13.036  18.537  -34.78  1   41.27  ? 967  GLU   A O    1 1 
ATOM   4272 C  CB   . GLU   A 1 277 ? 11.656  15.513  -35.445 1   43.97  ? 967  GLU   A CB   1 1 
ATOM   4273 C  CG   . GLU   A 1 277 ? 10.782  16.369  -36.346 1   49.72  ? 967  GLU   A CG   1 1 
ATOM   4274 C  CD   . GLU   A 1 277 ? 11.23   16.559  -37.781 1   57.49  ? 967  GLU   A CD   1 1 
ATOM   4275 O  OE1  . GLU   A 1 277 ? 10.376  16.954  -38.607 1   58.85  ? 967  GLU   A OE1  1 1 
ATOM   4276 O  OE2  . GLU   A 1 277 ? 12.42   16.315  -38.088 1   60.31  ? 967  GLU   A OE2  1 1 
ATOM   4277 H  H    . GLU   A 1 277 ? 13.22   14.323  -33.991 0   44.78  ? 967  GLU   A H    1 1 
ATOM   4278 H  HA   . GLU   A 1 277 ? 13.57   16.366  -35.854 0   46.61  ? 967  GLU   A HA   1 1 
ATOM   4279 H  HB2  . GLU   A 1 277 ? 11.897  14.606  -35.997 0   47.17  ? 967  GLU   A HB2  1 1 
ATOM   4280 H  HB3  . GLU   A 1 277 ? 11.063  15.256  -34.568 0   45.56  ? 967  GLU   A HB3  1 1 
ATOM   4281 H  HG2  . GLU   A 1 277 ? 9.808   15.886  -36.394 0   50.5   ? 967  GLU   A HG2  1 1 
ATOM   4282 H  HG3  . GLU   A 1 277 ? 10.655  17.36   -35.911 0   51.51  ? 967  GLU   A HG3  1 1 
ATOM   4283 N  N    . PHE   A 1 278 ? 12.188  17.431  -33.002 1   41.21  ? 968  PHE   A N    1 1 
ATOM   4284 C  CA   . PHE   A 1 278 ? 11.933  18.655  -32.24  1   41.79  ? 968  PHE   A CA   1 1 
ATOM   4285 C  C    . PHE   A 1 278 ? 13.221  19.291  -31.707 1   42.92  ? 968  PHE   A C    1 1 
ATOM   4286 O  O    . PHE   A 1 278 ? 13.229  20.503  -31.506 1   43.01  ? 968  PHE   A O    1 1 
ATOM   4287 C  CB   . PHE   A 1 278 ? 10.917  18.427  -31.098 1   41.49  ? 968  PHE   A CB   1 1 
ATOM   4288 C  CG   . PHE   A 1 278 ? 9.462   18.463  -31.516 1   41.64  ? 968  PHE   A CG   1 1 
ATOM   4289 C  CD1  . PHE   A 1 278 ? 8.834   19.664  -31.792 1   42.26  ? 968  PHE   A CD1  1 1 
ATOM   4290 C  CD2  . PHE   A 1 278 ? 8.726   17.299  -31.625 1   42.27  ? 968  PHE   A CD2  1 1 
ATOM   4291 C  CE1  . PHE   A 1 278 ? 7.501   19.696  -32.178 1   42.8   ? 968  PHE   A CE1  1 1 
ATOM   4292 C  CE2  . PHE   A 1 278 ? 7.389   17.338  -31.994 1   42.81  ? 968  PHE   A CE2  1 1 
ATOM   4293 C  CZ   . PHE   A 1 278 ? 6.787   18.534  -32.277 1   42.56  ? 968  PHE   A CZ   1 1 
ATOM   4294 H  H    . PHE   A 1 278 ? 11.922  16.573  -32.53  0   43.31  ? 968  PHE   A H    1 1 
ATOM   4295 H  HA   . PHE   A 1 278 ? 11.511  19.391  -32.923 0   44.35  ? 968  PHE   A HA   1 1 
ATOM   4296 H  HB2  . PHE   A 1 278 ? 11.11   17.465  -30.625 0   42.46  ? 968  PHE   A HB2  1 1 
ATOM   4297 H  HB3  . PHE   A 1 278 ? 11.053  19.219  -30.364 0   43.1   ? 968  PHE   A HB3  1 1 
ATOM   4298 H  HD1  . PHE   A 1 278 ? 9.39    20.584  -31.719 0   43.04  ? 968  PHE   A HD1  1 1 
ATOM   4299 H  HD2  . PHE   A 1 278 ? 9.188   16.351  -31.407 0   41.07  ? 968  PHE   A HD2  1 1 
ATOM   4300 H  HE1  . PHE   A 1 278 ? 7.026   20.638  -32.394 0   41.8   ? 968  PHE   A HE1  1 1 
ATOM   4301 H  HE2  . PHE   A 1 278 ? 6.829   16.422  -32.08  0   39.87  ? 968  PHE   A HE2  1 1 
ATOM   4302 H  HZ   . PHE   A 1 278 ? 5.752   18.56   -32.571 0   39.73  ? 968  PHE   A HZ   1 1 
ATOM   4303 N  N    . SER   A 1 279 ? 14.303  18.509  -31.482 1   43.47  ? 969  SER   A N    1 1 
ATOM   4304 C  CA   . SER   A 1 279 ? 15.584  19.074  -31.037 1   44.65  ? 969  SER   A CA   1 1 
ATOM   4305 C  C    . SER   A 1 279 ? 16.195  19.903  -32.162 1   45.73  ? 969  SER   A C    1 1 
ATOM   4306 O  O    . SER   A 1 279 ? 16.729  20.978  -31.9   1   46.05  ? 969  SER   A O    1 1 
ATOM   4307 C  CB   . SER   A 1 279 ? 16.562  17.981  -30.616 1   45.9   ? 969  SER   A CB   1 1 
ATOM   4308 O  OG   . SER   A 1 279 ? 16.167  17.358  -29.404 1   47.88  ? 969  SER   A OG   1 1 
ATOM   4309 H  H    . SER   A 1 279 ? 14.318  17.499  -31.574 0   48.98  ? 969  SER   A H    1 1 
ATOM   4310 H  HA   . SER   A 1 279 ? 15.416  19.728  -30.183 0   52.68  ? 969  SER   A HA   1 1 
ATOM   4311 H  HB2  . SER   A 1 279 ? 16.62   17.228  -31.4   0   55.26  ? 969  SER   A HB2  1 1 
ATOM   4312 H  HB3  . SER   A 1 279 ? 17.543  18.432  -30.47  0   57.26  ? 969  SER   A HB3  1 1 
ATOM   4313 H  HG   . SER   A 1 279 ? 15.279  16.926  -29.505 0   54.46  ? 969  SER   A HG   1 1 
ATOM   4314 N  N    . LYS   A 1 280 ? 16.094  19.422  -33.415 1   46.46  ? 970  LYS   A N    1 1 
ATOM   4315 C  CA   . LYS   A 1 280 ? 16.551  20.151  -34.6   1   47.67  ? 970  LYS   A CA   1 1 
ATOM   4316 C  C    . LYS   A 1 280 ? 15.793  21.485  -34.704 1   48.85  ? 970  LYS   A C    1 1 
ATOM   4317 O  O    . LYS   A 1 280 ? 16.4    22.519  -34.975 1   49.12  ? 970  LYS   A O    1 1 
ATOM   4318 C  CB   . LYS   A 1 280 ? 16.315  19.297  -35.863 1   49.68  ? 970  LYS   A CB   1 1 
ATOM   4319 C  CG   . LYS   A 1 280 ? 16.703  19.956  -37.19  1   54.07  ? 970  LYS   A CG   1 1 
ATOM   4320 C  CD   . LYS   A 1 280 ? 16.188  19.16   -38.395 1   59.05  ? 970  LYS   A CD   1 1 
ATOM   4321 C  CE   . LYS   A 1 280 ? 14.784  19.549  -38.816 1   63.13  ? 970  LYS   A CE   1 1 
ATOM   4322 N  NZ   . LYS   A 1 280 ? 14.243  18.642  -39.861 1   65.75  ? 970  LYS   A NZ   1 1 
ATOM   4323 H  H    . LYS   A 1 280 ? 15.718  18.505  -33.631 0   55.06  ? 970  LYS   A H    1 1 
ATOM   4324 H  HA   . LYS   A 1 280 ? 17.617  20.36   -34.513 0   60.93  ? 970  LYS   A HA   1 1 
ATOM   4325 H  HB2  . LYS   A 1 280 ? 16.902  18.384  -35.771 0   61.13  ? 970  LYS   A HB2  1 1 
ATOM   4326 H  HB3  . LYS   A 1 280 ? 15.257  19.043  -35.907 0   58.42  ? 970  LYS   A HB3  1 1 
ATOM   4327 H  HG2  . LYS   A 1 280 ? 16.287  20.959  -37.26  0   65.91  ? 970  LYS   A HG2  1 1 
ATOM   4328 H  HG3  . LYS   A 1 280 ? 17.789  19.999  -37.258 0   68.37  ? 970  LYS   A HG3  1 1 
ATOM   4329 H  HD2  . LYS   A 1 280 ? 16.85   19.338  -39.241 0   72.04  ? 970  LYS   A HD2  1 1 
ATOM   4330 H  HD3  . LYS   A 1 280 ? 16.182  18.099  -38.149 0   70.2   ? 970  LYS   A HD3  1 1 
ATOM   4331 H  HE2  . LYS   A 1 280 ? 14.119  19.499  -37.955 0   70.83  ? 970  LYS   A HE2  1 1 
ATOM   4332 H  HE3  . LYS   A 1 280 ? 14.798  20.561  -39.218 0   72.68  ? 970  LYS   A HE3  1 1 
ATOM   4333 H  HZ1  . LYS   A 1 280 ? 13.45   19.079  -40.32  0   73.91  ? 970  LYS   A HZ1  1 1 
ATOM   4334 H  HZ2  . LYS   A 1 280 ? 14.955  18.435  -40.554 0   75.69  ? 970  LYS   A HZ2  1 1 
ATOM   4335 H  HZ3  . LYS   A 1 280 ? 13.934  17.774  -39.435 0   72.92  ? 970  LYS   A HZ3  1 1 
ATOM   4336 N  N    . MET   A 1 281 ? 14.476  21.457  -34.459 1   49.34  ? 971  MET   A N    1 1 
ATOM   4337 C  CA   . MET   A 1 281 ? 13.633  22.651  -34.496 1   50.27  ? 971  MET   A CA   1 1 
ATOM   4338 C  C    . MET   A 1 281 ? 13.956  23.622  -33.355 1   51.48  ? 971  MET   A C    1 1 
ATOM   4339 O  O    . MET   A 1 281 ? 13.851  24.829  -33.549 1   51.61  ? 971  MET   A O    1 1 
ATOM   4340 C  CB   . MET   A 1 281 ? 12.147  22.262  -34.445 1   50.48  ? 971  MET   A CB   1 1 
ATOM   4341 C  CG   . MET   A 1 281 ? 11.671  21.567  -35.694 1   51.72  ? 971  MET   A CG   1 1 
ATOM   4342 S  SD   . MET   A 1 281 ? 9.927   21.134  -35.64  1   52.82  ? 971  MET   A SD   1 1 
ATOM   4343 C  CE   . MET   A 1 281 ? 9.681   20.734  -37.327 1   51     ? 971  MET   A CE   1 1 
ATOM   4344 H  H    . MET   A 1 281 ? 13.969  20.61   -34.225 0   56.26  ? 971  MET   A H    1 1 
ATOM   4345 H  HA   . MET   A 1 281 ? 13.815  23.17   -35.436 0   59.15  ? 971  MET   A HA   1 1 
ATOM   4346 H  HB2  . MET   A 1 281 ? 11.973  21.599  -33.6   0   55.14  ? 971  MET   A HB2  1 1 
ATOM   4347 H  HB3  . MET   A 1 281 ? 11.554  23.168  -34.327 0   55.99  ? 971  MET   A HB3  1 1 
ATOM   4348 H  HG2  . MET   A 1 281 ? 11.828  22.229  -36.544 0   57.35  ? 971  MET   A HG2  1 1 
ATOM   4349 H  HG3  . MET   A 1 281 ? 12.238  20.647  -35.829 0   56.66  ? 971  MET   A HG3  1 1 
ATOM   4350 H  HE1  . MET   A 1 281 ? 8.617   20.578  -37.503 0   52.34  ? 971  MET   A HE1  1 1 
ATOM   4351 H  HE2  . MET   A 1 281 ? 10.036  21.559  -37.944 0   54.39  ? 971  MET   A HE2  1 1 
ATOM   4352 H  HE3  . MET   A 1 281 ? 10.236  19.828  -37.563 0   53.8   ? 971  MET   A HE3  1 1 
ATOM   4353 N  N    . ALA   A 1 282 ? 14.347  23.11   -32.175 1   52.19  ? 972  ALA   A N    1 1 
ATOM   4354 C  CA   . ALA   A 1 282 ? 14.717  23.942  -31.029 1   53.42  ? 972  ALA   A CA   1 1 
ATOM   4355 C  C    . ALA   A 1 282 ? 16.038  24.702  -31.245 1   54.61  ? 972  ALA   A C    1 1 
ATOM   4356 O  O    . ALA   A 1 282 ? 16.268  25.705  -30.574 1   54.82  ? 972  ALA   A O    1 1 
ATOM   4357 C  CB   . ALA   A 1 282 ? 14.819  23.085  -29.778 1   53.59  ? 972  ALA   A CB   1 1 
ATOM   4358 H  H    . ALA   A 1 282 ? 14.4    22.117  -31.972 0   60.48  ? 972  ALA   A H    1 1 
ATOM   4359 H  HA   . ALA   A 1 282 ? 13.932  24.679  -30.862 0   63.45  ? 972  ALA   A HA   1 1 
ATOM   4360 H  HB1  . ALA   A 1 282 ? 15.061  23.725  -28.93  0   64.39  ? 972  ALA   A HB1  1 1 
ATOM   4361 H  HB2  . ALA   A 1 282 ? 13.863  22.591  -29.611 0   61.33  ? 972  ALA   A HB2  1 1 
ATOM   4362 H  HB3  . ALA   A 1 282 ? 15.603  22.342  -29.919 0   63.81  ? 972  ALA   A HB3  1 1 
ATOM   4363 N  N    . ARG   A 1 283 ? 16.907  24.236  -32.161 1   55.27  ? 973  ARG   A N    1 1 
ATOM   4364 C  CA   . ARG   A 1 283 ? 18.174  24.915  -32.446 1   56.33  ? 973  ARG   A CA   1 1 
ATOM   4365 C  C    . ARG   A 1 283 ? 17.955  26.212  -33.259 1   57.33  ? 973  ARG   A C    1 1 
ATOM   4366 O  O    . ARG   A 1 283 ? 18.772  27.129  -33.164 1   57.59  ? 973  ARG   A O    1 1 
ATOM   4367 C  CB   . ARG   A 1 283 ? 19.155  23.971  -33.163 1   57.73  ? 973  ARG   A CB   1 1 
ATOM   4368 C  CG   . ARG   A 1 283 ? 19.606  22.798  -32.29  1   60.47  ? 973  ARG   A CG   1 1 
ATOM   4369 C  CD   . ARG   A 1 283 ? 20.875  22.126  -32.793 1   63.12  ? 973  ARG   A CD   1 1 
ATOM   4370 N  NE   . ARG   A 1 283 ? 20.67   21.377  -34.033 1   65.02  ? 973  ARG   A NE   1 1 
ATOM   4371 C  CZ   . ARG   A 1 283 ? 20.174  20.14   -34.126 1   66.15  ? 973  ARG   A CZ   1 1 
ATOM   4372 N  NH1  . ARG   A 1 283 ? 19.788  19.481  -33.034 1   65.51  ? 973  ARG   A NH1  1 1 
ATOM   4373 N  NH2  . ARG   A 1 283 ? 20.047  19.557  -35.313 1   65.57  ? 973  ARG   A NH2  1 1 
ATOM   4374 H  H    . ARG   A 1 283 ? 16.76   23.404  -32.724 0   68.79  ? 973  ARG   A H    1 1 
ATOM   4375 H  HA   . ARG   A 1 283 ? 18.638  25.203  -31.504 0   75.35  ? 973  ARG   A HA   1 1 
ATOM   4376 H  HB2  . ARG   A 1 283 ? 18.679  23.564  -34.054 0   75.46  ? 973  ARG   A HB2  1 1 
ATOM   4377 H  HB3  . ARG   A 1 283 ? 20.038  24.541  -33.446 0   79.26  ? 973  ARG   A HB3  1 1 
ATOM   4378 H  HG2  . ARG   A 1 283 ? 19.799  23.156  -31.279 0   79.75  ? 973  ARG   A HG2  1 1 
ATOM   4379 H  HG3  . ARG   A 1 283 ? 18.817  22.048  -32.273 0   76.82  ? 973  ARG   A HG3  1 1 
ATOM   4380 H  HD2  . ARG   A 1 283 ? 21.616  22.897  -32.998 0   86.75  ? 973  ARG   A HD2  1 1 
ATOM   4381 H  HD3  . ARG   A 1 283 ? 21.265  21.462  -32.023 0   84.49  ? 973  ARG   A HD3  1 1 
ATOM   4382 H  HE   . ARG   A 1 283 ? 20.954  21.835  -34.893 0   86.51  ? 973  ARG   A HE   1 1 
ATOM   4383 H  HH11 . ARG   A 1 283 ? 19.848  19.872  -32.1   0   82.75  ? 973  ARG   A HH11 1 1 
ATOM   4384 H  HH12 . ARG   A 1 283 ? 19.405  18.546  -33.133 0   81.33  ? 973  ARG   A HH12 1 1 
ATOM   4385 H  HH21 . ARG   A 1 283 ? 20.336  20.043  -36.155 0   85     ? 973  ARG   A HH21 1 1 
ATOM   4386 H  HH22 . ARG   A 1 283 ? 19.664  18.619  -35.384 0   82.66  ? 973  ARG   A HH22 1 1 
ATOM   4387 N  N    . ASP   A 1 284 ? 16.87   26.281  -34.059 1   57.62  ? 974  ASP   A N    1 1 
ATOM   4388 C  CA   . ASP   A 1 284 ? 16.483  27.461  -34.84  1   58.43  ? 974  ASP   A CA   1 1 
ATOM   4389 C  C    . ASP   A 1 284 ? 14.964  27.623  -34.603 1   58.61  ? 974  ASP   A C    1 1 
ATOM   4390 O  O    . ASP   A 1 284 ? 14.174  27.252  -35.468 1   58.69  ? 974  ASP   A O    1 1 
ATOM   4391 C  CB   . ASP   A 1 284 ? 16.813  27.236  -36.333 1   60.53  ? 974  ASP   A CB   1 1 
ATOM   4392 C  CG   . ASP   A 1 284 ? 16.607  28.441  -37.235 1   65.7   ? 974  ASP   A CG   1 1 
ATOM   4393 O  OD1  . ASP   A 1 284 ? 16.259  29.525  -36.713 1   66.58  ? 974  ASP   A OD1  1 1 
ATOM   4394 O  OD2  . ASP   A 1 284 ? 16.808  28.304  -38.462 1   67.96  ? 974  ASP   A OD2  1 1 
ATOM   4395 H  H    . ASP   A 1 284 ? 16.233  25.506  -34.217 0   72.62  ? 974  ASP   A H    1 1 
ATOM   4396 H  HA   . ASP   A 1 284 ? 17.012  28.351  -34.504 0   78.73  ? 974  ASP   A HA   1 1 
ATOM   4397 H  HB2  . ASP   A 1 284 ? 17.866  26.969  -36.403 0   80.78  ? 974  ASP   A HB2  1 1 
ATOM   4398 H  HB3  . ASP   A 1 284 ? 16.215  26.414  -36.723 0   77.06  ? 974  ASP   A HB3  1 1 
ATOM   4399 N  N    . PRO   A 1 285 ? 14.523  28.074  -33.403 1   58.54  ? 975  PRO   A N    1 1 
ATOM   4400 C  CA   . PRO   A 1 285 ? 13.077  28.094  -33.116 1   58.72  ? 975  PRO   A CA   1 1 
ATOM   4401 C  C    . PRO   A 1 285 ? 12.204  29.044  -33.936 1   59.18  ? 975  PRO   A C    1 1 
ATOM   4402 O  O    . PRO   A 1 285 ? 11.066  28.686  -34.24  1   59.28  ? 975  PRO   A O    1 1 
ATOM   4403 C  CB   . PRO   A 1 285 ? 13.015  28.451  -31.629 1   59.3   ? 975  PRO   A CB   1 1 
ATOM   4404 C  CG   . PRO   A 1 285 ? 14.285  29.135  -31.337 1   59.64  ? 975  PRO   A CG   1 1 
ATOM   4405 C  CD   . PRO   A 1 285 ? 15.305  28.503  -32.224 1   58.03  ? 975  PRO   A CD   1 1 
ATOM   4406 H  HA   . PRO   A 1 285 ? 12.678  27.087  -33.232 0   70.07  ? 975  PRO   A HA   1 1 
ATOM   4407 H  HB2  . PRO   A 1 285 ? 12.169  29.111  -31.443 0   72.97  ? 975  PRO   A HB2  1 1 
ATOM   4408 H  HB3  . PRO   A 1 285 ? 12.932  27.54   -31.038 0   71.57  ? 975  PRO   A HB3  1 1 
ATOM   4409 H  HG2  . PRO   A 1 285 ? 14.187  30.196  -31.565 0   78.07  ? 975  PRO   A HG2  1 1 
ATOM   4410 H  HG3  . PRO   A 1 285 ? 14.545  28.989  -30.29  0   76.69  ? 975  PRO   A HG3  1 1 
ATOM   4411 H  HD2  . PRO   A 1 285 ? 16.054  29.245  -32.5   0   77.81  ? 975  PRO   A HD2  1 1 
ATOM   4412 H  HD3  . PRO   A 1 285 ? 15.756  27.642  -31.733 0   74.87  ? 975  PRO   A HD3  1 1 
ATOM   4413 N  N    . GLN   A 1 286 ? 12.703  30.237  -34.282 1   59.22  ? 976  GLN   A N    1 1 
ATOM   4414 C  CA   . GLN   A 1 286 ? 11.908  31.207  -35.046 1   59.75  ? 976  GLN   A CA   1 1 
ATOM   4415 C  C    . GLN   A 1 286 ? 11.593  30.751  -36.482 1   59.84  ? 976  GLN   A C    1 1 
ATOM   4416 O  O    . GLN   A 1 286 ? 10.651  31.262  -37.084 1   59.92  ? 976  GLN   A O    1 1 
ATOM   4417 C  CB   . GLN   A 1 286 ? 12.588  32.589  -35.047 1   61.57  ? 976  GLN   A CB   1 1 
ATOM   4418 C  CG   . GLN   A 1 286 ? 12.551  33.288  -33.688 1   65.34  ? 976  GLN   A CG   1 1 
ATOM   4419 C  CD   . GLN   A 1 286 ? 13.532  34.427  -33.599 1   70.06  ? 976  GLN   A CD   1 1 
ATOM   4420 O  OE1  . GLN   A 1 286 ? 13.897  35.045  -34.607 1   71.79  ? 976  GLN   A OE1  1 1 
ATOM   4421 N  NE2  . GLN   A 1 286 ? 13.981  34.743  -32.389 1   70.59  ? 976  GLN   A NE2  1 1 
ATOM   4422 H  H    . GLN   A 1 286 ? 13.644  30.544  -34.058 0   77.3   ? 976  GLN   A H    1 1 
ATOM   4423 H  HA   . GLN   A 1 286 ? 10.947  31.319  -34.546 0   75.65  ? 976  GLN   A HA   1 1 
ATOM   4424 H  HB2  . GLN   A 1 286 ? 13.629  32.476  -35.345 0   83.18  ? 976  GLN   A HB2  1 1 
ATOM   4425 H  HB3  . GLN   A 1 286 ? 12.07   33.23   -35.76  0   82.55  ? 976  GLN   A HB3  1 1 
ATOM   4426 H  HG2  . GLN   A 1 286 ? 11.552  33.69   -33.525 0   86.58  ? 976  GLN   A HG2  1 1 
ATOM   4427 H  HG3  . GLN   A 1 286 ? 12.794  32.568  -32.908 0   85.97  ? 976  GLN   A HG3  1 1 
ATOM   4428 H  HE21 . GLN   A 1 286 ? 13.667  34.237  -31.567 0   96.14  ? 976  GLN   A HE21 1 1 
ATOM   4429 H  HE22 . GLN   A 1 286 ? 14.645  35.503  -32.285 0   100.47 ? 976  GLN   A HE22 1 1 
ATOM   4430 N  N    . ARG   A 1 287 ? 12.358  29.791  -37.021 1   59.74  ? 977  ARG   A N    1 1 
ATOM   4431 C  CA   . ARG   A 1 287 ? 12.112  29.236  -38.351 1   60.02  ? 977  ARG   A CA   1 1 
ATOM   4432 C  C    . ARG   A 1 287 ? 10.834  28.385  -38.359 1   59.89  ? 977  ARG   A C    1 1 
ATOM   4433 O  O    . ARG   A 1 287 ? 10.085  28.425  -39.334 1   59.96  ? 977  ARG   A O    1 1 
ATOM   4434 C  CB   . ARG   A 1 287 ? 13.318  28.368  -38.781 1   61.52  ? 977  ARG   A CB   1 1 
ATOM   4435 C  CG   . ARG   A 1 287 ? 13.189  27.665  -40.134 1   64.44  ? 977  ARG   A CG   1 1 
ATOM   4436 C  CD   . ARG   A 1 287 ? 14.437  26.861  -40.443 1   67.68  ? 977  ARG   A CD   1 1 
ATOM   4437 N  NE   . ARG   A 1 287 ? 14.326  26.083  -41.678 1   71.19  ? 977  ARG   A NE   1 1 
ATOM   4438 C  CZ   . ARG   A 1 287 ? 15.312  25.361  -42.21  1   73.81  ? 977  ARG   A CZ   1 1 
ATOM   4439 N  NH1  . ARG   A 1 287 ? 16.504  25.306  -41.619 1   73.57  ? 977  ARG   A NH1  1 1 
ATOM   4440 N  NH2  . ARG   A 1 287 ? 15.115  24.687  -43.338 1   73.86  ? 977  ARG   A NH2  1 1 
ATOM   4441 H  H    . ARG   A 1 287 ? 13.17   29.389  -36.565 0   75.26  ? 977  ARG   A H    1 1 
ATOM   4442 H  HA   . ARG   A 1 287 ? 11.995  30.045  -39.071 0   75.5   ? 977  ARG   A HA   1 1 
ATOM   4443 H  HB2  . ARG   A 1 287 ? 14.199  29.006  -38.829 0   78.44  ? 977  ARG   A HB2  1 1 
ATOM   4444 H  HB3  . ARG   A 1 287 ? 13.47   27.59   -38.033 0   75.27  ? 977  ARG   A HB3  1 1 
ATOM   4445 H  HG2  . ARG   A 1 287 ? 12.352  26.968  -40.122 0   76.26  ? 977  ARG   A HG2  1 1 
ATOM   4446 H  HG3  . ARG   A 1 287 ? 13.054  28.408  -40.919 0   79.22  ? 977  ARG   A HG3  1 1 
ATOM   4447 H  HD2  . ARG   A 1 287 ? 15.278  27.545  -40.547 0   84.82  ? 977  ARG   A HD2  1 1 
ATOM   4448 H  HD3  . ARG   A 1 287 ? 14.621  26.166  -39.625 0   81.86  ? 977  ARG   A HD3  1 1 
ATOM   4449 H  HE   . ARG   A 1 287 ? 13.435  26.096  -42.164 0   84.46  ? 977  ARG   A HE   1 1 
ATOM   4450 H  HH11 . ARG   A 1 287 ? 16.712  25.799  -40.757 0   91.25  ? 977  ARG   A HH11 1 1 
ATOM   4451 H  HH12 . ARG   A 1 287 ? 17.241  24.75   -42.041 0   91.94  ? 977  ARG   A HH12 1 1 
ATOM   4452 H  HH21 . ARG   A 1 287 ? 14.214  24.719  -43.803 0   87.82  ? 977  ARG   A HH21 1 1 
ATOM   4453 H  HH22 . ARG   A 1 287 ? 15.867  24.138  -43.742 0   90.09  ? 977  ARG   A HH22 1 1 
ATOM   4454 N  N    . TYR   A 1 288 ? 10.588  27.616  -37.283 1   59.59  ? 978  TYR   A N    1 1 
ATOM   4455 C  CA   . TYR   A 1 288 ? 9.468   26.678  -37.211 1   59.85  ? 978  TYR   A CA   1 1 
ATOM   4456 C  C    . TYR   A 1 288 ? 8.193   27.203  -36.522 1   60.58  ? 978  TYR   A C    1 1 
ATOM   4457 O  O    . TYR   A 1 288 ? 7.129   26.638  -36.77  1   60.55  ? 978  TYR   A O    1 1 
ATOM   4458 C  CB   . TYR   A 1 288 ? 9.948   25.376  -36.555 1   59.49  ? 978  TYR   A CB   1 1 
ATOM   4459 C  CG   . TYR   A 1 288 ? 11.042  24.717  -37.365 1   59.82  ? 978  TYR   A CG   1 1 
ATOM   4460 C  CD1  . TYR   A 1 288 ? 10.743  23.986  -38.505 1   60.48  ? 978  TYR   A CD1  1 1 
ATOM   4461 C  CD2  . TYR   A 1 288 ? 12.379  24.93   -37.067 1   60.63  ? 978  TYR   A CD2  1 1 
ATOM   4462 C  CE1  . TYR   A 1 288 ? 11.743  23.42   -39.284 1   61.28  ? 978  TYR   A CE1  1 1 
ATOM   4463 C  CE2  . TYR   A 1 288 ? 13.391  24.381  -37.845 1   61.42  ? 978  TYR   A CE2  1 1 
ATOM   4464 C  CZ   . TYR   A 1 288 ? 13.069  23.629  -38.959 1   62.16  ? 978  TYR   A CZ   1 1 
ATOM   4465 O  OH   . TYR   A 1 288 ? 14.053  23.063  -39.733 1   63.41  ? 978  TYR   A OH   1 1 
ATOM   4466 H  H    . TYR   A 1 288 ? 11.156  27.609  -36.442 0   69.97  ? 978  TYR   A H    1 1 
ATOM   4467 H  HA   . TYR   A 1 288 ? 9.162   26.421  -38.224 0   67.15  ? 978  TYR   A HA   1 1 
ATOM   4468 H  HB2  . TYR   A 1 288 ? 10.342  25.594  -35.563 0   66.3   ? 978  TYR   A HB2  1 1 
ATOM   4469 H  HB3  . TYR   A 1 288 ? 9.113   24.682  -36.477 0   64.26  ? 978  TYR   A HB3  1 1 
ATOM   4470 H  HD1  . TYR   A 1 288 ? 9.712   23.822  -38.77  0   65.67  ? 978  TYR   A HD1  1 1 
ATOM   4471 H  HD2  . TYR   A 1 288 ? 12.639  25.526  -36.208 0   70.29  ? 978  TYR   A HD2  1 1 
ATOM   4472 H  HE1  . TYR   A 1 288 ? 11.486  22.831  -40.148 0   68.1   ? 978  TYR   A HE1  1 1 
ATOM   4473 H  HE2  . TYR   A 1 288 ? 14.421  24.543  -37.575 0   72.94  ? 978  TYR   A HE2  1 1 
ATOM   4474 H  HH   . TYR   A 1 288 ? 14.933  23.483  -39.544 0   75.46  ? 978  TYR   A HH   1 1 
ATOM   4475 N  N    . LEU   A 1 289 ? 8.265   28.262  -35.699 1   61.11  ? 979  LEU   A N    1 1 
ATOM   4476 C  CA   . LEU   A 1 289 ? 7.065   28.84   -35.085 1   62.1   ? 979  LEU   A CA   1 1 
ATOM   4477 C  C    . LEU   A 1 289 ? 7.107   30.357  -35.256 1   63.14  ? 979  LEU   A C    1 1 
ATOM   4478 O  O    . LEU   A 1 289 ? 8.135   30.969  -34.981 1   63.13  ? 979  LEU   A O    1 1 
ATOM   4479 C  CB   . LEU   A 1 289 ? 6.95    28.486  -33.593 1   62.26  ? 979  LEU   A CB   1 1 
ATOM   4480 C  CG   . LEU   A 1 289 ? 6.878   27.005  -33.194 1   63.58  ? 979  LEU   A CG   1 1 
ATOM   4481 C  CD1  . LEU   A 1 289 ? 7.014   26.859  -31.69  1   64.13  ? 979  LEU   A CD1  1 1 
ATOM   4482 C  CD2  . LEU   A 1 289 ? 5.574   26.35   -33.656 1   64.19  ? 979  LEU   A CD2  1 1 
ATOM   4483 H  H    . LEU   A 1 289 ? 9.123   28.732  -35.428 0   70.85  ? 979  LEU   A H    1 1 
ATOM   4484 H  HA   . LEU   A 1 289 ? 6.17    28.489  -35.596 0   69.22  ? 979  LEU   A HA   1 1 
ATOM   4485 H  HB2  . LEU   A 1 289 ? 7.823   28.905  -33.096 0   71.14  ? 979  LEU   A HB2  1 1 
ATOM   4486 H  HB3  . LEU   A 1 289 ? 6.053   28.966  -33.203 0   70.08  ? 979  LEU   A HB3  1 1 
ATOM   4487 H  HG   . LEU   A 1 289 ? 7.706   26.47   -33.656 0   68.9   ? 979  LEU   A HG   1 1 
ATOM   4488 H  HD11 . LEU   A 1 289 ? 6.925   25.808  -31.419 0   67.99  ? 979  LEU   A HD11 1 1 
ATOM   4489 H  HD12 . LEU   A 1 289 ? 7.989   27.238  -31.387 0   70.7   ? 979  LEU   A HD12 1 1 
ATOM   4490 H  HD13 . LEU   A 1 289 ? 6.226   27.436  -31.207 0   69.71  ? 979  LEU   A HD13 1 1 
ATOM   4491 H  HD21 . LEU   A 1 289 ? 5.472   25.373  -33.184 0   66.68  ? 979  LEU   A HD21 1 1 
ATOM   4492 H  HD22 . LEU   A 1 289 ? 4.736   26.987  -33.376 0   68.27  ? 979  LEU   A HD22 1 1 
ATOM   4493 H  HD23 . LEU   A 1 289 ? 5.598   26.221  -34.737 0   68.11  ? 979  LEU   A HD23 1 1 
ATOM   4494 N  N    . VAL   A 1 290 ? 5.995   30.959  -35.72  1   63.94  ? 980  VAL   A N    1 1 
ATOM   4495 C  CA   . VAL   A 1 290 ? 5.901   32.401  -35.961 1   65.33  ? 980  VAL   A CA   1 1 
ATOM   4496 C  C    . VAL   A 1 290 ? 5.019   33.041  -34.888 1   66.76  ? 980  VAL   A C    1 1 
ATOM   4497 O  O    . VAL   A 1 290 ? 3.796   32.937  -34.957 1   66.76  ? 980  VAL   A O    1 1 
ATOM   4498 C  CB   . VAL   A 1 290 ? 5.366   32.689  -37.39  1   66.12  ? 980  VAL   A CB   1 1 
ATOM   4499 C  CG1  . VAL   A 1 290 ? 5.356   34.19   -37.683 1   66.76  ? 980  VAL   A CG1  1 1 
ATOM   4500 C  CG2  . VAL   A 1 290 ? 6.189   31.942  -38.44  1   66.55  ? 980  VAL   A CG2  1 1 
ATOM   4501 H  H    . VAL   A 1 290 ? 5.13    30.471  -35.927 0   73.83  ? 980  VAL   A H    1 1 
ATOM   4502 H  HA   . VAL   A 1 290 ? 6.887   32.859  -35.902 0   80.57  ? 980  VAL   A HA   1 1 
ATOM   4503 H  HB   . VAL   A 1 290 ? 4.341   32.33   -37.467 0   79.22  ? 980  VAL   A HB   1 1 
ATOM   4504 H  HG11 . VAL   A 1 290 ? 5.156   34.35   -38.742 0   84.26  ? 980  VAL   A HG11 1 1 
ATOM   4505 H  HG12 . VAL   A 1 290 ? 4.573   34.671  -37.099 0   84.81  ? 980  VAL   A HG12 1 1 
ATOM   4506 H  HG13 . VAL   A 1 290 ? 6.327   34.609  -37.422 0   85.34  ? 980  VAL   A HG13 1 1 
ATOM   4507 H  HG21 . VAL   A 1 290 ? 5.926   32.306  -39.432 0   80.16  ? 980  VAL   A HG21 1 1 
ATOM   4508 H  HG22 . VAL   A 1 290 ? 7.247   32.113  -38.248 0   81.04  ? 980  VAL   A HG22 1 1 
ATOM   4509 H  HG23 . VAL   A 1 290 ? 5.967   30.877  -38.382 0   77.86  ? 980  VAL   A HG23 1 1 
ATOM   4510 N  N    . ILE   A 1 291 ? 5.644   33.682  -33.883 1   67.92  ? 981  ILE   A N    1 1 
ATOM   4511 C  CA   . ILE   A 1 291 ? 4.947   34.364  -32.783 1   69.5   ? 981  ILE   A CA   1 1 
ATOM   4512 C  C    . ILE   A 1 291 ? 5.408   35.829  -32.792 1   71.05  ? 981  ILE   A C    1 1 
ATOM   4513 O  O    . ILE   A 1 291 ? 6.61    36.08   -32.875 1   71.07  ? 981  ILE   A O    1 1 
ATOM   4514 C  CB   . ILE   A 1 291 ? 5.242   33.683  -31.408 1   70     ? 981  ILE   A CB   1 1 
ATOM   4515 C  CG1  . ILE   A 1 291 ? 4.891   32.168  -31.43  1   70.87  ? 981  ILE   A CG1  1 1 
ATOM   4516 C  CG2  . ILE   A 1 291 ? 4.471   34.393  -30.277 1   70.51  ? 981  ILE   A CG2  1 1 
ATOM   4517 C  CD1  . ILE   A 1 291 ? 5.646   31.316  -30.416 1   72.06  ? 981  ILE   A CD1  1 1 
ATOM   4518 H  H    . ILE   A 1 291 ? 6.654   33.74   -33.798 0   84.93  ? 981  ILE   A H    1 1 
ATOM   4519 H  HA   . ILE   A 1 291 ? 3.87    34.345  -32.939 0   86.72  ? 981  ILE   A HA   1 1 
ATOM   4520 H  HB   . ILE   A 1 291 ? 6.308   33.784  -31.206 0   87.4   ? 981  ILE   A HB   1 1 
ATOM   4521 H  HG12 . ILE   A 1 291 ? 3.829   32.055  -31.215 0   83.58  ? 981  ILE   A HG12 1 1 
ATOM   4522 H  HG13 . ILE   A 1 291 ? 5.104   31.745  -32.41  0   83.32  ? 981  ILE   A HG13 1 1 
ATOM   4523 H  HG21 . ILE   A 1 291 ? 4.601   33.851  -29.343 0   87.92  ? 981  ILE   A HG21 1 1 
ATOM   4524 H  HG22 . ILE   A 1 291 ? 4.849   35.407  -30.151 0   91.25  ? 981  ILE   A HG22 1 1 
ATOM   4525 H  HG23 . ILE   A 1 291 ? 3.414   34.423  -30.54  0   88.17  ? 981  ILE   A HG23 1 1 
ATOM   4526 H  HD11 . ILE   A 1 291 ? 5.417   30.267  -30.597 0   82.09  ? 981  ILE   A HD11 1 1 
ATOM   4527 H  HD12 . ILE   A 1 291 ? 6.715   31.489  -30.535 0   84.92  ? 981  ILE   A HD12 1 1 
ATOM   4528 H  HD13 . ILE   A 1 291 ? 5.335   31.589  -29.408 0   85.02  ? 981  ILE   A HD13 1 1 
ATOM   4529 N  N    . GLN   A 1 292 ? 4.468   36.792  -32.72  1   72.35  ? 982  GLN   A N    1 1 
ATOM   4530 C  CA   . GLN   A 1 292 ? 4.821   38.216  -32.723 1   74.09  ? 982  GLN   A CA   1 1 
ATOM   4531 C  C    . GLN   A 1 292 ? 5.578   38.596  -31.451 1   75.64  ? 982  GLN   A C    1 1 
ATOM   4532 O  O    . GLN   A 1 292 ? 5.167   38.21   -30.357 1   75.7   ? 982  GLN   A O    1 1 
ATOM   4533 C  CB   . GLN   A 1 292 ? 3.571   39.109  -32.839 1   76     ? 982  GLN   A CB   1 1 
ATOM   4534 C  CG   . GLN   A 1 292 ? 2.982   39.208  -34.242 1   79.88  ? 982  GLN   A CG   1 1 
ATOM   4535 C  CD   . GLN   A 1 292 ? 2.106   40.433  -34.387 1   84.68  ? 982  GLN   A CD   1 1 
ATOM   4536 O  OE1  . GLN   A 1 292 ? 1.473   40.891  -33.427 1   86.4   ? 982  GLN   A OE1  1 1 
ATOM   4537 N  NE2  . GLN   A 1 292 ? 2.042   40.998  -35.588 1   85.2   ? 982  GLN   A NE2  1 1 
ATOM   4538 H  H    . GLN   A 1 292 ? 3.471   36.61   -32.659 0   95     ? 982  GLN   A H    1 1 
ATOM   4539 H  HA   . GLN   A 1 292 ? 5.47    38.411  -33.576 0   101.77 ? 982  GLN   A HA   1 1 
ATOM   4540 H  HB2  . GLN   A 1 292 ? 2.794   38.735  -32.175 0   104.22 ? 982  GLN   A HB2  1 1 
ATOM   4541 H  HB3  . GLN   A 1 292 ? 3.853   40.115  -32.534 0   108.25 ? 982  GLN   A HB3  1 1 
ATOM   4542 H  HG2  . GLN   A 1 292 ? 3.792   39.275  -34.967 0   109.11 ? 982  GLN   A HG2  1 1 
ATOM   4543 H  HG3  . GLN   A 1 292 ? 2.371   38.328  -34.438 0   106.54 ? 982  GLN   A HG3  1 1 
ATOM   4544 H  HE21 . GLN   A 1 292 ? 2.563   40.616  -36.371 0   118.07 ? 982  GLN   A HE21 1 1 
ATOM   4545 H  HE22 . GLN   A 1 292 ? 1.465   41.821  -35.723 0   121.84 ? 982  GLN   A HE22 1 1 
ATOM   4546 N  N    . GLY   A 1 293 ? 6.656   39.362  -31.607 1   76.55  ? 983  GLY   A N    1 1 
ATOM   4547 C  CA   . GLY   A 1 293 ? 7.485   39.795  -30.489 1   78.14  ? 983  GLY   A CA   1 1 
ATOM   4548 C  C    . GLY   A 1 293 ? 8.14    38.636  -29.768 1   79.69  ? 983  GLY   A C    1 1 
ATOM   4549 O  O    . GLY   A 1 293 ? 8.113   38.575  -28.539 1   79.94  ? 983  GLY   A O    1 1 
ATOM   4550 H  H    . GLY   A 1 293 ? 6.986   39.709  -32.502 0   108.97 ? 983  GLY   A H    1 1 
ATOM   4551 H  HA2  . GLY   A 1 293 ? 8.267   40.459  -30.854 0   114.22 ? 983  GLY   A HA2  1 1 
ATOM   4552 H  HA3  . GLY   A 1 293 ? 6.873   40.344  -29.775 0   113.36 ? 983  GLY   A HA3  1 1 
ATOM   4553 N  N    . ASP   A 1 294 ? 8.736   37.711  -30.528 1   80.64  ? 984  ASP   A N    1 1 
ATOM   4554 C  CA   . ASP   A 1 294 ? 9.373   36.517  -29.976 1   82.08  ? 984  ASP   A CA   1 1 
ATOM   4555 C  C    . ASP   A 1 294 ? 10.678  36.857  -29.249 1   83.51  ? 984  ASP   A C    1 1 
ATOM   4556 O  O    . ASP   A 1 294 ? 10.962  36.261  -28.211 1   83.63  ? 984  ASP   A O    1 1 
ATOM   4557 C  CB   . ASP   A 1 294 ? 9.642   35.499  -31.101 1   83.59  ? 984  ASP   A CB   1 1 
ATOM   4558 C  CG   . ASP   A 1 294 ? 9.697   34.052  -30.656 1   87.55  ? 984  ASP   A CG   1 1 
ATOM   4559 O  OD1  . ASP   A 1 294 ? 10.04   33.801  -29.48  1   87.98  ? 984  ASP   A OD1  1 1 
ATOM   4560 O  OD2  . ASP   A 1 294 ? 9.402   33.169  -31.487 1   89.67  ? 984  ASP   A OD2  1 1 
ATOM   4561 H  H    . ASP   A 1 294 ? 8.822   37.785  -31.537 0   109.28 ? 984  ASP   A H    1 1 
ATOM   4562 H  HA   . ASP   A 1 294 ? 8.694   36.064  -29.255 0   107.04 ? 984  ASP   A HA   1 1 
ATOM   4563 H  HB2  . ASP   A 1 294 ? 8.847   35.568  -31.841 0   106.71 ? 984  ASP   A HB2  1 1 
ATOM   4564 H  HB3  . ASP   A 1 294 ? 10.598  35.738  -31.566 0   108.81 ? 984  ASP   A HB3  1 1 
ATOM   4565 N  N    . GLU   A 1 295 ? 11.47   37.796  -29.789 1   84.47  ? 985  GLU   A N    1 1 
ATOM   4566 C  CA   . GLU   A 1 295 ? 12.734  38.197  -29.168 1   85.95  ? 985  GLU   A CA   1 1 
ATOM   4567 C  C    . GLU   A 1 295 ? 12.503  38.951  -27.85  1   87.05  ? 985  GLU   A C    1 1 
ATOM   4568 O  O    . GLU   A 1 295 ? 13.309  38.824  -26.928 1   87.21  ? 985  GLU   A O    1 1 
ATOM   4569 C  CB   . GLU   A 1 295 ? 13.568  39.07   -30.128 1   88.51  ? 985  GLU   A CB   1 1 
ATOM   4570 C  CG   . GLU   A 1 295 ? 14.106  38.345  -31.354 1   93.56  ? 985  GLU   A CG   1 1 
ATOM   4571 C  CD   . GLU   A 1 295 ? 13.484  38.789  -32.663 1   100.36 ? 985  GLU   A CD   1 1 
ATOM   4572 O  OE1  . GLU   A 1 295 ? 12.842  37.948  -33.331 1   101.74 ? 985  GLU   A OE1  1 1 
ATOM   4573 O  OE2  . GLU   A 1 295 ? 13.643  39.977  -33.025 1   102.73 ? 985  GLU   A OE2  1 1 
ATOM   4574 H  H    . GLU   A 1 295 ? 11.256  38.296  -30.646 0   117.23 ? 985  GLU   A H    1 1 
ATOM   4575 H  HA   . GLU   A 1 295 ? 13.317  37.306  -28.944 0   119.18 ? 985  GLU   A HA   1 1 
ATOM   4576 H  HB2  . GLU   A 1 295 ? 12.952  39.901  -30.47  0   128.08 ? 985  GLU   A HB2  1 1 
ATOM   4577 H  HB3  . GLU   A 1 295 ? 14.426  39.459  -29.58  0   129.2  ? 985  GLU   A HB3  1 1 
ATOM   4578 H  HG2  . GLU   A 1 295 ? 15.176  38.537  -31.424 0   132.06 ? 985  GLU   A HG2  1 1 
ATOM   4579 H  HG3  . GLU   A 1 295 ? 13.935  37.273  -31.259 0   126.96 ? 985  GLU   A HG3  1 1 
ATOM   4580 N  N    . ARG   A 1 296 ? 11.409  39.724  -27.754 1   87.67  ? 986  ARG   A N    1 1 
ATOM   4581 C  CA   . ARG   A 1 296 ? 11.091  40.492  -26.547 1   88.78  ? 986  ARG   A CA   1 1 
ATOM   4582 C  C    . ARG   A 1 296 ? 10.532  39.64   -25.392 1   89.24  ? 986  ARG   A C    1 1 
ATOM   4583 O  O    . ARG   A 1 296 ? 10.54   40.107  -24.255 1   89.39  ? 986  ARG   A O    1 1 
ATOM   4584 C  CB   . ARG   A 1 296 ? 10.074  41.601  -26.874 1   90.69  ? 986  ARG   A CB   1 1 
ATOM   4585 C  CG   . ARG   A 1 296 ? 10.61   42.727  -27.776 1   94.55  ? 986  ARG   A CG   1 1 
ATOM   4586 C  CD   . ARG   A 1 296 ? 9.659   43.067  -28.917 1   98.51  ? 986  ARG   A CD   1 1 
ATOM   4587 N  NE   . ARG   A 1 296 ? 8.371   43.58   -28.441 1   102.01 ? 986  ARG   A NE   1 1 
ATOM   4588 C  CZ   . ARG   A 1 296 ? 7.281   43.73   -29.194 1   104.62 ? 986  ARG   A CZ   1 1 
ATOM   4589 N  NH1  . ARG   A 1 296 ? 7.3     43.398  -30.483 1   104.29 ? 986  ARG   A NH1  1 1 
ATOM   4590 N  NH2  . ARG   A 1 296 ? 6.162   44.208  -28.663 1   104.85 ? 986  ARG   A NH2  1 1 
ATOM   4591 H  H    . ARG   A 1 296 ? 10.723  39.836  -28.493 0   125.07 ? 986  ARG   A H    1 1 
ATOM   4592 H  HA   . ARG   A 1 296 ? 11.996  40.981  -26.19  0   132.12 ? 986  ARG   A HA   1 1 
ATOM   4593 H  HB2  . ARG   A 1 296 ? 9.203   41.143  -27.34  0   131.17 ? 986  ARG   A HB2  1 1 
ATOM   4594 H  HB3  . ARG   A 1 296 ? 9.77    42.066  -25.937 0   135.29 ? 986  ARG   A HB3  1 1 
ATOM   4595 H  HG2  . ARG   A 1 296 ? 10.743  43.625  -27.175 0   144.37 ? 986  ARG   A HG2  1 1 
ATOM   4596 H  HG3  . ARG   A 1 296 ? 11.562  42.432  -28.214 0   141.1  ? 986  ARG   A HG3  1 1 
ATOM   4597 H  HD2  . ARG   A 1 296 ? 10.114  43.831  -29.547 0   147.41 ? 986  ARG   A HD2  1 1 
ATOM   4598 H  HD3  . ARG   A 1 296 ? 9.481   42.161  -29.495 0   141.43 ? 986  ARG   A HD3  1 1 
ATOM   4599 H  HE   . ARG   A 1 296 ? 8.306   43.866  -27.469 0   149.29 ? 986  ARG   A HE   1 1 
ATOM   4600 H  HH11 . ARG   A 1 296 ? 8.123   43.024  -30.942 0   148.24 ? 986  ARG   A HH11 1 1 
ATOM   4601 H  HH12 . ARG   A 1 296 ? 6.455   43.513  -31.034 0   148.7  ? 986  ARG   A HH12 1 1 
ATOM   4602 H  HH21 . ARG   A 1 296 ? 6.13    44.471  -27.683 0   150.83 ? 986  ARG   A HH21 1 1 
ATOM   4603 H  HH22 . ARG   A 1 296 ? 5.331   44.32   -29.235 0   152.01 ? 986  ARG   A HH22 1 1 
ATOM   4604 N  N    . MET   A 1 297 ? 10.022  38.424  -25.668 1   89.33  ? 987  MET   A N    1 1 
ATOM   4605 C  CA   . MET   A 1 297 ? 9.427   37.582  -24.625 1   89.82  ? 987  MET   A CA   1 1 
ATOM   4606 C  C    . MET   A 1 297 ? 10.463  36.994  -23.665 1   90.26  ? 987  MET   A C    1 1 
ATOM   4607 O  O    . MET   A 1 297 ? 11.598  36.73   -24.058 1   90.42  ? 987  MET   A O    1 1 
ATOM   4608 C  CB   . MET   A 1 297 ? 8.585   36.45   -25.249 1   90.32  ? 987  MET   A CB   1 1 
ATOM   4609 C  CG   . MET   A 1 297 ? 7.268   36.927  -25.831 1   92.04  ? 987  MET   A CG   1 1 
ATOM   4610 S  SD   . MET   A 1 297 ? 6.472   35.695  -26.872 1   95.64  ? 987  MET   A SD   1 1 
ATOM   4611 C  CE   . MET   A 1 297 ? 4.977   36.539  -27.265 1   93.36  ? 987  MET   A CE   1 1 
ATOM   4612 H  H    . MET   A 1 297 ? 10.008  38      -26.59  0   121.66 ? 987  MET   A H    1 1 
ATOM   4613 H  HA   . MET   A 1 297 ? 8.758   38.207  -24.035 0   123.1  ? 987  MET   A HA   1 1 
ATOM   4614 H  HB2  . MET   A 1 297 ? 9.153   35.967  -26.042 0   116.67 ? 987  MET   A HB2  1 1 
ATOM   4615 H  HB3  . MET   A 1 297 ? 8.355   35.722  -24.472 0   116.11 ? 987  MET   A HB3  1 1 
ATOM   4616 H  HG2  . MET   A 1 297 ? 6.588   37.172  -25.017 0   120.28 ? 987  MET   A HG2  1 1 
ATOM   4617 H  HG3  . MET   A 1 297 ? 7.448   37.811  -26.441 0   121.86 ? 987  MET   A HG3  1 1 
ATOM   4618 H  HE1  . MET   A 1 297 ? 4.374   35.904  -27.914 0   115.88 ? 987  MET   A HE1  1 1 
ATOM   4619 H  HE2  . MET   A 1 297 ? 4.436   36.749  -26.344 0   118.74 ? 987  MET   A HE2  1 1 
ATOM   4620 H  HE3  . MET   A 1 297 ? 5.219   37.47   -27.777 0   120.33 ? 987  MET   A HE3  1 1 
ATOM   4621 N  N    . HIS   A 1 298 ? 10.055  36.795  -22.398 1   90.17  ? 988  HIS   A N    1 1 
ATOM   4622 C  CA   . HIS   A 1 298 ? 10.911  36.257  -21.34  1   90.65  ? 988  HIS   A CA   1 1 
ATOM   4623 C  C    . HIS   A 1 298 ? 10.047  35.647  -20.224 1   90.7   ? 988  HIS   A C    1 1 
ATOM   4624 O  O    . HIS   A 1 298 ? 9.015   36.218  -19.874 1   90.94  ? 988  HIS   A O    1 1 
ATOM   4625 C  CB   . HIS   A 1 298 ? 11.806  37.382  -20.768 1   91.64  ? 988  HIS   A CB   1 1 
ATOM   4626 C  CG   . HIS   A 1 298 ? 12.535  37.02   -19.507 1   94.13  ? 988  HIS   A CG   1 1 
ATOM   4627 N  ND1  . HIS   A 1 298 ? 12.016  37.33   -18.26  1   96     ? 988  HIS   A ND1  1 1 
ATOM   4628 C  CD2  . HIS   A 1 298 ? 13.717  36.385  -19.34  1   95.35  ? 988  HIS   A CD2  1 1 
ATOM   4629 C  CE1  . HIS   A 1 298 ? 12.891  36.87   -17.38  1   96.49  ? 988  HIS   A CE1  1 1 
ATOM   4630 N  NE2  . HIS   A 1 298 ? 13.931  36.295  -17.984 1   96.43  ? 988  HIS   A NE2  1 1 
ATOM   4631 H  H    . HIS   A 1 298 ? 9.115   37.01   -22.08  0   121.55 ? 988  HIS   A H    1 1 
ATOM   4632 H  HA   . HIS   A 1 298 ? 11.552  35.476  -21.747 0   120.55 ? 988  HIS   A HA   1 1 
ATOM   4633 H  HB2  . HIS   A 1 298 ? 12.553  37.645  -21.515 0   128.85 ? 988  HIS   A HB2  1 1 
ATOM   4634 H  HB3  . HIS   A 1 298 ? 11.182  38.248  -20.552 0   129.64 ? 988  HIS   A HB3  1 1 
ATOM   4635 H  HD2  . HIS   A 1 298 ? 14.367  36.022  -20.118 0   131.52 ? 988  HIS   A HD2  1 1 
ATOM   4636 H  HE1  . HIS   A 1 298 ? 12.776  36.949  -16.312 0   135.95 ? 988  HIS   A HE1  1 1 
ATOM   4637 H  HE2  . HIS   A 1 298 ? 14.732  35.871  -17.527 0   134.61 ? 988  HIS   A HE2  1 1 
ATOM   4638 N  N    . LEU   A 1 299 ? 10.481  34.507  -19.659 1   90.33  ? 989  LEU   A N    1 1 
ATOM   4639 C  CA   . LEU   A 1 299 ? 9.789   33.843  -18.55  1   90.51  ? 989  LEU   A CA   1 1 
ATOM   4640 C  C    . LEU   A 1 299 ? 10.774  33.651  -17.366 1   90.63  ? 989  LEU   A C    1 1 
ATOM   4641 O  O    . LEU   A 1 299 ? 11.967  33.466  -17.627 1   90.73  ? 989  LEU   A O    1 1 
ATOM   4642 C  CB   . LEU   A 1 299 ? 9.246   32.472  -18.996 1   90.71  ? 989  LEU   A CB   1 1 
ATOM   4643 C  CG   . LEU   A 1 299 ? 8.114   32.476  -20.038 1   92.19  ? 989  LEU   A CG   1 1 
ATOM   4644 C  CD1  . LEU   A 1 299 ? 7.976   31.114  -20.69  1   92.81  ? 989  LEU   A CD1  1 1 
ATOM   4645 C  CD2  . LEU   A 1 299 ? 6.771   32.875  -19.42  1   92.79  ? 989  LEU   A CD2  1 1 
ATOM   4646 H  H    . LEU   A 1 299 ? 11.32   34.016  -19.951 0   117.41 ? 989  LEU   A H    1 1 
ATOM   4647 H  HA   . LEU   A 1 299 ? 8.953   34.466  -18.241 0   117.61 ? 989  LEU   A HA   1 1 
ATOM   4648 H  HB2  . LEU   A 1 299 ? 10.081  31.91   -19.412 0   111.85 ? 989  LEU   A HB2  1 1 
ATOM   4649 H  HB3  . LEU   A 1 299 ? 8.873   31.954  -18.113 0   111.76 ? 989  LEU   A HB3  1 1 
ATOM   4650 H  HG   . LEU   A 1 299 ? 8.349   33.196  -20.82  0   113.98 ? 989  LEU   A HG   1 1 
ATOM   4651 H  HD11 . LEU   A 1 299 ? 7.161   31.145  -21.41  0   108.75 ? 989  LEU   A HD11 1 1 
ATOM   4652 H  HD12 . LEU   A 1 299 ? 8.908   30.869  -21.198 0   109.54 ? 989  LEU   A HD12 1 1 
ATOM   4653 H  HD13 . LEU   A 1 299 ? 7.766   30.373  -19.92  0   108.41 ? 989  LEU   A HD13 1 1 
ATOM   4654 H  HD21 . LEU   A 1 299 ? 5.988   32.764  -20.169 0   112.69 ? 989  LEU   A HD21 1 1 
ATOM   4655 H  HD22 . LEU   A 1 299 ? 6.562   32.228  -18.569 0   112.41 ? 989  LEU   A HD22 1 1 
ATOM   4656 H  HD23 . LEU   A 1 299 ? 6.814   33.913  -19.094 0   116.4  ? 989  LEU   A HD23 1 1 
ATOM   4657 N  N    . PRO   A 1 300 ? 10.342  33.674  -16.074 1   90.49  ? 990  PRO   A N    1 1 
ATOM   4658 C  CA   . PRO   A 1 300 ? 11.321  33.465  -14.985 1   90.59  ? 990  PRO   A CA   1 1 
ATOM   4659 C  C    . PRO   A 1 300 ? 11.921  32.06   -14.968 1   90.87  ? 990  PRO   A C    1 1 
ATOM   4660 O  O    . PRO   A 1 300 ? 13.09   31.877  -15.299 1   90.94  ? 990  PRO   A O    1 1 
ATOM   4661 C  CB   . PRO   A 1 300 ? 10.517  33.726  -13.703 1   91.23  ? 990  PRO   A CB   1 1 
ATOM   4662 C  CG   . PRO   A 1 300 ? 9.214   34.277  -14.127 1   91.62  ? 990  PRO   A CG   1 1 
ATOM   4663 C  CD   . PRO   A 1 300 ? 8.98    33.873  -15.538 1   89.98  ? 990  PRO   A CD   1 1 
ATOM   4664 H  HA   . PRO   A 1 300 ? 12.125  34.197  -15.052 0   122.66 ? 990  PRO   A HA   1 1 
ATOM   4665 H  HB2  . PRO   A 1 300 ? 10.379  32.789  -13.167 0   119.8  ? 990  PRO   A HB2  1 1 
ATOM   4666 H  HB3  . PRO   A 1 300 ? 11.051  34.445  -13.083 0   124.72 ? 990  PRO   A HB3  1 1 
ATOM   4667 H  HG2  . PRO   A 1 300 ? 8.431   33.875  -13.487 0   120.99 ? 990  PRO   A HG2  1 1 
ATOM   4668 H  HG3  . PRO   A 1 300 ? 9.243   35.363  -14.049 0   125    ? 990  PRO   A HG3  1 1 
ATOM   4669 H  HD2  . PRO   A 1 300 ? 8.413   32.944  -15.577 0   115.06 ? 990  PRO   A HD2  1 1 
ATOM   4670 H  HD3  . PRO   A 1 300 ? 8.453   34.686  -16.034 0   118.97 ? 990  PRO   A HD3  1 1 
ATOM   4671 N  N    . GLU   A 1 325 ? -14.044 14.912  -19.904 1   64.26  ? 1015 GLU   A N    1 ? 
ATOM   4672 C  CA   . GLU   A 1 325 ? -12.799 14.494  -20.547 1   64.81  ? 1015 GLU   A CA   1 ? 
ATOM   4673 C  C    . GLU   A 1 325 ? -12.721 12.97   -20.641 1   65.21  ? 1015 GLU   A C    1 ? 
ATOM   4674 O  O    . GLU   A 1 325 ? -12.404 12.446  -21.707 1   65.2   ? 1015 GLU   A O    1 ? 
ATOM   4675 C  CB   . GLU   A 1 325 ? -11.581 15.048  -19.782 1   66.76  ? 1015 GLU   A CB   1 ? 
ATOM   4676 C  CG   . GLU   A 1 325 ? -11.36  16.542  -19.954 1   70.8   ? 1015 GLU   A CG   1 ? 
ATOM   4677 C  CD   . GLU   A 1 325 ? -10.799 17.225  -18.724 1   76.19  ? 1015 GLU   A CD   1 ? 
ATOM   4678 O  OE1  . GLU   A 1 325 ? -11.532 17.323  -17.713 1   77.52  ? 1015 GLU   A OE1  1 ? 
ATOM   4679 O  OE2  . GLU   A 1 325 ? -9.63   17.671  -18.771 1   77.71  ? 1015 GLU   A OE2  1 ? 
ATOM   4680 H  HA   . GLU   A 1 325 ? -12.776 14.895  -21.559 0   64.81  ? 1015 GLU   A HA   1 ? 
ATOM   4681 H  HB2  . GLU   A 1 325 ? -11.717 14.848  -18.72  0   66.76  ? 1015 GLU   A HB2  1 ? 
ATOM   4682 H  HB3  . GLU   A 1 325 ? -10.687 14.539  -20.139 0   66.76  ? 1015 GLU   A HB3  1 ? 
ATOM   4683 H  HG2  . GLU   A 1 325 ? -10.652 16.696  -20.767 0   70.8   ? 1015 GLU   A HG2  1 ? 
ATOM   4684 H  HG3  . GLU   A 1 325 ? -12.305 17.028  -20.194 0   70.8   ? 1015 GLU   A HG3  1 ? 
ATOM   4685 N  N    . TYR   A 1 326 ? -13.015 12.262  -19.535 1   65.44  ? 1016 TYR   A N    1 ? 
ATOM   4686 C  CA   . TYR   A 1 326 ? -12.984 10.8    -19.477 1   66.15  ? 1016 TYR   A CA   1 ? 
ATOM   4687 C  C    . TYR   A 1 326 ? -14.417 10.268  -19.592 1   66.95  ? 1016 TYR   A C    1 ? 
ATOM   4688 O  O    . TYR   A 1 326 ? -15.298 10.752  -18.883 1   67     ? 1016 TYR   A O    1 ? 
ATOM   4689 C  CB   . TYR   A 1 326 ? -12.34  10.333  -18.161 1   66.02  ? 1016 TYR   A CB   1 ? 
ATOM   4690 C  CG   . TYR   A 1 326 ? -10.975 10.932  -17.899 1   66.57  ? 1016 TYR   A CG   1 ? 
ATOM   4691 C  CD1  . TYR   A 1 326 ? -9.822  10.298  -18.336 1   67.34  ? 1016 TYR   A CD1  1 ? 
ATOM   4692 C  CD2  . TYR   A 1 326 ? -10.836 12.105  -17.173 1   67.38  ? 1016 TYR   A CD2  1 ? 
ATOM   4693 C  CE1  . TYR   A 1 326 ? -8.565  10.835  -18.088 1   68.16  ? 1016 TYR   A CE1  1 ? 
ATOM   4694 C  CE2  . TYR   A 1 326 ? -9.586  12.663  -16.935 1   68.22  ? 1016 TYR   A CE2  1 ? 
ATOM   4695 C  CZ   . TYR   A 1 326 ? -8.45   12.018  -17.382 1   69.03  ? 1016 TYR   A CZ   1 ? 
ATOM   4696 O  OH   . TYR   A 1 326 ? -7.217  12.572  -17.124 1   70.41  ? 1016 TYR   A OH   1 ? 
ATOM   4697 H  H    . TYR   A 1 326 ? -13.275 12.682  -18.648 0   65.44  ? 1016 TYR   A H    1 ? 
ATOM   4698 H  HA   . TYR   A 1 326 ? -12.389 10.396  -20.296 0   66.15  ? 1016 TYR   A HA   1 ? 
ATOM   4699 H  HB2  . TYR   A 1 326 ? -12.993 10.594  -17.329 0   66.02  ? 1016 TYR   A HB2  1 ? 
ATOM   4700 H  HB3  . TYR   A 1 326 ? -12.205 9.253   -18.207 0   66.02  ? 1016 TYR   A HB3  1 ? 
ATOM   4701 H  HD1  . TYR   A 1 326 ? -9.902  9.377   -18.888 0   67.34  ? 1016 TYR   A HD1  1 ? 
ATOM   4702 H  HD2  . TYR   A 1 326 ? -11.717 12.618  -16.825 0   67.38  ? 1016 TYR   A HD2  1 ? 
ATOM   4703 H  HE1  . TYR   A 1 326 ? -7.688  10.325  -18.45  0   68.16  ? 1016 TYR   A HE1  1 ? 
ATOM   4704 H  HE2  . TYR   A 1 326 ? -9.502  13.581  -16.379 0   68.22  ? 1016 TYR   A HE2  1 ? 
ATOM   4705 H  HH   . TYR   A 1 326 ? -6.497  12.061  -17.578 0   70.41  ? 1016 TYR   A HH   1 ? 
ATOM   4706 N  N    . LEU   A 1 327 ? -14.66  9.31    -20.51  1   67.48  ? 1017 LEU   A N    1 ? 
ATOM   4707 C  CA   . LEU   A 1 327 ? -15.994 8.745   -20.746 1   68.56  ? 1017 LEU   A CA   1 ? 
ATOM   4708 C  C    . LEU   A 1 327 ? -15.962 7.211   -20.863 1   69.72  ? 1017 LEU   A C    1 ? 
ATOM   4709 O  O    . LEU   A 1 327 ? -14.91  6.625   -21.114 1   69.79  ? 1017 LEU   A O    1 ? 
ATOM   4710 C  CB   . LEU   A 1 327 ? -16.617 9.345   -22.032 1   68.74  ? 1017 LEU   A CB   1 ? 
ATOM   4711 C  CG   . LEU   A 1 327 ? -16.799 10.893  -22.087 1   70.28  ? 1017 LEU   A CG   1 ? 
ATOM   4712 C  CD1  . LEU   A 1 327 ? -15.626 11.57   -22.8   1   70.9   ? 1017 LEU   A CD1  1 ? 
ATOM   4713 C  CD2  . LEU   A 1 327 ? -18.106 11.276  -22.775 1   70.98  ? 1017 LEU   A CD2  1 ? 
ATOM   4714 H  H    . LEU   A 1 327 ? -13.947 8.902   -21.106 0   67.48  ? 1017 LEU   A H    1 ? 
ATOM   4715 H  HA   . LEU   A 1 327 ? -16.659 8.983   -19.917 0   68.56  ? 1017 LEU   A HA   1 ? 
ATOM   4716 H  HB2  . LEU   A 1 327 ? -15.998 9.041   -22.875 0   68.74  ? 1017 LEU   A HB2  1 ? 
ATOM   4717 H  HB3  . LEU   A 1 327 ? -17.596 8.882   -22.143 0   68.74  ? 1017 LEU   A HB3  1 ? 
ATOM   4718 H  HG   . LEU   A 1 327 ? -16.844 11.302  -21.079 0   70.28  ? 1017 LEU   A HG   1 ? 
ATOM   4719 H  HD11 . LEU   A 1 327 ? -15.756 12.651  -22.758 0   70.9   ? 1017 LEU   A HD11 1 ? 
ATOM   4720 H  HD12 . LEU   A 1 327 ? -14.7   11.287  -22.302 0   70.9   ? 1017 LEU   A HD12 1 ? 
ATOM   4721 H  HD13 . LEU   A 1 327 ? -15.604 11.239  -23.837 0   70.9   ? 1017 LEU   A HD13 1 ? 
ATOM   4722 H  HD21 . LEU   A 1 327 ? -18.1   12.338  -23.016 0   70.98  ? 1017 LEU   A HD21 1 ? 
ATOM   4723 H  HD22 . LEU   A 1 327 ? -18.216 10.681  -23.68  0   70.98  ? 1017 LEU   A HD22 1 ? 
ATOM   4724 H  HD23 . LEU   A 1 327 ? -18.93  11.062  -22.095 0   70.98  ? 1017 LEU   A HD23 1 ? 
ATOM   4725 N  N    . ILE   A 1 328 ? -17.133 6.573   -20.695 1   70.52  ? 1018 ILE   A N    1 2 
ATOM   4726 C  CA   . ILE   A 1 328 ? -17.287 5.118   -20.797 1   71.79  ? 1018 ILE   A CA   1 2 
ATOM   4727 C  C    . ILE   A 1 328 ? -17.225 4.744   -22.295 1   72.73  ? 1018 ILE   A C    1 2 
ATOM   4728 O  O    . ILE   A 1 328 ? -17.975 5.342   -23.068 1   72.75  ? 1018 ILE   A O    1 2 
ATOM   4729 C  CB   . ILE   A 1 328 ? -18.647 4.665   -20.161 1   72.54  ? 1018 ILE   A CB   1 2 
ATOM   4730 C  CG1  . ILE   A 1 328 ? -18.682 4.879   -18.614 1   73.67  ? 1018 ILE   A CG1  1 2 
ATOM   4731 C  CG2  . ILE   A 1 328 ? -19.009 3.221   -20.548 1   73.03  ? 1018 ILE   A CG2  1 2 
ATOM   4732 C  CD1  . ILE   A 1 328 ? -17.867 3.885   -17.7   1   75.04  ? 1018 ILE   A CD1  1 2 
ATOM   4733 H  H    . ILE   A 1 328 ? -18     7.065   -20.503 0   90.76  ? 1018 ILE   A H    1 2 
ATOM   4734 H  HA   . ILE   A 1 328 ? -16.478 4.645   -20.245 0   91.99  ? 1018 ILE   A HA   1 2 
ATOM   4735 H  HB   . ILE   A 1 328 ? -19.432 5.289   -20.586 0   92.76  ? 1018 ILE   A HB   1 2 
ATOM   4736 H  HG12 . ILE   A 1 328 ? -18.314 5.879   -18.392 0   94.07  ? 1018 ILE   A HG12 1 2 
ATOM   4737 H  HG13 . ILE   A 1 328 ? -19.722 4.812   -18.297 0   94.09  ? 1018 ILE   A HG13 1 2 
ATOM   4738 H  HG21 . ILE   A 1 328 ? -19.729 2.83    -19.831 0   93.29  ? 1018 ILE   A HG21 1 2 
ATOM   4739 H  HG22 . ILE   A 1 328 ? -19.469 3.225   -21.535 0   93.17  ? 1018 ILE   A HG22 1 2 
ATOM   4740 H  HG23 . ILE   A 1 328 ? -18.113 2.604   -20.554 0   93.25  ? 1018 ILE   A HG23 1 2 
ATOM   4741 H  HD11 . ILE   A 1 328 ? -17.815 4.308   -16.698 0   95.57  ? 1018 ILE   A HD11 1 2 
ATOM   4742 H  HD12 . ILE   A 1 328 ? -18.375 2.923   -17.655 0   95.43  ? 1018 ILE   A HD12 1 2 
ATOM   4743 H  HD13 . ILE   A 1 328 ? -16.86  3.758   -18.095 0   95.4   ? 1018 ILE   A HD13 1 2 
ATOM   4744 N  N    . PRO   A 1 329 ? -16.372 3.791   -22.75  1   73.42  ? 1019 PRO   A N    1 2 
ATOM   4745 C  CA   . PRO   A 1 329 ? -16.355 3.462   -24.187 1   74.09  ? 1019 PRO   A CA   1 2 
ATOM   4746 C  C    . PRO   A 1 329 ? -17.559 2.632   -24.636 1   75.2   ? 1019 PRO   A C    1 2 
ATOM   4747 O  O    . PRO   A 1 329 ? -18.245 2.028   -23.808 1   75.42  ? 1019 PRO   A O    1 2 
ATOM   4748 C  CB   . PRO   A 1 329 ? -15.05  2.686   -24.353 1   74.63  ? 1019 PRO   A CB   1 2 
ATOM   4749 C  CG   . PRO   A 1 329 ? -14.839 2.034   -23.044 1   74.81  ? 1019 PRO   A CG   1 2 
ATOM   4750 C  CD   . PRO   A 1 329 ? -15.4   2.966   -22.003 1   73.02  ? 1019 PRO   A CD   1 2 
ATOM   4751 H  HA   . PRO   A 1 329 ? -16.296 4.366   -24.792 0   94.08  ? 1019 PRO   A HA   1 2 
ATOM   4752 H  HB2  . PRO   A 1 329 ? -15.157 1.945   -25.144 0   94.62  ? 1019 PRO   A HB2  1 2 
ATOM   4753 H  HB3  . PRO   A 1 329 ? -14.239 3.377   -24.578 0   94.63  ? 1019 PRO   A HB3  1 2 
ATOM   4754 H  HG2  . PRO   A 1 329 ? -15.37  1.084   -23.026 0   94.87  ? 1019 PRO   A HG2  1 2 
ATOM   4755 H  HG3  . PRO   A 1 329 ? -13.773 1.877   -22.885 0   94.88  ? 1019 PRO   A HG3  1 2 
ATOM   4756 H  HD2  . PRO   A 1 329 ? -15.898 2.393   -21.222 0   93.15  ? 1019 PRO   A HD2  1 2 
ATOM   4757 H  HD3  . PRO   A 1 329 ? -14.609 3.592   -21.592 0   93.14  ? 1019 PRO   A HD3  1 2 
ATOM   4758 N  N    . GLN   A 1 330 ? -17.809 2.596   -25.953 1   75.59  ? 1020 GLN   A N    1 2 
ATOM   4759 C  CA   . GLN   A 1 330 ? -18.93  1.851   -26.523 1   76.5   ? 1020 GLN   A CA   1 2 
ATOM   4760 C  C    . GLN   A 1 330 ? -18.655 1.499   -27.981 1   76.84  ? 1020 GLN   A C    1 2 
ATOM   4761 O  O    . GLN   A 1 330 ? -19.37  0.686   -28.563 1   76.97  ? 1020 GLN   A O    1 2 
ATOM   4762 C  CB   . GLN   A 1 330 ? -20.239 2.657   -26.402 1   78.44  ? 1020 GLN   A CB   1 2 
ATOM   4763 C  CG   . GLN   A 1 330 ? -20.187 4.071   -26.996 1   82.21  ? 1020 GLN   A CG   1 2 
ATOM   4764 C  CD   . GLN   A 1 330 ? -21.483 4.838   -26.82  1   86.89  ? 1020 GLN   A CD   1 2 
ATOM   4765 O  OE1  . GLN   A 1 330 ? -22.502 4.312   -26.349 1   88.45  ? 1020 GLN   A OE1  1 2 
ATOM   4766 N  NE2  . GLN   A 1 330 ? -21.478 6.111   -27.2   1   87.55  ? 1020 GLN   A NE2  1 2 
ATOM   4767 H  H    . GLN   A 1 330 ? -17.244 3.073   -26.648 0   95.57  ? 1020 GLN   A H    1 2 
ATOM   4768 H  HA   . GLN   A 1 330 ? -19.061 0.916   -25.982 0   96.52  ? 1020 GLN   A HA   1 2 
ATOM   4769 H  HB2  . GLN   A 1 330 ? -21.028 2.113   -26.919 0   98.48  ? 1020 GLN   A HB2  1 2 
ATOM   4770 H  HB3  . GLN   A 1 330 ? -20.491 2.752   -25.347 0   98.47  ? 1020 GLN   A HB3  1 2 
ATOM   4771 H  HG2  . GLN   A 1 330 ? -19.404 4.646   -26.503 0   102.19 ? 1020 GLN   A HG2  1 2 
ATOM   4772 H  HG3  . GLN   A 1 330 ? -19.986 4.011   -28.064 0   102.21 ? 1020 GLN   A HG3  1 2 
ATOM   4773 H  HE21 . GLN   A 1 330 ? -20.639 6.534   -27.584 0   107.57 ? 1020 GLN   A HE21 1 2 
ATOM   4774 H  HE22 . GLN   A 1 330 ? -22.322 6.667   -27.101 0   107.6  ? 1020 GLN   A HE22 1 2 
HETATM 4775 N  N1   . A1IEZ B 2 .   ? -0.903  17.811  -10.028 1   46.29  ? 2001 A1IEZ A N1   1 1 
HETATM 4776 N  N3   . A1IEZ B 2 .   ? 0.751   14.628  -9.484  1   46.55  ? 2001 A1IEZ A N3   1 1 
HETATM 4777 C  C4   . A1IEZ B 2 .   ? -3.356  16.165  -12.411 1   46.22  ? 2001 A1IEZ A C4   1 1 
HETATM 4778 C  C5   . A1IEZ B 2 .   ? -1.858  14.531  -11.183 1   45.96  ? 2001 A1IEZ A C5   1 1 
HETATM 4779 C  C6   . A1IEZ B 2 .   ? -1.24   15.67   -10.537 1   46.2   ? 2001 A1IEZ A C6   1 1 
HETATM 4780 C  C7   . A1IEZ B 2 .   ? -1.746  16.963  -10.679 1   46.3   ? 2001 A1IEZ A C7   1 1 
HETATM 4781 C  C8   . A1IEZ B 2 .   ? 0.166   17.112  -9.448  1   46.24  ? 2001 A1IEZ A C8   1 1 
HETATM 4782 C  C10  . A1IEZ B 2 .   ? 2.477   17.229  -8.534  1   46.15  ? 2001 A1IEZ A C10  1 1 
HETATM 4783 C  C13  . A1IEZ B 2 .   ? 1.124   19.198  -8.396  1   45.93  ? 2001 A1IEZ A C13  1 1 
HETATM 4784 C  C15  . A1IEZ B 2 .   ? 0.904   14.051  -8.215  1   46.72  ? 2001 A1IEZ A C15  1 1 
HETATM 4785 C  C17  . A1IEZ B 2 .   ? 0.705   14.075  -5.81   1   46.81  ? 2001 A1IEZ A C17  1 1 
HETATM 4786 C  C20  . A1IEZ B 2 .   ? 1.604   12.822  -8.122  1   46.84  ? 2001 A1IEZ A C20  1 1 
HETATM 4787 C  C21  . A1IEZ B 2 .   ? 1.122   11.225  -9.757  1   46.73  ? 2001 A1IEZ A C21  1 1 
HETATM 4788 CL CL   . A1IEZ B 2 .   ? 2.813   10.859  -6.693  1   47.25  ? 2001 A1IEZ A CL   1 1 
HETATM 4789 C  C19  . A1IEZ B 2 .   ? 1.847   12.271  -6.868  1   46.97  ? 2001 A1IEZ A C19  1 1 
HETATM 4790 C  C18  . A1IEZ B 2 .   ? 1.395   12.876  -5.711  1   46.84  ? 2001 A1IEZ A C18  1 1 
HETATM 4791 C  C16  . A1IEZ B 2 .   ? 0.453   14.66   -7.036  1   46.76  ? 2001 A1IEZ A C16  1 1 
HETATM 4792 O  O2   . A1IEZ B 2 .   ? 2.029   12.201  -9.272  1   46.8   ? 2001 A1IEZ A O2   1 1 
HETATM 4793 C  C14  . A1IEZ B 2 .   ? -0.037  15.743  -9.762  1   46.34  ? 2001 A1IEZ A C14  1 1 
HETATM 4794 O  O1   . A1IEZ B 2 .   ? -1.52   13.361  -11.019 1   45.76  ? 2001 A1IEZ A O1   1 1 
HETATM 4795 N  N    . A1IEZ B 2 .   ? -2.909  14.813  -12.05  1   45.99  ? 2001 A1IEZ A N    1 1 
HETATM 4796 C  C9   . A1IEZ B 2 .   ? 1.231   17.832  -8.752  1   46.12  ? 2001 A1IEZ A C9   1 1 
HETATM 4797 F  F    . A1IEZ B 2 .   ? -0.013  19.874  -8.513  1   45.78  ? 2001 A1IEZ A F    1 1 
HETATM 4798 C  C12  . A1IEZ B 2 .   ? 2.246   19.883  -7.893  1   45.95  ? 2001 A1IEZ A C12  1 1 
HETATM 4799 N  N2   . A1IEZ B 2 .   ? 3.446   19.294  -7.725  1   46.01  ? 2001 A1IEZ A N2   1 1 
HETATM 4800 C  C11  . A1IEZ B 2 .   ? 3.543   17.987  -8.044  1   46.1   ? 2001 A1IEZ A C11  1 1 
HETATM 4801 C  C3   . A1IEZ B 2 .   ? -3.029  17.296  -11.39  1   46.44  ? 2001 A1IEZ A C3   1 1 
HETATM 4802 C  C2   . A1IEZ B 2 .   ? -3.011  18.644  -12.154 1   46.74  ? 2001 A1IEZ A C2   1 1 
HETATM 4803 C  C1   . A1IEZ B 2 .   ? -2.901  19.904  -11.262 1   47.04  ? 2001 A1IEZ A C1   1 1 
HETATM 4804 O  O    . A1IEZ B 2 .   ? -3.797  19.69   -10.193 1   47.3   ? 2001 A1IEZ A O    1 1 
HETATM 4805 C  C    . A1IEZ B 2 .   ? -3.531  20.5    -9.076  1   47.33  ? 2001 A1IEZ A C    1 1 
HETATM 4806 O  O    . HOH   C 3 .   ? 9.621   13.182  -6.524  1   43.73  ? 2101 HOH   A O    1 ? 
HETATM 4807 O  O    . HOH   C 3 .   ? 6.925   15.712  -8.765  1   39.28  ? 2102 HOH   A O    1 ? 
HETATM 4808 O  O    . HOH   C 3 .   ? 11.029  5.8     -28.661 1   31.33  ? 2103 HOH   A O    1 ? 
HETATM 4809 O  O    . HOH   C 3 .   ? -1.892  7.178   -16.875 1   25.21  ? 2104 HOH   A O    1 ? 
HETATM 4810 O  O    . HOH   C 3 .   ? -6.67   7.75    -1.771  1   46.11  ? 2105 HOH   A O    1 ? 
HETATM 4811 O  O    . HOH   C 3 .   ? -4.689  3.677   -11.001 1   48.53  ? 2106 HOH   A O    1 ? 
HETATM 4812 O  O    . HOH   C 3 .   ? -1.39   8.472   -23.797 1   28.35  ? 2107 HOH   A O    1 ? 
HETATM 4813 O  O    . HOH   C 3 .   ? -5.064  8.875   -15.322 1   34.51  ? 2108 HOH   A O    1 ? 
HETATM 4814 O  O    . HOH   C 3 .   ? -5.105  18.496  -21.239 1   46.14  ? 2109 HOH   A O    1 ? 
HETATM 4815 O  O    . HOH   C 3 .   ? -6.716  14.963  -34.685 1   19.66  ? 2110 HOH   A O    1 ? 
HETATM 4816 O  O    . HOH   C 3 .   ? -2.32   5.184   -25.114 1   26.22  ? 2111 HOH   A O    1 ? 
HETATM 4817 O  O    . HOH   C 3 .   ? -7.797  18.538  -20.507 1   32.55  ? 2112 HOH   A O    1 ? 
HETATM 4818 O  O    . HOH   C 3 .   ? -11.878 1.23    -21.023 1   37.26  ? 2113 HOH   A O    1 ? 
HETATM 4819 O  O    . HOH   C 3 .   ? -2.19   2.837   -12.385 1   42.51  ? 2114 HOH   A O    1 ? 
HETATM 4820 O  O    . HOH   C 3 .   ? 13.347  12.267  -36.452 1   39.76  ? 2115 HOH   A O    1 ? 
HETATM 4821 O  O    . HOH   C 3 .   ? -3.719  7.417   -25.243 1   32.12  ? 2116 HOH   A O    1 ? 
HETATM 4822 O  O    . HOH   C 3 .   ? 13.512  33.469  -21.009 1   48.51  ? 2117 HOH   A O    1 ? 
HETATM 4823 O  O    . HOH   C 3 .   ? 14.172  4.3     -27.489 1   56.42  ? 2118 HOH   A O    1 ? 
HETATM 4824 O  O    . HOH   C 3 .   ? -7.044  21.527  -23.923 1   32.54  ? 2119 HOH   A O    1 ? 
HETATM 4825 O  O    . HOH   C 3 .   ? 7.213   5.419   -29.797 1   30.38  ? 2120 HOH   A O    1 ? 
HETATM 4826 O  O    . HOH   C 3 .   ? -1.647  29.206  -32.022 1   52     ? 2121 HOH   A O    1 ? 
HETATM 4827 O  O    . HOH   C 3 .   ? 11.447  1.586   -6.628  1   42.43  ? 2122 HOH   A O    1 ? 
HETATM 4828 O  O    . HOH   C 3 .   ? 4.772   4.823   -23.729 1   22.01  ? 2123 HOH   A O    1 ? 
HETATM 4829 O  O    . HOH   C 3 .   ? -2.316  0.422   -13.508 1   79.8   ? 2124 HOH   A O    1 ? 
HETATM 4830 O  O    . HOH   C 3 .   ? 14.949  15.21   -38.032 1   70.01  ? 2125 HOH   A O    1 ? 
HETATM 4831 O  O    . HOH   C 3 .   ? 19.52   28.099  -30.675 1   49.95  ? 2126 HOH   A O    1 ? 
HETATM 4832 O  O    . HOH   C 3 .   ? 12.564  -2.621  -19.954 1   47.56  ? 2127 HOH   A O    1 ? 
HETATM 4833 O  O    . HOH   C 3 .   ? 6.154   32.018  -14.689 1   59.08  ? 2128 HOH   A O    1 ? 
HETATM 4834 O  O    . HOH   C 3 .   ? 7.02    -2.324  -24.731 1   46.9   ? 2129 HOH   A O    1 ? 
HETATM 4835 O  O    . HOH   C 3 .   ? -7.125  13.053  4.383   1   54.62  ? 2130 HOH   A O    1 ? 
HETATM 4836 O  O    . HOH   C 3 .   ? 1.017   16.039  14.385  1   65.2   ? 2131 HOH   A O    1 ? 
HETATM 4837 O  O    . HOH   C 3 .   ? -6.517  12.092  -42.439 1   44.93  ? 2132 HOH   A O    1 ? 
HETATM 4838 O  O    . HOH   C 3 .   ? -5.513  30.128  -25.919 1   56.39  ? 2133 HOH   A O    1 ? 
HETATM 4839 O  O    . HOH   C 3 .   ? -1.290  26.423  -44.306 1   34.26  ? 2134 HOH   A O    1 ? 
HETATM 4840 O  O    . HOH   C 3 .   ? -7.548  9.374   -41.907 1   47.11  ? 2135 HOH   A O    1 ? 
HETATM 4841 O  O    . HOH   C 3 .   ? 2.761   -1.024  -40.716 1   54.48  ? 2136 HOH   A O    1 ? 
HETATM 4842 O  O    . HOH   C 3 .   ? -5.207  8.874   -23.713 1   43.55  ? 2137 HOH   A O    1 ? 
HETATM 4843 O  O    . HOH   C 3 .   ? -6.442  24.159  -40.224 1   46.39  ? 2138 HOH   A O    1 ? 
HETATM 4844 O  O    . HOH   C 3 .   ? -2.01   5.602   -41.943 1   45.45  ? 2139 HOH   A O    1 ? 
HETATM 4845 O  O    . HOH   C 3 .   ? -6.613  26.583  -36.264 1   48.82  ? 2140 HOH   A O    1 ? 
HETATM 4846 O  O    . HOH   C 3 .   ? -5.86   14.918  -14.765 1   43.03  ? 2141 HOH   A O    1 ? 
HETATM 4847 O  O    . HOH   C 3 .   ? -10.353 -0.31   -2.966  1   69.36  ? 2142 HOH   A O    1 ? 
HETATM 4848 O  O    . HOH   C 3 .   ? 6.979   1.576   -30.785 1   42.9   ? 2143 HOH   A O    1 ? 
HETATM 4849 O  O    . HOH   C 3 .   ? -5.524  9.378   -11.546 1   54.75  ? 2144 HOH   A O    1 ? 
HETATM 4850 O  O    . HOH   C 3 .   ? 8.839   4.872   -3.588  1   43.27  ? 2145 HOH   A O    1 ? 
HETATM 4851 O  O    . HOH   C 3 .   ? 1.559   23.704  -8.055  1   54.44  ? 2146 HOH   A O    1 ? 
HETATM 4852 O  O    . HOH   C 3 .   ? -8.155  19.801  -17.31  1   56     ? 2147 HOH   A O    1 ? 
HETATM 4853 O  O    . HOH   C 3 .   ? 6.877   -4.893  -17.274 1   55.04  ? 2148 HOH   A O    1 ? 
HETATM 4854 O  O    . HOH   C 3 .   ? -3.588  7.835   -42.185 1   27.46  ? 2149 HOH   A O    1 ? 
HETATM 4855 O  O    . HOH   C 3 .   ? -4.833  5.958   -27.147 1   33.69  ? 2150 HOH   A O    1 ? 
HETATM 4856 O  O    . HOH   C 3 .   ? 5.645   9.405   -39.792 1   42.08  ? 2151 HOH   A O    1 ? 
HETATM 4857 O  O    . HOH   C 3 .   ? 16.807  24.068  -38.883 1   55.04  ? 2152 HOH   A O    1 ? 
HETATM 4858 O  O    . HOH   C 3 .   ? -2.183  23.634  -11.823 1   55.34  ? 2153 HOH   A O    1 ? 
HETATM 4859 O  O    . HOH   C 3 .   ? 16.304  12.609  -20.697 1   42.9   ? 2154 HOH   A O    1 ? 
HETATM 4860 O  O    . HOH   C 3 .   ? -8.974  17.846  -41.13  1   38.81  ? 2155 HOH   A O    1 ? 
HETATM 4861 O  O    . HOH   C 3 .   ? -9.671  1.659   -18.921 1   37.81  ? 2156 HOH   A O    1 ? 
HETATM 4862 O  O    . HOH   C 3 .   ? 9.01    -0.451  -28.323 1   54.29  ? 2157 HOH   A O    1 ? 
HETATM 4863 O  O    . HOH   C 3 .   ? -19.482 -1.668  -25.162 1   68.1   ? 2158 HOH   A O    1 ? 
HETATM 4864 O  O    . HOH   C 3 .   ? -4.962  11.654  -22.493 1   23.11  ? 2159 HOH   A O    1 ? 
HETATM 4865 O  O    . HOH   C 3 .   ? -11.213 -1.029  -17.365 1   53.85  ? 2160 HOH   A O    1 ? 
HETATM 4866 O  O    . HOH   C 3 .   ? -4.533  26.341  -41.74  1   35.63  ? 2161 HOH   A O    1 ? 
HETATM 4867 O  O    . HOH   C 3 .   ? -11.405 26.018  -26.304 1   47.54  ? 2162 HOH   A O    1 ? 
HETATM 4868 O  O    . HOH   C 3 .   ? -8.791  22.033  -9.971  1   62.29  ? 2163 HOH   A O    1 ? 
HETATM 4869 O  O    . HOH   C 3 .   ? 7.426   6.192   -40.462 1   54     ? 2164 HOH   A O    1 ? 
HETATM 4870 O  O    . HOH   C 3 .   ? -0.548  12.673  -42.621 1   44.08  ? 2165 HOH   A O    1 ? 
HETATM 4871 O  O    . HOH   C 3 .   ? 4.593   27.511  -43.284 1   37     ? 2166 HOH   A O    1 ? 
HETATM 4872 O  O    . HOH   C 3 .   ? 8.164   14.335  -38.958 1   47.94  ? 2167 HOH   A O    1 ? 
HETATM 4873 O  O    . HOH   C 3 .   ? 9.257   14.601  -9.331  1   40.22  ? 2168 HOH   A O    1 ? 
HETATM 4874 O  O    . HOH   C 3 .   ? -0.362  28.613  -40.5   1   52.83  ? 2169 HOH   A O    1 ? 
HETATM 4875 O  O    . HOH   C 3 .   ? -4.639  15.152  4.815   1   58.02  ? 2170 HOH   A O    1 ? 
HETATM 4876 O  O    . HOH   C 3 .   ? 18.809  1.891   -11.81  1   60.64  ? 2171 HOH   A O    1 ? 
HETATM 4877 O  O    . HOH   C 3 .   ? -22.715 12.023  -26.184 1   39.52  ? 2172 HOH   A O    1 ? 
HETATM 4878 O  O    . HOH   C 3 .   ? -0.382  -2.422  -14.731 1   54.01  ? 2173 HOH   A O    1 ? 
HETATM 4879 O  O    . HOH   C 3 .   ? -3.708  28.357  -40.198 1   50.02  ? 2174 HOH   A O    1 ? 
HETATM 4880 O  O    . HOH   C 3 .   ? -13.929 14.588  -16.181 1   45.49  ? 2175 HOH   A O    1 ? 
HETATM 4881 O  O    . HOH   C 3 .   ? -3.256  26.891  -5.84   1   48.34  ? 2176 HOH   A O    1 ? 
HETATM 4882 O  O    . HOH   C 3 .   ? -9.125  20.437  -22.499 1   36.03  ? 2177 HOH   A O    1 ? 
HETATM 4883 O  O    . HOH   C 3 .   ? 15.463  7.246   -34.525 1   37.63  ? 2178 HOH   A O    1 ? 
HETATM 4884 O  O    . HOH   C 3 .   ? -6.419  17.882  -14.717 1   61.89  ? 2179 HOH   A O    1 ? 
HETATM 4885 O  O    . HOH   C 3 .   ? -7.668  20.71   -12.722 1   58.44  ? 2180 HOH   A O    1 ? 
HETATM 4886 O  O    . HOH   C 3 .   ? -11.633 19.431  -23.613 1   38.95  ? 2181 HOH   A O    1 ? 
HETATM 4887 O  O    . HOH   C 3 .   ? -8.312  26.617  -38.618 1   56.37  ? 2182 HOH   A O    1 ? 
HETATM 4888 O  O    . HOH   C 3 .   ? 15.447  10.212  -36.552 1   50.48  ? 2183 HOH   A O    1 ? 
HETATM 4889 O  O    . HOH   C 3 .   ? 20.782  24.569  -39.874 1   52.22  ? 2184 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   . GLN   A 8   ? 1.0537 0.8166 1.0254 0.2644  -0.0106 0.2127  701  GLN   A N   
2    C  CA  . GLN   A 8   ? 1.0902 0.7928 1.0301 0.2425  -0.0102 0.2101  701  GLN   A CA  
3    C  C   . GLN   A 8   ? 1.0763 0.8047 1.0302 0.2046  -0.0183 0.2059  701  GLN   A C   
4    O  O   . GLN   A 8   ? 1.0494 0.8357 1.0279 0.1991  -0.0303 0.2138  701  GLN   A O   
5    C  CB  . GLN   A 8   ? 1.1345 0.8099 1.0483 0.2649  -0.0153 0.2289  701  GLN   A CB  
6    C  CG  . GLN   A 8   ? 1.1589 0.9041 1.0977 0.2806  -0.0301 0.2498  701  GLN   A CG  
7    C  CD  . GLN   A 8   ? 1.2516 0.9682 1.1624 0.3058  -0.0347 0.2689  701  GLN   A CD  
8    O  OE1 . GLN   A 8   ? 1.3066 0.9655 1.1852 0.3344  -0.025  0.2704  701  GLN   A OE1 
9    N  NE2 . GLN   A 8   ? 1.2519 1.0025 1.1686 0.2961  -0.0501 0.2845  701  GLN   A NE2 
17   N  N   . ALA   A 9   ? 1.0922 0.7773 1.0269 0.1785  -0.0118 0.1944  702  ALA   A N   
18   C  CA  . ALA   A 9   ? 1.0869 0.7899 1.0283 0.1477  -0.0164 0.1896  702  ALA   A CA  
19   C  C   . ALA   A 9   ? 1.0989 0.7874 1.019  0.1422  -0.0244 0.2029  702  ALA   A C   
20   O  O   . ALA   A 9   ? 1.1295 0.7685 1.0202 0.1433  -0.0192 0.2068  702  ALA   A O   
21   C  CB  . ALA   A 9   ? 1.1016 0.7745 1.0336 0.1252  -0.0046 0.1735  702  ALA   A CB  
27   N  N   . LEU   A 10  ? 1.0757 0.8044 1.0068 0.1334  -0.0373 0.2094  703  LEU   A N   
28   C  CA  . LEU   A 10  ? 1.087  0.8053 0.9958 0.1262  -0.0465 0.2215  703  LEU   A CA  
29   C  C   . LEU   A 10  ? 1.0888 0.8169 0.9933 0.1001  -0.0496 0.2136  703  LEU   A C   
30   O  O   . LEU   A 10  ? 1.0782 0.8415 1.0018 0.0931  -0.0551 0.2083  703  LEU   A O   
31   C  CB  . LEU   A 10  ? 1.0716 0.8268 0.9894 0.1435  -0.0618 0.2402  703  LEU   A CB  
32   C  CG  . LEU   A 10  ? 1.0898 0.8386 1.0092 0.1774  -0.0584 0.2504  703  LEU   A CG  
33   C  CD1 . LEU   A 10  ? 1.0657 0.8757 1.0203 0.1942  -0.063  0.2545  703  LEU   A CD1 
34   C  CD2 . LEU   A 10  ? 1.1084 0.8429 1.005  0.191   -0.0672 0.2701  703  LEU   A CD2 
46   N  N   . LEU   A 11  ? 1.1024 0.7992 0.979  0.0879  -0.0461 0.214   704  LEU   A N   
47   C  CA  . LEU   A 11  ? 1.1061 0.8059 0.9711 0.0683  -0.0463 0.206   704  LEU   A CA  
48   C  C   . LEU   A 11  ? 1.1166 0.8135 0.9556 0.0631  -0.0598 0.2177  704  LEU   A C   
49   O  O   . LEU   A 11  ? 1.1331 0.8102 0.955  0.0697  -0.0616 0.2298  704  LEU   A O   
50   C  CB  . LEU   A 11  ? 1.1238 0.7958 0.9754 0.0585  -0.0295 0.1971  704  LEU   A CB  
51   C  CG  . LEU   A 11  ? 1.1414 0.8172 1.0141 0.0567  -0.017  0.1838  704  LEU   A CG  
52   C  CD1 . LEU   A 11  ? 1.1597 0.822  1.0196 0.0421  -0.0027 0.1775  704  LEU   A CD1 
53   C  CD2 . LEU   A 11  ? 1.1327 0.843  1.0298 0.0562  -0.0214 0.1746  704  LEU   A CD2 
65   N  N   . ARG   A 12  ? 1.1104 0.821  0.9414 0.0508  -0.0691 0.2142  705  ARG   A N   
66   C  CA  . ARG   A 12  ? 1.1257 0.8282 0.924  0.0419  -0.083  0.2233  705  ARG   A CA  
67   C  C   . ARG   A 12  ? 1.1488 0.8189 0.9127 0.0334  -0.0723 0.2151  705  ARG   A C   
68   O  O   . ARG   A 12  ? 1.1512 0.8199 0.9092 0.0271  -0.0678 0.2027  705  ARG   A O   
69   C  CB  . ARG   A 12  ? 1.1322 0.8618 0.9316 0.0303  -0.1018 0.2254  705  ARG   A CB  
70   C  CG  . ARG   A 12  ? 1.1431 0.9161 0.9732 0.0387  -0.1151 0.2397  705  ARG   A CG  
71   C  CD  . ARG   A 12  ? 1.1659 0.9752 0.9966 0.0229  -0.1373 0.2485  705  ARG   A CD  
72   N  NE  . ARG   A 12  ? 1.2135 0.9983 1.0004 -0.0008 -0.1492 0.2457  705  ARG   A NE  
73   C  CZ  . ARG   A 12  ? 1.2492 1.0064 0.9955 -0.0079 -0.157  0.2524  705  ARG   A CZ  
74   N  NH1 . ARG   A 12  ? 1.242  0.9916 0.9867 0.0067  -0.1532 0.2625  705  ARG   A NH1 
75   N  NH2 . ARG   A 12  ? 1.2678 0.9981 0.9689 -0.0294 -0.1681 0.2485  705  ARG   A NH2 
89   N  N   . ILE   A 13  ? 1.1616 0.807  0.9018 0.0352  -0.0674 0.2228  706  ILE   A N   
90   C  CA  . ILE   A 13  ? 1.1855 0.806  0.8908 0.0289  -0.0561 0.2172  706  ILE   A CA  
91   C  C   . ILE   A 13  ? 1.1998 0.8092 0.8669 0.0207  -0.0705 0.2184  706  ILE   A C   
92   O  O   . ILE   A 13  ? 1.2095 0.8168 0.8616 0.018   -0.0866 0.2315  706  ILE   A O   
93   C  CB  . ILE   A 13  ? 1.2059 0.8045 0.8956 0.0307  -0.0457 0.2261  706  ILE   A CB  
94   C  CG1 . ILE   A 13  ? 1.2107 0.81   0.9296 0.036   -0.0359 0.2268  706  ILE   A CG1 
95   C  CG2 . ILE   A 13  ? 1.2263 0.811  0.8862 0.0256  -0.0308 0.2204  706  ILE   A CG2 
96   C  CD1 . ILE   A 13  ? 1.2224 0.8269 0.9543 0.0304  -0.0172 0.2145  706  ILE   A CD1 
108  N  N   . LEU   A 14  ? 1.2049 0.8054 0.8536 0.0173  -0.0655 0.2057  707  LEU   A N   
109  C  CA  . LEU   A 14  ? 1.2266 0.8042 0.8285 0.0085  -0.0788 0.2044  707  LEU   A CA  
110  C  C   . LEU   A 14  ? 1.254  0.8003 0.81   0.0132  -0.0642 0.1998  707  LEU   A C   
111  O  O   . LEU   A 14  ? 1.2507 0.802  0.8156 0.0223  -0.0438 0.1915  707  LEU   A O   
112  C  CB  . LEU   A 14  ? 1.2275 0.8104 0.8343 0.0031  -0.0851 0.1937  707  LEU   A CB  
113  C  CG  . LEU   A 14  ? 1.2162 0.8387 0.8733 -0.0002 -0.0956 0.1973  707  LEU   A CG  
114  C  CD1 . LEU   A 14  ? 1.2226 0.8483 0.8838 -0.0054 -0.0972 0.1858  707  LEU   A CD1 
115  C  CD2 . LEU   A 14  ? 1.2198 0.858  0.8756 -0.0103 -0.1189 0.2132  707  LEU   A CD2 
127  N  N   . LYS   A 15  ? 1.2729 0.7909 0.7794 0.0071  -0.0753 0.206   708  LYS   A N   
128  C  CA  . LYS   A 15  ? 1.3018 0.7896 0.7591 0.0139  -0.0608 0.203   708  LYS   A CA  
129  C  C   . LYS   A 15  ? 1.3216 0.786  0.7444 0.0209  -0.0529 0.1878  708  LYS   A C   
130  O  O   . LYS   A 15  ? 1.3303 0.786  0.7473 0.0132  -0.0671 0.182   708  LYS   A O   
131  C  CB  . LYS   A 15  ? 1.3464 0.8063 0.7546 0.0049  -0.0764 0.2134  708  LYS   A CB  
132  C  CG  . LYS   A 15  ? 1.3767 0.8565 0.8109 -0.0013 -0.091  0.2307  708  LYS   A CG  
133  C  CD  . LYS   A 15  ? 1.4506 0.9051 0.8333 -0.0115 -0.1085 0.2413  708  LYS   A CD  
134  C  CE  . LYS   A 15  ? 1.4753 0.956  0.8839 -0.0175 -0.1293 0.2594  708  LYS   A CE  
135  N  NZ  . LYS   A 15  ? 1.5259 0.986  0.8827 -0.0308 -0.1501 0.2698  708  LYS   A NZ  
149  N  N   . GLU   A 16  ? 1.3297 0.7845 0.727  0.0355  -0.031  0.1829  709  GLU   A N   
150  C  CA  . GLU   A 16  ? 1.3542 0.7832 0.7111 0.0492  -0.0216 0.1695  709  GLU   A CA  
151  C  C   . GLU   A 16  ? 1.3988 0.7684 0.6798 0.0428  -0.0386 0.166   709  GLU   A C   
152  O  O   . GLU   A 16  ? 1.4233 0.7609 0.6688 0.0492  -0.0393 0.1547  709  GLU   A O   
153  C  CB  . GLU   A 16  ? 1.3805 0.8235 0.7302 0.07    0.0076  0.1674  709  GLU   A CB  
154  C  CG  . GLU   A 16  ? 1.4734 0.8905 0.7672 0.0759  0.0152  0.1728  709  GLU   A CG  
155  C  CD  . GLU   A 16  ? 1.5471 0.9886 0.8358 0.0971  0.0453  0.1725  709  GLU   A CD  
156  O  OE1 . GLU   A 16  ? 1.5758 1.007  0.8275 0.101   0.0542  0.1792  709  GLU   A OE1 
157  O  OE2 . GLU   A 16  ? 1.5499 1.0251 0.8712 0.1095  0.0599  0.1668  709  GLU   A OE2 
164  N  N   . THR   A 17  ? 1.41   0.7613 0.6622 0.029   -0.0536 0.1761  710  THR   A N   
165  C  CA  . THR   A 17  ? 1.4567 0.7504 0.6334 0.0167  -0.0732 0.1742  710  THR   A CA  
166  C  C   . THR   A 17  ? 1.4559 0.7448 0.6388 -0.0062 -0.1    0.1734  710  THR   A C   
167  O  O   . THR   A 17  ? 1.4981 0.733  0.6136 -0.0184 -0.1154 0.1685  710  THR   A O   
168  C  CB  . THR   A 17  ? 1.4846 0.7683 0.634  0.0066  -0.0827 0.1871  710  THR   A CB  
169  O  OG1 . THR   A 17  ? 1.4591 0.7928 0.6744 -0.0039 -0.092  0.2014  710  THR   A OG1 
170  C  CG2 . THR   A 17  ? 1.5025 0.7748 0.6194 0.0267  -0.0577 0.1868  710  THR   A CG2 
178  N  N   . GLU   A 18  ? 1.4095 0.7527 0.6682 -0.013  -0.1053 0.1787  711  GLU   A N   
179  C  CA  . GLU   A 18  ? 1.405  0.7561 0.6772 -0.0345 -0.1284 0.1798  711  GLU   A CA  
180  C  C   . GLU   A 18  ? 1.4215 0.7464 0.6756 -0.0284 -0.1221 0.1646  711  GLU   A C   
181  O  O   . GLU   A 18  ? 1.4341 0.7411 0.6675 -0.0495 -0.1423 0.1637  711  GLU   A O   
182  C  CB  . GLU   A 18  ? 1.3805 0.7999 0.7381 -0.0381 -0.1327 0.1904  711  GLU   A CB  
183  C  CG  . GLU   A 18  ? 1.4218 0.8658 0.7953 -0.0448 -0.1443 0.2078  711  GLU   A CG  
184  C  CD  . GLU   A 18  ? 1.4453 0.9493 0.8968 -0.0393 -0.1435 0.2173  711  GLU   A CD  
185  O  OE1 . GLU   A 18  ? 1.4365 0.9698 0.9242 -0.0453 -0.1507 0.216   711  GLU   A OE1 
186  O  OE2 . GLU   A 18  ? 1.4567 0.9748 0.9288 -0.0284 -0.1352 0.2261  711  GLU   A OE2 
193  N  N   . PHE   A 19  ? 1.4156 0.7417 0.6779 -0.0009 -0.0949 0.1543  712  PHE   A N   
194  C  CA  . PHE   A 19  ? 1.4346 0.7383 0.6805 0.0107  -0.0867 0.1409  712  PHE   A CA  
195  C  C   . PHE   A 19  ? 1.4848 0.716  0.6391 0.0263  -0.079  0.1311  712  PHE   A C   
196  O  O   . PHE   A 19  ? 1.499  0.7207 0.6272 0.0423  -0.0645 0.1321  712  PHE   A O   
197  C  CB  . PHE   A 19  ? 1.3978 0.7534 0.7089 0.0332  -0.0618 0.1371  712  PHE   A CB  
198  C  CG  . PHE   A 19  ? 1.3612 0.7801 0.7556 0.0219  -0.0664 0.1452  712  PHE   A CG  
199  C  CD1 . PHE   A 19  ? 1.3455 0.8013 0.7806 0.0257  -0.0569 0.1538  712  PHE   A CD1 
200  C  CD2 . PHE   A 19  ? 1.3554 0.7922 0.7809 0.0072  -0.081  0.145   712  PHE   A CD2 
201  C  CE1 . PHE   A 19  ? 1.3178 0.8208 0.8191 0.0182  -0.0613 0.1608  712  PHE   A CE1 
202  C  CE2 . PHE   A 19  ? 1.3233 0.8155 0.8196 0.0008  -0.084  0.1523  712  PHE   A CE2 
203  C  CZ  . PHE   A 19  ? 1.299  0.8208 0.8306 0.0078  -0.0741 0.1597  712  PHE   A CZ  
213  N  N   . LYS   A 20  ? 1.5111 0.6921 0.6175 0.0237  -0.087  0.1218  713  LYS   A N   
214  C  CA  . LYS   A 20  ? 1.5707 0.6695 0.5784 0.0426  -0.0796 0.1109  713  LYS   A CA  
215  C  C   . LYS   A 20  ? 1.5865 0.6583 0.5769 0.0596  -0.0721 0.0998  713  LYS   A C   
216  O  O   . LYS   A 20  ? 1.5506 0.6691 0.6063 0.0507  -0.0757 0.1012  713  LYS   A O   
217  C  CB  . LYS   A 20  ? 1.6387 0.6669 0.5639 0.0126  -0.107  0.1126  713  LYS   A CB  
218  C  CG  . LYS   A 20  ? 1.6794 0.7207 0.6021 -0.002  -0.1157 0.1236  713  LYS   A CG  
219  C  CD  . LYS   A 20  ? 1.7361 0.7732 0.6371 0.0309  -0.089  0.1214  713  LYS   A CD  
220  C  CE  . LYS   A 20  ? 1.7581 0.8318 0.6855 0.0189  -0.0935 0.1349  713  LYS   A CE  
221  N  NZ  . LYS   A 20  ? 1.7764 0.8741 0.7138 0.0503  -0.0633 0.1354  713  LYS   A NZ  
235  N  N   . LYS   A 21  ? 1.6372 0.6348 0.5396 0.0857  -0.0614 0.0894  714  LYS   A N   
236  C  CA  . LYS   A 21  ? 1.6656 0.6214 0.5325 0.1067  -0.0545 0.079   714  LYS   A CA  
237  C  C   . LYS   A 21  ? 1.6013 0.6395 0.5619 0.1243  -0.0374 0.0798  714  LYS   A C   
238  O  O   . LYS   A 21  ? 1.5947 0.6352 0.5755 0.1133  -0.0469 0.0778  714  LYS   A O   
239  C  CB  . LYS   A 21  ? 1.7389 0.6227 0.5466 0.0722  -0.0842 0.0763  714  LYS   A CB  
240  C  CG  . LYS   A 21  ? 1.8582 0.6567 0.5671 0.0485  -0.1044 0.0758  714  LYS   A CG  
241  C  CD  . LYS   A 21  ? 1.9747 0.6869 0.6058 0.0177  -0.1307 0.0718  714  LYS   A CD  
242  C  CE  . LYS   A 21  ? 2.0813 0.723  0.6272 -0.0202 -0.1576 0.0744  714  LYS   A CE  
243  N  NZ  . LYS   A 21  ? 2.1679 0.7278 0.6381 -0.0582 -0.1857 0.0724  714  LYS   A NZ  
257  N  N   . ILE   A 22  ? 1.5531 0.6578 0.5668 0.1495  -0.0126 0.0832  715  ILE   A N   
258  C  CA  . ILE   A 22  ? 1.4956 0.6814 0.5961 0.1635  0.0037  0.0848  715  ILE   A CA  
259  C  C   . ILE   A 22  ? 1.5095 0.6744 0.5766 0.2036  0.0219  0.0767  715  ILE   A C   
260  O  O   . ILE   A 22  ? 1.5319 0.6806 0.5535 0.24    0.0426  0.0745  715  ILE   A O   
261  C  CB  . ILE   A 22  ? 1.4519 0.7178 0.6227 0.1653  0.0191  0.0939  715  ILE   A CB  
262  C  CG1 . ILE   A 22  ? 1.4441 0.7295 0.6526 0.1262  -0.002  0.1027  715  ILE   A CG1 
263  C  CG2 . ILE   A 22  ? 1.4052 0.7501 0.656  0.1786  0.0364  0.0952  715  ILE   A CG2 
264  C  CD1 . ILE   A 22  ? 1.4283 0.7646 0.6785 0.1249  0.0092  0.1124  715  ILE   A CD1 
276  N  N   . LYS   A 23  ? 1.4906 0.6633 0.584  0.199   0.0154  0.0738  716  LYS   A N   
277  C  CA  . LYS   A 23  ? 1.5075 0.6593 0.5686 0.238   0.0306  0.0673  716  LYS   A CA  
278  C  C   . LYS   A 23  ? 1.4432 0.6852 0.5978 0.2435  0.0412  0.0704  716  LYS   A C   
279  O  O   . LYS   A 23  ? 1.4115 0.6915 0.6289 0.2098  0.0266  0.0734  716  LYS   A O   
280  C  CB  . LYS   A 23  ? 1.5889 0.6414 0.5675 0.2286  0.0112  0.0601  716  LYS   A CB  
281  C  CG  . LYS   A 23  ? 1.6973 0.6577 0.5845 0.2084  -0.0067 0.0576  716  LYS   A CG  
282  C  CD  . LYS   A 23  ? 1.7974 0.7067 0.6039 0.2482  0.0121  0.0531  716  LYS   A CD  
283  C  CE  . LYS   A 23  ? 1.8924 0.7365 0.63   0.2236  -0.0038 0.0528  716  LYS   A CE  
284  N  NZ  . LYS   A 23  ? 1.9778 0.7271 0.6403 0.1882  -0.0338 0.0487  716  LYS   A NZ  
298  N  N   . VAL   A 24  ? 1.4243 0.6977 0.5831 0.2852  0.065   0.0701  717  VAL   A N   
299  C  CA  . VAL   A 24  ? 1.3649 0.7288 0.6093 0.2911  0.0761  0.074   717  VAL   A CA  
300  C  C   . VAL   A 24  ? 1.3716 0.709  0.613  0.285   0.0628  0.0692  717  VAL   A C   
301  O  O   . VAL   A 24  ? 1.4227 0.6901 0.5899 0.3096  0.063   0.0638  717  VAL   A O   
302  C  CB  . VAL   A 24  ? 1.3513 0.7725 0.6063 0.3363  0.1057  0.0783  717  VAL   A CB  
303  C  CG1 . VAL   A 24  ? 1.3016 0.8115 0.6393 0.337   0.1128  0.0824  717  VAL   A CG1 
304  C  CG2 . VAL   A 24  ? 1.3422 0.7994 0.6061 0.3386  0.1196  0.085   717  VAL   A CG2 
314  N  N   . LEU   A 25  ? 1.3207 0.711  0.6382 0.254   0.0523  0.0713  718  LEU   A N   
315  C  CA  . LEU   A 25  ? 1.3221 0.7    0.6467 0.2457  0.0408  0.068   718  LEU   A CA  
316  C  C   . LEU   A 25  ? 1.2828 0.726  0.6517 0.2744  0.0586  0.0696  718  LEU   A C   
317  O  O   . LEU   A 25  ? 1.3096 0.7204 0.6421 0.2969  0.0597  0.0668  718  LEU   A O   
318  C  CB  . LEU   A 25  ? 1.2987 0.7018 0.6797 0.1992  0.0206  0.07    718  LEU   A CB  
319  C  CG  . LEU   A 25  ? 1.3565 0.696  0.6933 0.1655  -0.0035 0.07    718  LEU   A CG  
320  C  CD1 . LEU   A 25  ? 1.3235 0.7164 0.732  0.1277  -0.0166 0.0754  718  LEU   A CD1 
321  C  CD2 . LEU   A 25  ? 1.4135 0.677  0.6845 0.1603  -0.0182 0.0659  718  LEU   A CD2 
333  N  N   . GLY   A 26  ? 1.2202 0.7524 0.6634 0.272   0.0712  0.0751  719  GLY   A N   
334  C  CA  . GLY   A 26  ? 1.1788 0.7836 0.6684 0.2937  0.0868  0.0784  719  GLY   A CA  
335  C  C   . GLY   A 26  ? 1.1208 0.8154 0.6787 0.2861  0.1002  0.0857  719  GLY   A C   
336  O  O   . GLY   A 26  ? 1.1165 0.8141 0.6867 0.2645  0.0978  0.088   719  GLY   A O   
340  N  N   . SER   A 27  ? 1.0751 0.8429 0.6752 0.302   0.1136  0.0904  720  SER   A N   
341  C  CA  . SER   A 27  ? 1.0243 0.8809 0.6869 0.2911  0.1259  0.0987  720  SER   A CA  
342  C  C   . SER   A 27  ? 0.9783 0.9064 0.6973 0.2883  0.1285  0.1015  720  SER   A C   
343  O  O   . SER   A 27  ? 0.9886 0.9078 0.6919 0.3103  0.1277  0.0993  720  SER   A O   
344  C  CB  . SER   A 27  ? 1.0398 0.9233 0.6778 0.3228  0.1469  0.1066  720  SER   A CB  
345  O  OG  . SER   A 27  ? 1.0958 0.9329 0.6971 0.3163  0.1459  0.106   720  SER   A OG  
351  N  N   . GLY   A 28  ? 0.9293 0.9235 0.7086 0.2602  0.1308  0.1065  721  GLY   A N   
352  C  CA  . GLY   A 28  ? 0.8884 0.9519 0.7205 0.251   0.1321  0.1094  721  GLY   A CA  
353  C  C   . GLY   A 28  ? 0.8507 0.9621 0.7361 0.2113  0.131   0.1131  721  GLY   A C   
354  O  O   . GLY   A 28  ? 0.8481 0.9684 0.7333 0.2014  0.1374  0.1188  721  GLY   A O   
358  N  N   . ALA   A 29  ? 0.8227 0.9599 0.7488 0.1879  0.1227  0.1099  722  ALA   A N   
359  C  CA  . ALA   A 29  ? 0.7977 0.9676 0.7659 0.1489  0.1203  0.112   722  ALA   A CA  
360  C  C   . ALA   A 29  ? 0.8164 0.9273 0.7755 0.1267  0.1109  0.1072  722  ALA   A C   
361  O  O   . ALA   A 29  ? 0.8075 0.9321 0.7826 0.1024  0.113   0.1118  722  ALA   A O   
362  C  CB  . ALA   A 29  ? 0.7804 0.9772 0.7831 0.1318  0.1127  0.1076  722  ALA   A CB  
368  N  N   . PHE   A 30  ? 0.8393 0.8857 0.7711 0.1339  0.0999  0.0993  723  PHE   A N   
369  C  CA  . PHE   A 30  ? 0.8595 0.8539 0.7801 0.1174  0.0899  0.0967  723  PHE   A CA  
370  C  C   . PHE   A 30  ? 0.8687 0.8485 0.762  0.1229  0.097   0.1033  723  PHE   A C   
371  O  O   . PHE   A 30  ? 0.8804 0.8303 0.7708 0.1064  0.0903  0.104   723  PHE   A O   
372  C  CB  . PHE   A 30  ? 0.8852 0.8233 0.7808 0.1226  0.0757  0.0892  723  PHE   A CB  
373  C  CG  . PHE   A 30  ? 0.9169 0.8242 0.7652 0.1519  0.0775  0.0879  723  PHE   A CG  
374  C  CD1 . PHE   A 30  ? 0.9547 0.8172 0.7555 0.1638  0.078   0.0893  723  PHE   A CD1 
375  C  CD2 . PHE   A 30  ? 0.9226 0.8387 0.768  0.1678  0.0778  0.085   723  PHE   A CD2 
376  C  CE1 . PHE   A 30  ? 0.9929 0.8157 0.7401 0.1918  0.0797  0.0872  723  PHE   A CE1 
377  C  CE2 . PHE   A 30  ? 0.9604 0.8367 0.7535 0.1968  0.0793  0.0838  723  PHE   A CE2 
378  C  CZ  . PHE   A 30  ? 0.9902 0.8171 0.7323 0.2087  0.0803  0.0845  723  PHE   A CZ  
388  N  N   . GLY   A 31  ? 0.8632 0.8638 0.7346 0.1486  0.1106  0.1085  724  GLY   A N   
389  C  CA  . GLY   A 31  ? 0.8774 0.8674 0.7183 0.1581  0.1197  0.1149  724  GLY   A CA  
390  C  C   . GLY   A 31  ? 0.9124 0.8482 0.6954 0.1887  0.1192  0.1107  724  GLY   A C   
391  O  O   . GLY   A 31  ? 0.918  0.8623 0.6848 0.217   0.1257  0.1094  724  GLY   A O   
395  N  N   . THR   A 32  ? 0.9383 0.8147 0.6853 0.1835  0.1108  0.1087  725  THR   A N   
396  C  CA  . THR   A 32  ? 0.9832 0.7949 0.6645 0.2072  0.1078  0.1041  725  THR   A CA  
397  C  C   . THR   A 32  ? 1.0099 0.7586 0.6727 0.1847  0.0863  0.099   725  THR   A C   
398  O  O   . THR   A 32  ? 1.0058 0.7515 0.6817 0.1629  0.0805  0.1027  725  THR   A O   
399  C  CB  . THR   A 32  ? 1.0114 0.8218 0.6541 0.2282  0.1235  0.11    725  THR   A CB  
400  O  OG1 . THR   A 32  ? 0.9891 0.8752 0.6587 0.2451  0.1437  0.118   725  THR   A OG1 
401  C  CG2 . THR   A 32  ? 1.066  0.8034 0.6302 0.2568  0.1225  0.1043  725  THR   A CG2 
409  N  N   . VAL   A 33  ? 1.0352 0.7354 0.666  0.1895  0.0742  0.092   726  VAL   A N   
410  C  CA  . VAL   A 33  ? 1.0644 0.7116 0.676  0.1662  0.0526  0.0891  726  VAL   A CA  
411  C  C   . VAL   A 33  ? 1.1218 0.6939 0.6512 0.1798  0.048   0.0863  726  VAL   A C   
412  O  O   . VAL   A 33  ? 1.1463 0.692  0.6321 0.2078  0.0557  0.0825  726  VAL   A O   
413  C  CB  . VAL   A 33  ? 1.0619 0.7129 0.7003 0.1525  0.0399  0.0848  726  VAL   A CB  
414  C  CG1 . VAL   A 33  ? 1.0936 0.6942 0.7061 0.129   0.0174  0.084   726  VAL   A CG1 
415  C  CG2 . VAL   A 33  ? 1.021  0.7375 0.7336 0.1371  0.0433  0.0867  726  VAL   A CG2 
425  N  N   . TYR   A 34  ? 1.1437 0.6799 0.6482 0.1612  0.0356  0.0886  727  TYR   A N   
426  C  CA  . TYR   A 34  ? 1.2056 0.6642 0.6271 0.1665  0.0278  0.0859  727  TYR   A CA  
427  C  C   . TYR   A 34  ? 1.2298 0.6511 0.6399 0.1321  0.0006  0.0861  727  TYR   A C   
428  O  O   . TYR   A 34  ? 1.197  0.6607 0.6672 0.1089  -0.0086 0.0898  727  TYR   A O   
429  C  CB  . TYR   A 34  ? 1.214  0.6686 0.614  0.1707  0.0358  0.0907  727  TYR   A CB  
430  C  CG  . TYR   A 34  ? 1.1953 0.7065 0.6222 0.194   0.0614  0.095   727  TYR   A CG  
431  C  CD1 . TYR   A 34  ? 1.2323 0.7243 0.605  0.2289  0.0791  0.0938  727  TYR   A CD1 
432  C  CD2 . TYR   A 34  ? 1.1581 0.7379 0.657  0.1788  0.0671  0.1018  727  TYR   A CD2 
433  C  CE1 . TYR   A 34  ? 1.2146 0.7675 0.6125 0.2478  0.1026  0.1005  727  TYR   A CE1 
434  C  CE2 . TYR   A 34  ? 1.1441 0.7777 0.665  0.1933  0.089   0.1078  727  TYR   A CE2 
435  C  CZ  . TYR   A 34  ? 1.1748 0.8002 0.6478 0.2271  0.1068  0.108   727  TYR   A CZ  
436  O  OH  . TYR   A 34  ? 1.1632 0.8514 0.6589 0.2407  0.1289  0.1163  727  TYR   A OH  
446  N  N   . LYS   A 35  ? 1.2858 0.6302 0.6157 0.1295  -0.011  0.0834  728  LYS   A N   
447  C  CA  . LYS   A 35  ? 1.3122 0.6221 0.6226 0.0926  -0.0386 0.0861  728  LYS   A CA  
448  C  C   . LYS   A 35  ? 1.3534 0.621  0.6102 0.0844  -0.0459 0.0892  728  LYS   A C   
449  O  O   . LYS   A 35  ? 1.3734 0.6206 0.5918 0.1113  -0.0293 0.0864  728  LYS   A O   
450  C  CB  . LYS   A 35  ? 1.3724 0.6193 0.6256 0.0886  -0.0505 0.0804  728  LYS   A CB  
451  C  CG  . LYS   A 35  ? 1.4798 0.6437 0.6362 0.1174  -0.0424 0.0728  728  LYS   A CG  
452  C  CD  . LYS   A 35  ? 1.5791 0.6671 0.6689 0.107   -0.0582 0.0683  728  LYS   A CD  
453  C  CE  . LYS   A 35  ? 1.6881 0.6872 0.6772 0.1431  -0.0476 0.0599  728  LYS   A CE  
454  N  NZ  . LYS   A 35  ? 1.7648 0.6857 0.6879 0.1332  -0.0626 0.056   728  LYS   A NZ  
468  N  N   . GLY   A 36  ? 1.3598 0.6211 0.6162 0.0489  -0.0697 0.0958  729  GLY   A N   
469  C  CA  . GLY   A 36  ? 1.4007 0.6243 0.6065 0.0374  -0.0796 0.0999  729  GLY   A CA  
470  C  C   . GLY   A 36  ? 1.4136 0.632  0.6154 -0.0049 -0.1098 0.1086  729  GLY   A C   
471  O  O   . GLY   A 36  ? 1.3996 0.6344 0.6264 -0.0252 -0.1232 0.1107  729  GLY   A O   
475  N  N   . LEU   A 37  ? 1.438  0.6371 0.6067 -0.0188 -0.1209 0.1148  730  LEU   A N   
476  C  CA  . LEU   A 37  ? 1.4534 0.6544 0.6154 -0.0597 -0.1508 0.1259  730  LEU   A CA  
477  C  C   . LEU   A 37  ? 1.4319 0.6881 0.6431 -0.0626 -0.1515 0.1377  730  LEU   A C   
478  O  O   . LEU   A 37  ? 1.4548 0.6863 0.6305 -0.0516 -0.1446 0.1377  730  LEU   A O   
479  C  CB  . LEU   A 37  ? 1.5243 0.6313 0.5764 -0.0778 -0.1685 0.1226  730  LEU   A CB  
480  C  CG  . LEU   A 37  ? 1.5915 0.623  0.574  -0.0785 -0.172  0.1118  730  LEU   A CG  
481  C  CD1 . LEU   A 37  ? 1.6748 0.5984 0.5355 -0.0826 -0.1806 0.1051  730  LEU   A CD1 
482  C  CD2 . LEU   A 37  ? 1.5861 0.6374 0.5909 -0.1172 -0.1957 0.1189  730  LEU   A CD2 
494  N  N   . TRP   A 38  ? 1.3886 0.7178 0.6787 -0.0749 -0.1587 0.1481  731  TRP   A N   
495  C  CA  . TRP   A 38  ? 1.3692 0.7499 0.7067 -0.0752 -0.1599 0.1607  731  TRP   A CA  
496  C  C   . TRP   A 38  ? 1.3944 0.7745 0.7068 -0.1083 -0.1897 0.1748  731  TRP   A C   
497  O  O   . TRP   A 38  ? 1.3795 0.7882 0.7116 -0.1333 -0.209  0.1826  731  TRP   A O   
498  C  CB  . TRP   A 38  ? 1.3104 0.7664 0.7408 -0.0661 -0.1507 0.1648  731  TRP   A CB  
499  C  CG  . TRP   A 38  ? 1.2828 0.7866 0.7583 -0.0653 -0.1536 0.1789  731  TRP   A CG  
500  C  CD1 . TRP   A 38  ? 1.2999 0.7955 0.7647 -0.0536 -0.1451 0.1828  731  TRP   A CD1 
501  C  CD2 . TRP   A 38  ? 1.2426 0.8082 0.7772 -0.0744 -0.1655 0.1919  731  TRP   A CD2 
502  N  NE1 . TRP   A 38  ? 1.2725 0.8151 0.7833 -0.0549 -0.1519 0.1975  731  TRP   A NE1 
503  C  CE2 . TRP   A 38  ? 1.2392 0.8264 0.7936 -0.0653 -0.1639 0.2032  731  TRP   A CE2 
504  C  CE3 . TRP   A 38  ? 1.2223 0.8283 0.7935 -0.0875 -0.1765 0.1959  731  TRP   A CE3 
505  C  CZ2 . TRP   A 38  ? 1.2098 0.8542 0.8166 -0.0652 -0.1726 0.2181  731  TRP   A CZ2 
506  C  CZ3 . TRP   A 38  ? 1.1936 0.8626 0.8196 -0.0879 -0.1844 0.2108  731  TRP   A CZ3 
507  C  CH2 . TRP   A 38  ? 1.1844 0.8709 0.8271 -0.0749 -0.1821 0.2215  731  TRP   A CH2 
518  N  N   . ILE   A 39  ? 1.4277 0.7809 0.698  -0.1093 -0.1935 0.1793  732  ILE   A N   
519  C  CA  . ILE   A 39  ? 1.4512 0.8086 0.6973 -0.1402 -0.222  0.1944  732  ILE   A CA  
520  C  C   . ILE   A 39  ? 1.4195 0.8459 0.7343 -0.1297 -0.2194 0.2094  732  ILE   A C   
521  O  O   . ILE   A 39  ? 1.4279 0.8431 0.737  -0.1092 -0.2037 0.2083  732  ILE   A O   
522  C  CB  . ILE   A 39  ? 1.5196 0.7964 0.6665 -0.1482 -0.2291 0.1898  732  ILE   A CB  
523  C  CG1 . ILE   A 39  ? 1.5881 0.7814 0.656  -0.1508 -0.2277 0.173   732  ILE   A CG1 
524  C  CG2 . ILE   A 39  ? 1.53   0.8166 0.6527 -0.1843 -0.2614 0.2071  732  ILE   A CG2 
525  C  CD1 . ILE   A 39  ? 1.6319 0.7787 0.668  -0.11   -0.196  0.156   732  ILE   A CD1 
537  N  N   . PRO   A 40  ? 1.382  0.879  0.7602 -0.14   -0.2324 0.2237  733  PRO   A N   
538  C  CA  . PRO   A 40  ? 1.3518 0.9039 0.7859 -0.1242 -0.2285 0.2379  733  PRO   A CA  
539  C  C   . PRO   A 40  ? 1.3797 0.9172 0.7735 -0.1331 -0.2428 0.2505  733  PRO   A C   
540  O  O   . PRO   A 40  ? 1.4146 0.9168 0.7462 -0.1603 -0.2635 0.2526  733  PRO   A O   
541  C  CB  . PRO   A 40  ? 1.3139 0.94   0.8109 -0.1332 -0.2417 0.251   733  PRO   A CB  
542  C  CG  . PRO   A 40  ? 1.3259 0.9393 0.8108 -0.1513 -0.2467 0.2414  733  PRO   A CG  
543  C  CD  . PRO   A 40  ? 1.3602 0.8901 0.7583 -0.1652 -0.2507 0.2292  733  PRO   A CD  
551  N  N   . GLU   A 41  ? 1.3658 0.9251 0.7894 -0.1116 -0.232  0.2588  734  GLU   A N   
552  C  CA  . GLU   A 41  ? 1.3913 0.9386 0.7791 -0.1171 -0.244  0.2719  734  GLU   A CA  
553  C  C   . GLU   A 41  ? 1.3799 0.971  0.7707 -0.1441 -0.277  0.2923  734  GLU   A C   
554  O  O   . GLU   A 41  ? 1.3387 0.9972 0.7912 -0.1405 -0.283  0.3045  734  GLU   A O   
555  C  CB  . GLU   A 41  ? 1.4051 0.9699 0.8287 -0.0888 -0.2264 0.2789  734  GLU   A CB  
556  C  CG  . GLU   A 41  ? 1.4889 1.0108 0.8964 -0.0684 -0.1967 0.2632  734  GLU   A CG  
557  C  CD  . GLU   A 41  ? 1.6105 1.0727 0.9419 -0.0731 -0.1944 0.2577  734  GLU   A CD  
558  O  OE1 . GLU   A 41  ? 1.639  1.0915 0.9321 -0.0883 -0.2146 0.2697  734  GLU   A OE1 
559  O  OE2 . GLU   A 41  ? 1.6545 1.0823 0.9639 -0.0602 -0.172  0.242   734  GLU   A OE2 
566  N  N   . GLY   A 42  ? 1.4175 0.9684 0.7374 -0.1716 -0.2974 0.2946  735  GLY   A N   
567  C  CA  . GLY   A 42  ? 1.4103 1.0039 0.7249 -0.2037 -0.3318 0.3158  735  GLY   A CA  
568  C  C   . GLY   A 42  ? 1.4215 1.0125 0.717  -0.2385 -0.3498 0.3121  735  GLY   A C   
569  O  O   . GLY   A 42  ? 1.452  1.0175 0.6856 -0.2761 -0.3765 0.318   735  GLY   A O   
573  N  N   . GLU   A 43  ? 1.3949 1.0085 0.7378 -0.2286 -0.3363 0.3032  736  GLU   A N   
574  C  CA  . GLU   A 43  ? 1.4066 1.0204 0.7354 -0.2616 -0.3522 0.3008  736  GLU   A CA  
575  C  C   . GLU   A 43  ? 1.4731 0.9799 0.7093 -0.2738 -0.3491 0.2793  736  GLU   A C   
576  O  O   . GLU   A 43  ? 1.5075 0.9578 0.7111 -0.2485 -0.3288 0.2657  736  GLU   A O   
577  C  CB  . GLU   A 43  ? 1.3946 1.0573 0.7976 -0.243  -0.3353 0.2958  736  GLU   A CB  
578  C  CG  . GLU   A 43  ? 1.3972 1.1621 0.8846 -0.2292 -0.3383 0.3167  736  GLU   A CG  
579  C  CD  . GLU   A 43  ? 1.4363 1.248  0.9911 -0.2118 -0.3225 0.3119  736  GLU   A CD  
580  O  OE1 . GLU   A 43  ? 1.3997 1.2907 1.0202 -0.1947 -0.3219 0.3277  736  GLU   A OE1 
581  O  OE2 . GLU   A 43  ? 1.4807 1.2491 1.0203 -0.2131 -0.3103 0.2928  736  GLU   A OE2 
588  N  N   . LYS   A 44  ? 1.4942 0.9705 0.6859 -0.3098 -0.3669 0.276   737  LYS   A N   
589  C  CA  . LYS   A 44  ? 1.5643 0.9286 0.6604 -0.3166 -0.3626 0.2545  737  LYS   A CA  
590  C  C   . LYS   A 44  ? 1.5628 0.9131 0.6603 -0.3272 -0.3609 0.2449  737  LYS   A C   
591  O  O   . LYS   A 44  ? 1.6226 0.8876 0.6325 -0.351  -0.3715 0.2347  737  LYS   A O   
592  C  CB  . LYS   A 44  ? 1.6456 0.9502 0.6448 -0.3579 -0.392  0.2598  737  LYS   A CB  
593  C  CG  . LYS   A 44  ? 1.7092 1.0132 0.6905 -0.3492 -0.3946 0.268   737  LYS   A CG  
594  C  CD  . LYS   A 44  ? 1.8208 1.0808 0.7133 -0.3965 -0.4288 0.277   737  LYS   A CD  
595  C  CE  . LYS   A 44  ? 1.8421 1.1803 0.7649 -0.444  -0.464  0.3016  737  LYS   A CE  
596  N  NZ  . LYS   A 44  ? 1.9121 1.2032 0.7411 -0.4965 -0.4995 0.3101  737  LYS   A NZ  
610  N  N   . VAL   A 45  ? 1.4983 0.9223 0.6855 -0.309  -0.3476 0.2474  738  VAL   A N   
611  C  CA  . VAL   A 45  ? 1.4893 0.9159 0.6925 -0.3165 -0.3446 0.2406  738  VAL   A CA  
612  C  C   . VAL   A 45  ? 1.5016 0.8778 0.7005 -0.2706 -0.3102 0.2179  738  VAL   A C   
613  O  O   . VAL   A 45  ? 1.4746 0.8877 0.7285 -0.2349 -0.2887 0.2168  738  VAL   A O   
614  C  CB  . VAL   A 45  ? 1.4295 0.9652 0.7319 -0.3166 -0.3457 0.255   738  VAL   A CB  
615  C  CG1 . VAL   A 45  ? 1.4393 0.965  0.7466 -0.3245 -0.3413 0.2459  738  VAL   A CG1 
616  C  CG2 . VAL   A 45  ? 1.4063 1.0137 0.7253 -0.3543 -0.3772 0.2816  738  VAL   A CG2 
626  N  N   . LYS   A 46  ? 1.5419 0.834  0.6716 -0.273  -0.3064 0.2017  739  LYS   A N   
627  C  CA  . LYS   A 46  ? 1.5529 0.8033 0.6774 -0.2284 -0.2738 0.1817  739  LYS   A CA  
628  C  C   . LYS   A 46  ? 1.5092 0.8021 0.6967 -0.2176 -0.2618 0.1775  739  LYS   A C   
629  O  O   . LYS   A 46  ? 1.5368 0.7918 0.686  -0.2382 -0.2721 0.1737  739  LYS   A O   
630  C  CB  . LYS   A 46  ? 1.6524 0.7865 0.6629 -0.2278 -0.2735 0.1668  739  LYS   A CB  
631  C  CG  . LYS   A 46  ? 1.743  0.8291 0.6853 -0.2345 -0.2823 0.1688  739  LYS   A CG  
632  C  CD  . LYS   A 46  ? 1.8676 0.8491 0.7146 -0.2091 -0.2665 0.1504  739  LYS   A CD  
633  C  CE  . LYS   A 46  ? 1.9731 0.8655 0.7367 -0.2239 -0.2756 0.1399  739  LYS   A CE  
634  N  NZ  . LYS   A 46  ? 2.0709 0.8553 0.7306 -0.1954 -0.2607 0.123   739  LYS   A NZ  
648  N  N   . ILE   A 47  ? 1.4441 0.807  0.7186 -0.1878 -0.2413 0.1782  740  ILE   A N   
649  C  CA  . ILE   A 47  ? 1.4001 0.8121 0.7406 -0.1776 -0.2301 0.1753  740  ILE   A CA  
650  C  C   . ILE   A 47  ? 1.4061 0.7768 0.7338 -0.1424 -0.2029 0.1566  740  ILE   A C   
651  O  O   . ILE   A 47  ? 1.4017 0.7752 0.743  -0.1123 -0.1824 0.1514  740  ILE   A O   
652  C  CB  . ILE   A 47  ? 1.346  0.8509 0.7808 -0.1637 -0.223  0.1865  740  ILE   A CB  
653  C  CG1 . ILE   A 47  ? 1.3348 0.8933 0.7878 -0.1947 -0.2499 0.2078  740  ILE   A CG1 
654  C  CG2 . ILE   A 47  ? 1.3156 0.8667 0.8167 -0.1473 -0.2071 0.1811  740  ILE   A CG2 
655  C  CD1 . ILE   A 47  ? 1.31   0.9325 0.8233 -0.1761 -0.2449 0.2202  740  ILE   A CD1 
667  N  N   . PRO   A 48  ? 1.4119 0.7492 0.7155 -0.1446 -0.2017 0.1477  741  PRO   A N   
668  C  CA  . PRO   A 48  ? 1.414  0.7241 0.7116 -0.107  -0.1752 0.1322  741  PRO   A CA  
669  C  C   . PRO   A 48  ? 1.3441 0.7326 0.7358 -0.0823 -0.1544 0.1316  741  PRO   A C   
670  O  O   . PRO   A 48  ? 1.3061 0.7523 0.7568 -0.0945 -0.1602 0.1381  741  PRO   A O   
671  C  CB  . PRO   A 48  ? 1.4573 0.7165 0.7075 -0.1193 -0.1833 0.1263  741  PRO   A CB  
672  C  CG  . PRO   A 48  ? 1.4794 0.7274 0.698  -0.1672 -0.2146 0.138   741  PRO   A CG  
673  C  CD  . PRO   A 48  ? 1.4149 0.7411 0.696  -0.181  -0.2239 0.1529  741  PRO   A CD  
681  N  N   . VAL   A 49  ? 1.3262 0.7172 0.7287 -0.0494 -0.1307 0.1248  742  VAL   A N   
682  C  CA  . VAL   A 49  ? 1.271  0.7283 0.7533 -0.0293 -0.1113 0.1242  742  VAL   A CA  
683  C  C   . VAL   A 49  ? 1.2676 0.7156 0.7469 0.0031  -0.0863 0.1126  742  VAL   A C   
684  O  O   . VAL   A 49  ? 1.3076 0.6987 0.722  0.0167  -0.0812 0.1058  742  VAL   A O   
685  C  CB  . VAL   A 49  ? 1.2565 0.7482 0.771  -0.0274 -0.109  0.1333  742  VAL   A CB  
686  C  CG1 . VAL   A 49  ? 1.2496 0.7681 0.7802 -0.0545 -0.1325 0.1473  742  VAL   A CG1 
687  C  CG2 . VAL   A 49  ? 1.293  0.7419 0.7549 -0.0137 -0.1002 0.1309  742  VAL   A CG2 
697  N  N   . ALA   A 50  ? 1.2183 0.7234 0.7656 0.0158  -0.071  0.1112  743  ALA   A N   
698  C  CA  . ALA   A 50  ? 1.2109 0.727  0.7685 0.0437  -0.0477 0.1034  743  ALA   A CA  
699  C  C   . ALA   A 50  ? 1.1805 0.7383 0.7797 0.053   -0.0325 0.1073  743  ALA   A C   
700  O  O   . ALA   A 50  ? 1.1562 0.746  0.7975 0.04    -0.0384 0.1142  743  ALA   A O   
701  C  CB  . ALA   A 50  ? 1.1895 0.735  0.7859 0.0455  -0.0446 0.0988  743  ALA   A CB  
707  N  N   . ILE   A 51  ? 1.1821 0.7385 0.7656 0.0758  -0.013  0.1042  744  ILE   A N   
708  C  CA  . ILE   A 51  ? 1.1634 0.7548 0.7762 0.0817  0.0019  0.1091  744  ILE   A CA  
709  C  C   . ILE   A 51  ? 1.14   0.7745 0.7861 0.0983  0.0223  0.1056  744  ILE   A C   
710  O  O   . ILE   A 51  ? 1.1538 0.7763 0.7708 0.1185  0.0312  0.1006  744  ILE   A O   
711  C  CB  . ILE   A 51  ? 1.2011 0.7555 0.7571 0.0902  0.0059  0.1119  744  ILE   A CB  
712  C  CG1 . ILE   A 51  ? 1.2426 0.7501 0.7558 0.0715  -0.0168 0.1154  744  ILE   A CG1 
713  C  CG2 . ILE   A 51  ? 1.1862 0.7754 0.7693 0.0922  0.0201  0.119   744  ILE   A CG2 
714  C  CD1 . ILE   A 51  ? 1.3051 0.7519 0.7368 0.082   -0.0163 0.1128  744  ILE   A CD1 
726  N  N   . LYS   A 52  ? 1.1065 0.789  0.8084 0.0904  0.0295  0.1091  745  LYS   A N   
727  C  CA  . LYS   A 52  ? 1.0876 0.8165 0.8217 0.1004  0.0468  0.1074  745  LYS   A CA  
728  C  C   . LYS   A 52  ? 1.0816 0.8395 0.8259 0.1005  0.0622  0.1149  745  LYS   A C   
729  O  O   . LYS   A 52  ? 1.0841 0.8322 0.8292 0.0875  0.058   0.1211  745  LYS   A O   
730  C  CB  . LYS   A 52  ? 1.0811 0.8407 0.8672 0.0874  0.0421  0.1043  745  LYS   A CB  
731  C  CG  . LYS   A 52  ? 1.1078 0.9105 0.9199 0.0966  0.0553  0.1011  745  LYS   A CG  
732  C  CD  . LYS   A 52  ? 1.1469 0.966  0.9941 0.0876  0.0481  0.0955  745  LYS   A CD  
733  C  CE  . LYS   A 52  ? 1.1736 1.0121 1.0617 0.0681  0.0458  0.0971  745  LYS   A CE  
734  N  NZ  . LYS   A 52  ? 1.1841 1.0471 1.1058 0.0624  0.0442  0.0912  745  LYS   A NZ  
748  N  N   . GLU   A 53  ? 1.0712 0.8676 0.8222 0.1149  0.0797  0.1157  746  GLU   A N   
749  C  CA  . GLU   A 53  ? 1.0655 0.9009 0.8266 0.1136  0.0961  0.1246  746  GLU   A CA  
750  C  C   . GLU   A 53  ? 1.039  0.9381 0.8408 0.1134  0.108   0.1258  746  GLU   A C   
751  O  O   . GLU   A 53  ? 1.0323 0.9399 0.8469 0.1206  0.1048  0.1192  746  GLU   A O   
752  C  CB  . GLU   A 53  ? 1.1147 0.936  0.8252 0.1382  0.1077  0.1274  746  GLU   A CB  
753  C  CG  . GLU   A 53  ? 1.1993 0.9718 0.8703 0.1331  0.1005  0.1305  746  GLU   A CG  
754  C  CD  . GLU   A 53  ? 1.2919 1.0479 0.9078 0.1588  0.1134  0.1323  746  GLU   A CD  
755  O  OE1 . GLU   A 53  ? 1.2908 1.0879 0.9069 0.1807  0.1321  0.1347  746  GLU   A OE1 
756  O  OE2 . GLU   A 53  ? 1.3515 1.055  0.9223 0.1579  0.1048  0.1321  746  GLU   A OE2 
763  N  N   . LEU   A 54  ? 1.0221 0.9671 0.8419 0.1033  0.1211  0.1355  747  LEU   A N   
764  C  CA  . LEU   A 54  ? 0.9977 1.0109 0.8532 0.0994  0.1321  0.1394  747  LEU   A CA  
765  C  C   . LEU   A 54  ? 0.9919 1.0534 0.8352 0.1145  0.1516  0.1505  747  LEU   A C   
766  O  O   . LEU   A 54  ? 0.9851 1.0693 0.8345 0.0953  0.1584  0.161   747  LEU   A O   
767  C  CB  . LEU   A 54  ? 0.9848 1.0142 0.8774 0.0634  0.1274  0.1422  747  LEU   A CB  
768  C  CG  . LEU   A 54  ? 1.0112 1.0069 0.9218 0.0504  0.1112  0.1321  747  LEU   A CG  
769  C  CD1 . LEU   A 54  ? 1.0131 1.0071 0.9437 0.0184  0.1079  0.1355  747  LEU   A CD1 
770  C  CD2 . LEU   A 54  ? 1.005  1.0266 0.9357 0.0598  0.1097  0.1245  747  LEU   A CD2 
782  N  N   . ALA   A 62  ? 0.84   0.9271 0.7683 -0.1051 0.1388  0.1892  755  ALA   A N   
783  C  CA  . ALA   A 62  ? 0.8508 0.9238 0.7783 -0.0653 0.136   0.1778  755  ALA   A CA  
784  C  C   . ALA   A 62  ? 0.885  0.8798 0.7926 -0.0559 0.1235  0.1708  755  ALA   A C   
785  O  O   . ALA   A 62  ? 0.8929 0.8634 0.8073 -0.04   0.114   0.1589  755  ALA   A O   
786  C  CB  . ALA   A 62  ? 0.8436 0.9579 0.7599 -0.0383 0.1497  0.1845  755  ALA   A CB  
791  N  N   . ASN   A 63  ? 0.9024 0.8619 0.7854 -0.066  0.1232  0.1796  756  ASN   A N   
792  C  CA  . ASN   A 63  ? 0.9329 0.8251 0.7976 -0.0573 0.1108  0.176   756  ASN   A CA  
793  C  C   . ASN   A 63  ? 0.9373 0.7932 0.8134 -0.0694 0.0995  0.1688  756  ASN   A C   
794  O  O   . ASN   A 63  ? 0.9516 0.7727 0.8275 -0.0536 0.0886  0.1616  756  ASN   A O   
795  C  CB  . ASN   A 63  ? 0.9686 0.834  0.8033 -0.0662 0.1133  0.1889  756  ASN   A CB  
796  C  CG  . ASN   A 63  ? 1.0105 0.8977 0.8256 -0.0475 0.123   0.1943  756  ASN   A CG  
797  O  OD1 . ASN   A 63  ? 1.0338 0.9052 0.8373 -0.0215 0.1185  0.1873  756  ASN   A OD1 
798  N  ND2 . ASN   A 63  ? 1.0114 0.9339 0.8182 -0.0612 0.1366  0.2074  756  ASN   A ND2 
805  N  N   . LYS   A 64  ? 0.9227 0.7874 0.8056 -0.0979 0.1023  0.1714  757  LYS   A N   
806  C  CA  . LYS   A 64  ? 0.9301 0.7579 0.8172 -0.1095 0.0937  0.1638  757  LYS   A CA  
807  C  C   . LYS   A 64  ? 0.9091 0.7464 0.8206 -0.0898 0.0876  0.1494  757  LYS   A C   
808  O  O   . LYS   A 64  ? 0.9224 0.7187 0.8323 -0.08   0.0786  0.143   757  LYS   A O   
809  C  CB  . LYS   A 64  ? 0.9519 0.7947 0.8375 -0.1473 0.0983  0.1688  757  LYS   A CB  
810  C  CG  . LYS   A 64  ? 1.0152 0.8279 0.9027 -0.1614 0.0913  0.1588  757  LYS   A CG  
811  C  CD  . LYS   A 64  ? 1.1077 0.8381 0.9676 -0.1569 0.0832  0.1566  757  LYS   A CD  
812  C  CE  . LYS   A 64  ? 1.1695 0.8624 1.0171 -0.1767 0.0791  0.149   757  LYS   A CE  
813  N  NZ  . LYS   A 64  ? 1.1929 0.8855 1.0614 -0.1535 0.0741  0.134   757  LYS   A NZ  
827  N  N   . GLU   A 65  ? 0.8729 0.7649 0.8048 -0.0811 0.0928  0.1457  758  GLU   A N   
828  C  CA  . GLU   A 65  ? 0.8546 0.7567 0.8076 -0.065  0.0873  0.133   758  GLU   A CA  
829  C  C   . GLU   A 65  ? 0.8483 0.722  0.7949 -0.0383 0.0791  0.1286  758  GLU   A C   
830  O  O   . GLU   A 65  ? 0.852  0.7047 0.8072 -0.0319 0.0704  0.1209  758  GLU   A O   
831  C  CB  . GLU   A 65  ? 0.8607 0.8267 0.8317 -0.0601 0.0952  0.1325  758  GLU   A CB  
832  C  CG  . GLU   A 65  ? 0.9075 0.9167 0.8873 -0.089  0.1026  0.1398  758  GLU   A CG  
833  C  CD  . GLU   A 65  ? 0.9594 1.0382 0.9623 -0.082  0.1087  0.1394  758  GLU   A CD  
834  O  OE1 . GLU   A 65  ? 0.9733 1.0583 0.981  -0.0526 0.1077  0.1328  758  GLU   A OE1 
835  O  OE2 . GLU   A 65  ? 0.9741 1.1002 0.9876 -0.1068 0.1136  0.1468  758  GLU   A OE2 
842  N  N   . ILE   A 66  ? 0.8379 0.7131 0.768  -0.0246 0.0817  0.134   759  ILE   A N   
843  C  CA  . ILE   A 66  ? 0.8416 0.691  0.7604 -0.0037 0.0723  0.1306  759  ILE   A CA  
844  C  C   . ILE   A 66  ? 0.8438 0.6488 0.7561 -0.0061 0.0615  0.133   759  ILE   A C   
845  O  O   . ILE   A 66  ? 0.8462 0.6385 0.7633 0.0049  0.051   0.1285  759  ILE   A O   
846  C  CB  . ILE   A 66  ? 0.857  0.7094 0.7498 0.0119  0.0769  0.1349  759  ILE   A CB  
847  C  CG1 . ILE   A 66  ? 0.8824 0.712  0.7621 0.0299  0.0657  0.1286  759  ILE   A CG1 
848  C  CG2 . ILE   A 66  ? 0.8776 0.7101 0.7463 0.0052  0.0798  0.146   759  ILE   A CG2 
849  C  CD1 . ILE   A 66  ? 0.9059 0.7416 0.7589 0.0492  0.072   0.1273  759  ILE   A CD1 
861  N  N   . LEU   A 67  ? 0.8404 0.6237 0.7413 -0.0201 0.064   0.141   760  LEU   A N   
862  C  CA  . LEU   A 67  ? 0.8502 0.5906 0.7422 -0.0176 0.0547  0.1445  760  LEU   A CA  
863  C  C   . LEU   A 67  ? 0.8336 0.5646 0.7429 -0.018  0.0508  0.1366  760  LEU   A C   
864  O  O   . LEU   A 67  ? 0.8397 0.5485 0.749  -0.0053 0.0421  0.1372  760  LEU   A O   
865  C  CB  . LEU   A 67  ? 0.8724 0.5844 0.7397 -0.0309 0.0585  0.1562  760  LEU   A CB  
866  C  CG  . LEU   A 67  ? 0.8995 0.61   0.7434 -0.0266 0.0602  0.1659  760  LEU   A CG  
867  C  CD1 . LEU   A 67  ? 0.916  0.6168 0.7395 -0.0464 0.069   0.1771  760  LEU   A CD1 
868  C  CD2 . LEU   A 67  ? 0.9214 0.6027 0.7528 -0.0105 0.0471  0.1702  760  LEU   A CD2 
880  N  N   . ASP   A 68  ? 0.8105 0.5617 0.7336 -0.0313 0.0572  0.1297  761  ASP   A N   
881  C  CA  . ASP   A 68  ? 0.8049 0.5476 0.7411 -0.0308 0.0542  0.1204  761  ASP   A CA  
882  C  C   . ASP   A 68  ? 0.7816 0.5439 0.7377 -0.0112 0.047   0.1136  761  ASP   A C   
883  O  O   . ASP   A 68  ? 0.7862 0.5341 0.7483 -0.001  0.0415  0.1104  761  ASP   A O   
884  C  CB  . ASP   A 68  ? 0.817  0.583  0.7623 -0.0517 0.0612  0.1148  761  ASP   A CB  
885  C  CG  . ASP   A 68  ? 0.8921 0.6349 0.8153 -0.0783 0.0662  0.1212  761  ASP   A CG  
886  O  OD1 . ASP   A 68  ? 0.9261 0.6202 0.8242 -0.0783 0.064   0.1278  761  ASP   A OD1 
887  O  OD2 . ASP   A 68  ? 0.9094 0.6834 0.8387 -0.1004 0.0718  0.1209  761  ASP   A OD2 
892  N  N   . GLU   A 69  ? 0.757  0.5503 0.7193 -0.0056 0.0475  0.1124  762  GLU   A N   
893  C  CA  . GLU   A 69  ? 0.7439 0.5506 0.7171 0.0085  0.0398  0.1074  762  GLU   A CA  
894  C  C   . GLU   A 69  ? 0.7485 0.5343 0.7131 0.0193  0.0289  0.1138  762  GLU   A C   
895  O  O   . GLU   A 69  ? 0.7413 0.5322 0.7187 0.0268  0.0212  0.1115  762  GLU   A O   
896  C  CB  . GLU   A 69  ? 0.7579 0.5887 0.7263 0.0129  0.0433  0.106   762  GLU   A CB  
897  C  CG  . GLU   A 69  ? 0.793  0.6322 0.7668 0.0233  0.0355  0.1002  762  GLU   A CG  
898  C  CD  . GLU   A 69  ? 0.8399 0.6979 0.806  0.0304  0.0407  0.0971  762  GLU   A CD  
899  O  OE1 . GLU   A 69  ? 0.8504 0.7178 0.8046 0.0315  0.0502  0.1011  762  GLU   A OE1 
900  O  OE2 . GLU   A 69  ? 0.8556 0.7196 0.8258 0.0361  0.0357  0.0915  762  GLU   A OE2 
907  N  N   . ALA   A 70  ? 0.7585 0.5252 0.7018 0.0193  0.028   0.1231  763  ALA   A N   
908  C  CA  . ALA   A 70  ? 0.7705 0.5211 0.7044 0.0281  0.0165  0.1315  763  ALA   A CA  
909  C  C   . ALA   A 70  ? 0.7743 0.512  0.718  0.0351  0.0134  0.1339  763  ALA   A C   
910  O  O   . ALA   A 70  ? 0.7687 0.5154 0.7213 0.0456  0.0034  0.1375  763  ALA   A O   
911  C  CB  . ALA   A 70  ? 0.7874 0.5184 0.694  0.0256  0.0175  0.1413  763  ALA   A CB  
917  N  N   . TYR   A 71  ? 0.7838 0.5002 0.7226 0.0292  0.0219  0.1327  764  TYR   A N   
918  C  CA  . TYR   A 71  ? 0.7994 0.4921 0.7376 0.0394  0.021   0.134   764  TYR   A CA  
919  C  C   . TYR   A 71  ? 0.7812 0.4967 0.7438 0.0497  0.0188  0.1258  764  TYR   A C   
920  O  O   . TYR   A 71  ? 0.7791 0.4975 0.7475 0.0675  0.0127  0.1311  764  TYR   A O   
921  C  CB  . TYR   A 71  ? 0.8258 0.4811 0.7437 0.0261  0.0305  0.133   764  TYR   A CB  
922  C  CG  . TYR   A 71  ? 0.8559 0.4808 0.7677 0.035   0.0326  0.1285  764  TYR   A CG  
923  C  CD1 . TYR   A 71  ? 0.8855 0.4814 0.7838 0.0573  0.0285  0.1366  764  TYR   A CD1 
924  C  CD2 . TYR   A 71  ? 0.8685 0.493  0.7845 0.0232  0.0388  0.1165  764  TYR   A CD2 
925  C  CE1 . TYR   A 71  ? 0.9137 0.4764 0.7997 0.0708  0.032   0.1322  764  TYR   A CE1 
926  C  CE2 . TYR   A 71  ? 0.897  0.4871 0.8002 0.0328  0.0412  0.1111  764  TYR   A CE2 
927  C  CZ  . TYR   A 71  ? 0.9274 0.4846 0.8141 0.0584  0.0385  0.1186  764  TYR   A CZ  
928  O  OH  . TYR   A 71  ? 0.9677 0.4853 0.8349 0.073   0.0425  0.1132  764  TYR   A OH  
938  N  N   . VAL   A 72  ? 0.7648 0.5008 0.7413 0.0393  0.0239  0.1145  765  VAL   A N   
939  C  CA  . VAL   A 72  ? 0.7525 0.5108 0.7506 0.0463  0.023   0.106   765  VAL   A CA  
940  C  C   . VAL   A 72  ? 0.7339 0.5236 0.7469 0.056   0.0124  0.1107  765  VAL   A C   
941  O  O   . VAL   A 72  ? 0.726  0.5305 0.753  0.0685  0.0094  0.1112  765  VAL   A O   
942  C  CB  . VAL   A 72  ? 0.7568 0.532  0.7636 0.0308  0.0298  0.0948  765  VAL   A CB  
943  C  CG1 . VAL   A 72  ? 0.747  0.5573 0.7757 0.0348  0.0261  0.0884  765  VAL   A CG1 
944  C  CG2 . VAL   A 72  ? 0.7767 0.5259 0.7728 0.021   0.0377  0.0885  765  VAL   A CG2 
954  N  N   . MET   A 73  ? 0.7269 0.5252 0.7333 0.0496  0.007   0.1148  766  MET   A N   
955  C  CA  . MET   A 73  ? 0.7173 0.5392 0.7297 0.0519  -0.005  0.1195  766  MET   A CA  
956  C  C   . MET   A 73  ? 0.7161 0.5392 0.7275 0.0633  -0.0142 0.1328  766  MET   A C   
957  O  O   . MET   A 73  ? 0.7027 0.5551 0.7296 0.0685  -0.0226 0.1375  766  MET   A O   
958  C  CB  . MET   A 73  ? 0.7294 0.5483 0.7236 0.0425  -0.0085 0.1196  766  MET   A CB  
959  C  CG  . MET   A 73  ? 0.7459 0.5744 0.743  0.0367  -0.002  0.1087  766  MET   A CG  
960  S  SD  . MET   A 73  ? 0.7919 0.609  0.7583 0.0335  -0.0039 0.1088  766  MET   A SD  
961  C  CE  . MET   A 73  ? 0.7771 0.5992 0.7373 0.0297  -0.0211 0.112   766  MET   A CE  
971  N  N   . ALA   A 74  ? 0.7286 0.5241 0.7221 0.067   -0.0128 0.1403  767  ALA   A N   
972  C  CA  . ALA   A 74  ? 0.732  0.529  0.7229 0.0808  -0.0214 0.1546  767  ALA   A CA  
973  C  C   . ALA   A 74  ? 0.7281 0.5296 0.7327 0.1012  -0.0172 0.1558  767  ALA   A C   
974  O  O   . ALA   A 74  ? 0.7163 0.5414 0.7297 0.1166  -0.0253 0.168   767  ALA   A O   
975  C  CB  . ALA   A 74  ? 0.7551 0.5167 0.7193 0.0799  -0.0201 0.1623  767  ALA   A CB  
981  N  N   . SER   A 75  ? 0.7372 0.5167 0.7407 0.1019  -0.0048 0.1441  768  SER   A N   
982  C  CA  . SER   A 75  ? 0.7467 0.5202 0.7543 0.123   0.0011  0.1428  768  SER   A CA  
983  C  C   . SER   A 75  ? 0.7265 0.552  0.7634 0.1314  -0.0027 0.1424  768  SER   A C   
984  O  O   . SER   A 75  ? 0.7209 0.5627 0.7652 0.1557  -0.003  0.1502  768  SER   A O   
985  C  CB  . SER   A 75  ? 0.7807 0.5144 0.7737 0.1153  0.0138  0.129   768  SER   A CB  
986  O  OG  . SER   A 75  ? 0.8316 0.523  0.798  0.1013  0.0173  0.1303  768  SER   A OG  
992  N  N   . VAL   A 76  ? 0.7147 0.5669 0.7662 0.1127  -0.0052 0.1345  769  VAL   A N   
993  C  CA  . VAL   A 76  ? 0.6985 0.5994 0.7755 0.115   -0.0091 0.1343  769  VAL   A CA  
994  C  C   . VAL   A 76  ? 0.688  0.6288 0.7739 0.106   -0.025  0.1473  769  VAL   A C   
995  O  O   . VAL   A 76  ? 0.6722 0.652  0.7751 0.0987  -0.0302 0.1477  769  VAL   A O   
996  C  CB  . VAL   A 76  ? 0.7052 0.6086 0.7892 0.1008  -0.0025 0.1183  769  VAL   A CB  
997  C  CG1 . VAL   A 76  ? 0.7298 0.5946 0.8014 0.1047  0.011   0.1064  769  VAL   A CG1 
998  C  CG2 . VAL   A 76  ? 0.7144 0.6149 0.7915 0.0781  -0.0071 0.1143  769  VAL   A CG2 
1008 N  N   . ASP   A 77  ? 0.6951 0.6269 0.7673 0.1055  -0.0336 0.1592  770  ASP   A N   
1009 C  CA  . ASP   A 77  ? 0.6897 0.6528 0.7624 0.0922  -0.0508 0.172   770  ASP   A CA  
1010 C  C   . ASP   A 77  ? 0.6633 0.6832 0.7589 0.1052  -0.0593 0.1882  770  ASP   A C   
1011 O  O   . ASP   A 77  ? 0.6516 0.7105 0.7544 0.0882  -0.0731 0.1965  770  ASP   A O   
1012 C  CB  . ASP   A 77  ? 0.7342 0.6611 0.7795 0.0877  -0.0549 0.1774  770  ASP   A CB  
1013 C  CG  . ASP   A 77  ? 0.7957 0.7357 0.8281 0.0654  -0.0717 0.1841  770  ASP   A CG  
1014 O  OD1 . ASP   A 77  ? 0.7886 0.7703 0.8312 0.0634  -0.0858 0.1988  770  ASP   A OD1 
1015 O  OD2 . ASP   A 77  ? 0.8456 0.7538 0.8548 0.0503  -0.0707 0.1753  770  ASP   A OD2 
1020 N  N   . ASN   A 78  A 0.6542 0.6786 0.7577 0.1351  -0.0517 0.1941  770  ASN   A N   
1021 C  CA  . ASN   A 78  A 0.6283 0.7126 0.7551 0.1564  -0.0563 0.2111  770  ASN   A CA  
1022 C  C   . ASN   A 78  A 0.611  0.7102 0.7547 0.1746  -0.042  0.2019  770  ASN   A C   
1023 O  O   . ASN   A 78  A 0.6366 0.6848 0.7649 0.1899  -0.0274 0.1895  770  ASN   A O   
1024 C  CB  . ASN   A 78  A 0.6616 0.7222 0.7737 0.1834  -0.0548 0.2225  770  ASN   A CB  
1025 C  CG  . ASN   A 78  A 0.7133 0.778  0.8129 0.1644  -0.0722 0.2355  770  ASN   A CG  
1026 O  OD1 . ASN   A 78  A 0.7077 0.8293 0.8211 0.1654  -0.0866 0.2549  770  ASN   A OD1 
1027 N  ND2 . ASN   A 78  A 0.7511 0.7588 0.8232 0.1466  -0.0713 0.226   770  ASN   A ND2 
1034 N  N   . PRO   A 79  B 0.5682 0.7314 0.7388 0.1711  -0.0452 0.207   770  PRO   A N   
1035 C  CA  . PRO   A 79  B 0.532  0.7606 0.7197 0.148   -0.0633 0.223   770  PRO   A CA  
1036 C  C   . PRO   A 79  B 0.5322 0.7381 0.7038 0.1065  -0.0747 0.2155  770  PRO   A C   
1037 O  O   . PRO   A 79  B 0.5289 0.7539 0.6937 0.0851  -0.0924 0.2285  770  PRO   A O   
1038 C  CB  . PRO   A 79  B 0.5123 0.8041 0.7292 0.1583  -0.0574 0.2263  770  PRO   A CB  
1039 C  CG  . PRO   A 79  B 0.5319 0.7925 0.7452 0.1947  -0.0364 0.2143  770  PRO   A CG  
1040 C  CD  . PRO   A 79  B 0.5532 0.7261 0.7356 0.19    -0.0299 0.1972  770  PRO   A CD  
1048 N  N   . GLY   A 80  C 0.5345 0.699  0.6967 0.0964  -0.065  0.1954  770  GLY   A N   
1049 C  CA  . GLY   A 80  C 0.5402 0.6765 0.6833 0.0646  -0.072  0.186   770  GLY   A CA  
1050 C  C   . GLY   A 80  C 0.5079 0.6801 0.6638 0.0477  -0.0753 0.1848  770  GLY   A C   
1051 O  O   . GLY   A 80  C 0.48   0.7134 0.6608 0.0529  -0.078  0.1972  770  GLY   A O   
1055 N  N   . ASN   A 81  ? 0.5087 0.645  0.6466 0.0287  -0.0746 0.171   771  ASN   A N   
1056 C  CA  . ASN   A 81  ? 0.4888 0.648  0.632  0.011   -0.0777 0.169   771  ASN   A CA  
1057 C  C   . ASN   A 81  ? 0.4977 0.625  0.6061 -0.02   -0.0924 0.1688  771  ASN   A C   
1058 O  O   . ASN   A 81  ? 0.5247 0.5988 0.6059 -0.0203 -0.0908 0.1603  771  ASN   A O   
1059 C  CB  . ASN   A 81  ? 0.5026 0.6429 0.6528 0.023   -0.0605 0.1509  771  ASN   A CB  
1060 C  CG  . ASN   A 81  ? 0.5224 0.6879 0.6796 0.0088  -0.0618 0.1489  771  ASN   A CG  
1061 O  OD1 . ASN   A 81  ? 0.5523 0.6882 0.6883 -0.0089 -0.0656 0.1416  771  ASN   A OD1 
1062 N  ND2 . ASN   A 81  ? 0.5013 0.7219 0.6858 0.0179  -0.0583 0.1563  771  ASN   A ND2 
1069 N  N   . PRO   A 82  ? 0.4769 0.6305 0.58   -0.0462 -0.1061 0.1779  772  PRO   A N   
1070 C  CA  . PRO   A 82  ? 0.5002 0.6068 0.558  -0.0745 -0.1197 0.1763  772  PRO   A CA  
1071 C  C   . PRO   A 82  ? 0.5195 0.5687 0.5533 -0.0707 -0.1096 0.1574  772  PRO   A C   
1072 O  O   . PRO   A 82  ? 0.5523 0.5495 0.542  -0.0836 -0.1171 0.154   772  PRO   A O   
1073 C  CB  . PRO   A 82  ? 0.4952 0.6437 0.5529 -0.1046 -0.1354 0.1906  772  PRO   A CB  
1074 C  CG  . PRO   A 82  ? 0.459  0.687  0.5654 -0.0912 -0.1311 0.2029  772  PRO   A CG  
1075 C  CD  . PRO   A 82  ? 0.4344 0.6582 0.567  -0.0524 -0.1096 0.1907  772  PRO   A CD  
1083 N  N   . HIS   A 83  ? 0.4981 0.5568 0.5572 -0.0524 -0.093  0.146   773  HIS   A N   
1084 C  CA  . HIS   A 83  ? 0.5157 0.5325 0.5574 -0.0475 -0.0834 0.1301  773  HIS   A CA  
1085 C  C   . HIS   A 83  ? 0.5209 0.5144 0.5689 -0.0245 -0.0677 0.1184  773  HIS   A C   
1086 O  O   . HIS   A 83  ? 0.5225 0.5038 0.5726 -0.0161 -0.0565 0.1064  773  HIS   A O   
1087 C  CB  . HIS   A 83  ? 0.505  0.5492 0.5654 -0.0495 -0.0782 0.1264  773  HIS   A CB  
1088 C  CG  . HIS   A 83  ? 0.51   0.5882 0.5697 -0.0738 -0.0926 0.1404  773  HIS   A CG  
1089 N  ND1 . HIS   A 83  ? 0.5543 0.601  0.5716 -0.101  -0.1094 0.1468  773  HIS   A ND1 
1090 C  CD2 . HIS   A 83  ? 0.4889 0.6302 0.5825 -0.0752 -0.0926 0.1505  773  HIS   A CD2 
1091 C  CE1 . HIS   A 83  ? 0.5408 0.6341 0.5688 -0.1227 -0.1203 0.1613  773  HIS   A CE1 
1092 N  NE2 . HIS   A 83  ? 0.5026 0.6587 0.579  -0.1068 -0.1099 0.1644  773  HIS   A NE2 
1100 N  N   . VAL   A 84  ? 0.5221 0.5103 0.5706 -0.0166 -0.0679 0.1232  774  VAL   A N   
1101 C  CA  . VAL   A 84  ? 0.5351 0.5003 0.5853 0.0004  -0.0548 0.1151  774  VAL   A CA  
1102 C  C   . VAL   A 84  ? 0.5625 0.4976 0.5833 -0.0037 -0.0623 0.1209  774  VAL   A C   
1103 O  O   . VAL   A 84  ? 0.5589 0.5089 0.5789 -0.0103 -0.0742 0.1334  774  VAL   A O   
1104 C  CB  . VAL   A 84  ? 0.5237 0.5141 0.6058 0.0176  -0.0454 0.1163  774  VAL   A CB  
1105 C  CG1 . VAL   A 84  ? 0.5417 0.5019 0.6178 0.0293  -0.0346 0.1107  774  VAL   A CG1 
1106 C  CG2 . VAL   A 84  ? 0.5127 0.5285 0.6184 0.0229  -0.0369 0.1094  774  VAL   A CG2 
1116 N  N   . CYS   A 85  ? 0.5867 0.4842 0.5828 0.0002  -0.0557 0.113   775  CYS   A N   
1117 C  CA  . CYS   A 85  ? 0.6194 0.4857 0.5834 -0.0018 -0.0609 0.1176  775  CYS   A CA  
1118 C  C   . CYS   A 85  ? 0.6178 0.4938 0.5979 0.007   -0.0584 0.1244  775  CYS   A C   
1119 O  O   . CYS   A 85  ? 0.6078 0.4932 0.612  0.0191  -0.0459 0.12    775  CYS   A O   
1120 C  CB  . CYS   A 85  ? 0.6528 0.4845 0.5896 0.0055  -0.0508 0.1082  775  CYS   A CB  
1121 S  SG  . CYS   A 85  ? 0.7296 0.5285 0.6234 -0.0017 -0.0576 0.1035  775  CYS   A SG  
1127 N  N   . ARG   A 86  ? 0.6298 0.4986 0.5914 0.0004  -0.0707 0.1353  776  ARG   A N   
1128 C  CA  . ARG   A 86  ? 0.634  0.5091 0.606  0.0101  -0.0698 0.1438  776  ARG   A CA  
1129 C  C   . ARG   A 86  ? 0.6627 0.5    0.6    0.0097  -0.0696 0.145   776  ARG   A C   
1130 O  O   . ARG   A 86  ? 0.6836 0.4961 0.5845 -0.0015 -0.0784 0.1453  776  ARG   A O   
1131 C  CB  . ARG   A 86  ? 0.6346 0.5498 0.6249 0.0071  -0.0837 0.1589  776  ARG   A CB  
1132 C  CG  . ARG   A 86  ? 0.6873 0.6058 0.6524 -0.0153 -0.1045 0.1695  776  ARG   A CG  
1133 C  CD  . ARG   A 86  ? 0.7044 0.6792 0.6964 -0.0242 -0.116  0.1814  776  ARG   A CD  
1134 N  NE  . ARG   A 86  ? 0.7183 0.7355 0.7443 -0.0048 -0.1138 0.193   776  ARG   A NE  
1135 C  CZ  . ARG   A 86  ? 0.7155 0.7922 0.775  -0.0005 -0.1169 0.2034  776  ARG   A CZ  
1136 N  NH1 . ARG   A 86  ? 0.6933 0.8025 0.7777 0.0237  -0.1131 0.2139  776  ARG   A NH1 
1137 N  NH2 . ARG   A 86  ? 0.7026 0.8066 0.7686 -0.0188 -0.1232 0.2041  776  ARG   A NH2 
1151 N  N   . LEU   A 87  ? 0.6644 0.4929 0.6083 0.0218  -0.0588 0.1454  777  LEU   A N   
1152 C  CA  . LEU   A 87  ? 0.6924 0.489  0.6061 0.0226  -0.0557 0.1473  777  LEU   A CA  
1153 C  C   . LEU   A 87  ? 0.7066 0.5017 0.6036 0.0178  -0.0715 0.1615  777  LEU   A C   
1154 O  O   . LEU   A 87  ? 0.6932 0.5091 0.611  0.0252  -0.0753 0.1716  777  LEU   A O   
1155 C  CB  . LEU   A 87  ? 0.6918 0.4813 0.6183 0.033   -0.0397 0.1447  777  LEU   A CB  
1156 C  CG  . LEU   A 87  ? 0.7291 0.4902 0.6275 0.0331  -0.0324 0.1464  777  LEU   A CG  
1157 C  CD1 . LEU   A 87  ? 0.7441 0.4978 0.629  0.032   -0.0207 0.136   777  LEU   A CD1 
1158 C  CD2 . LEU   A 87  ? 0.7365 0.4897 0.6444 0.0389  -0.0231 0.1503  777  LEU   A CD2 
1170 N  N   . LEU   A 88  ? 0.7333 0.5026 0.5896 0.0068  -0.0807 0.1628  778  LEU   A N   
1171 C  CA  . LEU   A 88  ? 0.7542 0.5197 0.5887 -0.0011 -0.097  0.1765  778  LEU   A CA  
1172 C  C   . LEU   A 88  ? 0.7728 0.5219 0.6002 0.01    -0.0889 0.1817  778  LEU   A C   
1173 O  O   . LEU   A 88  ? 0.7684 0.53   0.6006 0.0124  -0.0984 0.1954  778  LEU   A O   
1174 C  CB  . LEU   A 88  ? 0.7871 0.5189 0.5698 -0.0179 -0.1093 0.1748  778  LEU   A CB  
1175 C  CG  . LEU   A 88  ? 0.807  0.5474 0.5835 -0.0361 -0.1237 0.1743  778  LEU   A CG  
1176 C  CD1 . LEU   A 88  ? 0.8543 0.5402 0.5674 -0.0485 -0.1301 0.1677  778  LEU   A CD1 
1177 C  CD2 . LEU   A 88  ? 0.7951 0.5783 0.5893 -0.0505 -0.1442 0.1912  778  LEU   A CD2 
1189 N  N   . GLY   A 89  ? 0.7896 0.514  0.605  0.0163  -0.0718 0.1724  779  GLY   A N   
1190 C  CA  . GLY   A 89  ? 0.8093 0.5169 0.6158 0.0235  -0.0621 0.177   779  GLY   A CA  
1191 C  C   . GLY   A 89  ? 0.8287 0.5186 0.6203 0.0264  -0.0437 0.167   779  GLY   A C   
1192 O  O   . GLY   A 89  ? 0.8274 0.5215 0.6219 0.0269  -0.0371 0.1561  779  GLY   A O   
1196 N  N   . ILE   A 90  ? 0.8446 0.5183 0.6202 0.0287  -0.0351 0.1723  780  ILE   A N   
1197 C  CA  . ILE   A 90  ? 0.8621 0.5283 0.6232 0.0309  -0.017  0.1664  780  ILE   A CA  
1198 C  C   . ILE   A 90  ? 0.8933 0.5337 0.6087 0.0306  -0.0171 0.1723  780  ILE   A C   
1199 O  O   . ILE   A 90  ? 0.9022 0.5296 0.602  0.0274  -0.0299 0.1826  780  ILE   A O   
1200 C  CB  . ILE   A 90  ? 0.859  0.5366 0.6469 0.0304  -0.0017 0.1663  780  ILE   A CB  
1201 C  CG1 . ILE   A 90  ? 0.8818 0.542  0.662  0.0285  -0.0028 0.1789  780  ILE   A CG1 
1202 C  CG2 . ILE   A 90  ? 0.845  0.5435 0.6719 0.031   -0.0016 0.159   780  ILE   A CG2 
1203 C  CD1 . ILE   A 90  ? 0.899  0.5574 0.6859 0.022   0.0133  0.1802  780  ILE   A CD1 
1215 N  N   . CYS   A 91  ? 0.9062 0.5424 0.5994 0.0357  -0.0025 0.1667  781  CYS   A N   
1216 C  CA  . CYS   A 91  ? 0.9411 0.5534 0.5871 0.0384  0.0012  0.1711  781  CYS   A CA  
1217 C  C   . CYS   A 91  ? 0.9393 0.5673 0.5895 0.0406  0.0225  0.174   781  CYS   A C   
1218 O  O   . CYS   A 91  ? 0.9226 0.5782 0.5979 0.0433  0.0359  0.1681  781  CYS   A O   
1219 C  CB  . CYS   A 91  ? 0.9741 0.5638 0.5781 0.0456  -0.0012 0.1624  781  CYS   A CB  
1220 S  SG  . CYS   A 91  ? 1.0584 0.6083 0.5926 0.0503  0.0003  0.1666  781  CYS   A SG  
1226 N  N   . LEU   A 92  ? 0.9553 0.569  0.5806 0.0373  0.0252  0.1844  782  LEU   A N   
1227 C  CA  . LEU   A 92  ? 0.9563 0.5867 0.5827 0.0346  0.0445  0.1904  782  LEU   A CA  
1228 C  C   . LEU   A 92  ? 0.9805 0.6058 0.562  0.0449  0.0569  0.1911  782  LEU   A C   
1229 O  O   . LEU   A 92  ? 0.9987 0.6055 0.549  0.042   0.0571  0.2005  782  LEU   A O   
1230 C  CB  . LEU   A 92  ? 0.9616 0.5796 0.5931 0.0223  0.0403  0.2035  782  LEU   A CB  
1231 C  CG  . LEU   A 92  ? 0.9682 0.5843 0.6358 0.0171  0.0291  0.2044  782  LEU   A CG  
1232 C  CD1 . LEU   A 92  ? 0.985  0.5769 0.6426 0.0108  0.0242  0.2185  782  LEU   A CD1 
1233 C  CD2 . LEU   A 92  ? 0.9564 0.5988 0.6613 0.0118  0.04    0.1973  782  LEU   A CD2 
1245 N  N   . THR   A 93  ? 0.9777 0.6202 0.5546 0.0594  0.0687  0.1817  783  THR   A N   
1246 C  CA  . THR   A 93  ? 0.9995 0.6419 0.5334 0.0764  0.0846  0.1815  783  THR   A CA  
1247 C  C   . THR   A 93  ? 0.9734 0.6702 0.5336 0.0733  0.1075  0.1892  783  THR   A C   
1248 O  O   . THR   A 93  ? 0.96   0.6709 0.5518 0.0526  0.1064  0.1971  783  THR   A O   
1249 C  CB  . THR   A 93  ? 1.0334 0.6588 0.5424 0.0968  0.0831  0.168   783  THR   A CB  
1250 O  OG1 . THR   A 93  ? 1.0211 0.686  0.5735 0.1008  0.0903  0.1622  783  THR   A OG1 
1251 C  CG2 . THR   A 93  ? 1.0641 0.6402 0.5491 0.0909  0.0587  0.1626  783  THR   A CG2 
1259 N  N   . SER   A 94  ? 0.9649 0.6925 0.5103 0.0929  0.1277  0.1883  784  SER   A N   
1260 C  CA  . SER   A 94  ? 0.9346 0.7264 0.5099 0.0871  0.148   0.1975  784  SER   A CA  
1261 C  C   . SER   A 94  ? 0.901  0.7257 0.5344 0.07    0.144   0.1948  784  SER   A C   
1262 O  O   . SER   A 94  ? 0.8812 0.7461 0.5424 0.0497  0.1526  0.2044  784  SER   A O   
1263 C  CB  . SER   A 94  ? 0.9483 0.7742 0.501  0.1174  0.1692  0.1966  784  SER   A CB  
1264 O  OG  . SER   A 94  ? 0.9878 0.7947 0.5293 0.1415  0.1647  0.1827  784  SER   A OG  
1270 N  N   . THR   A 95  ? 0.8939 0.6986 0.541  0.0759  0.1302  0.1823  785  THR   A N   
1271 C  CA  . THR   A 95  ? 0.8677 0.6931 0.5636 0.0619  0.124   0.1775  785  THR   A CA  
1272 C  C   . THR   A 95  ? 0.8721 0.6497 0.5735 0.0531  0.1016  0.1718  785  THR   A C   
1273 O  O   . THR   A 95  ? 0.8986 0.6339 0.5673 0.0607  0.0903  0.1698  785  THR   A O   
1274 C  CB  . THR   A 95  ? 0.8705 0.7274 0.5787 0.0818  0.1309  0.1687  785  THR   A CB  
1275 O  OG1 . THR   A 95  ? 0.9097 0.7222 0.5808 0.1039  0.1227  0.1591  785  THR   A OG1 
1276 C  CG2 . THR   A 95  ? 0.8549 0.7738 0.5655 0.0932  0.1535  0.1763  785  THR   A CG2 
1284 N  N   . VAL   A 96  ? 0.8435 0.6303 0.5843 0.0375  0.0952  0.1696  786  VAL   A N   
1285 C  CA  . VAL   A 96  ? 0.8437 0.5965 0.5943 0.0327  0.0762  0.1654  786  VAL   A CA  
1286 C  C   . VAL   A 96  ? 0.8313 0.585  0.5877 0.0461  0.0696  0.1534  786  VAL   A C   
1287 O  O   . VAL   A 96  ? 0.8138 0.6005 0.5919 0.0497  0.0779  0.148   786  VAL   A O   
1288 C  CB  . VAL   A 96  ? 0.84   0.5959 0.6228 0.0137  0.0737  0.168   786  VAL   A CB  
1289 C  CG1 . VAL   A 96  ? 0.8518 0.5807 0.646  0.015   0.0561  0.1643  786  VAL   A CG1 
1290 C  CG2 . VAL   A 96  ? 0.8526 0.5992 0.622  -0.0017 0.0796  0.1809  786  VAL   A CG2 
1300 N  N   . GLN   A 97  ? 0.8382 0.5571 0.5729 0.0515  0.0542  0.1505  787  GLN   A N   
1301 C  CA  . GLN   A 97  ? 0.8364 0.5484 0.5682 0.0604  0.0461  0.1404  787  GLN   A CA  
1302 C  C   . GLN   A 97  ? 0.8225 0.525  0.576  0.0507  0.0279  0.1392  787  GLN   A C   
1303 O  O   . GLN   A 97  ? 0.8287 0.5162 0.5798 0.0431  0.0177  0.1467  787  GLN   A O   
1304 C  CB  . GLN   A 97  ? 0.8856 0.5617 0.5625 0.0728  0.0426  0.1384  787  GLN   A CB  
1305 C  CG  . GLN   A 97  ? 0.9361 0.6145 0.5797 0.0866  0.06    0.1416  787  GLN   A CG  
1306 C  CD  . GLN   A 97  ? 1.0225 0.6523 0.6031 0.0992  0.0545  0.138   787  GLN   A CD  
1307 O  OE1 . GLN   A 97  ? 1.0595 0.6524 0.6145 0.0887  0.0379  0.1406  787  GLN   A OE1 
1308 N  NE2 . GLN   A 97  ? 1.0432 0.6697 0.5932 0.1224  0.0676  0.1325  787  GLN   A NE2 
1317 N  N   . LEU   A 98  ? 0.8019 0.515  0.574  0.0525  0.0238  0.1309  788  LEU   A N   
1318 C  CA  . LEU   A 98  ? 0.7911 0.5034 0.5845 0.0445  0.0078  0.1304  788  LEU   A CA  
1319 C  C   . LEU   A 98  ? 0.8052 0.4904 0.5647 0.044   -0.0072 0.1286  788  LEU   A C   
1320 O  O   . LEU   A 98  ? 0.8206 0.4888 0.5478 0.0528  -0.003  0.1228  788  LEU   A O   
1321 C  CB  . LEU   A 98  ? 0.7705 0.5119 0.6043 0.0436  0.012   0.1232  788  LEU   A CB  
1322 C  CG  . LEU   A 98  ? 0.7718 0.5379 0.634  0.0401  0.0263  0.1231  788  LEU   A CG  
1323 C  CD1 . LEU   A 98  ? 0.7602 0.5512 0.6539 0.039   0.0286  0.1149  788  LEU   A CD1 
1324 C  CD2 . LEU   A 98  ? 0.7807 0.5374 0.6523 0.0322  0.0239  0.1309  788  LEU   A CD2 
1336 N  N   . ILE   A 99  ? 0.799  0.4801 0.5626 0.0335  -0.0249 0.1345  789  ILE   A N   
1337 C  CA  . ILE   A 99  ? 0.8191 0.4757 0.5485 0.0252  -0.0425 0.1353  789  ILE   A CA  
1338 C  C   . ILE   A 99  ? 0.7992 0.4802 0.5606 0.0154  -0.0548 0.1359  789  ILE   A C   
1339 O  O   . ILE   A 99  ? 0.7754 0.4869 0.5779 0.0149  -0.0557 0.1409  789  ILE   A O   
1340 C  CB  . ILE   A 99  ? 0.8432 0.4783 0.5411 0.0175  -0.055  0.1457  789  ILE   A CB  
1341 C  CG1 . ILE   A 99  ? 0.8671 0.4871 0.5426 0.027   -0.041  0.1479  789  ILE   A CG1 
1342 C  CG2 . ILE   A 99  ? 0.8764 0.4773 0.5249 0.0049  -0.0732 0.1459  789  ILE   A CG2 
1343 C  CD1 . ILE   A 99  ? 0.906  0.4996 0.5379 0.0398  -0.0273 0.1398  789  ILE   A CD1 
1355 N  N   . THR   A 100 ? 0.8094 0.4743 0.5475 0.0084  -0.0638 0.1313  790  THR   A N   
1356 C  CA  . THR   A 100 ? 0.7979 0.4866 0.5607 -0.0037 -0.0759 0.1329  790  THR   A CA  
1357 C  C   . THR   A 100 ? 0.8312 0.4846 0.544  -0.0206 -0.0933 0.1335  790  THR   A C   
1358 O  O   . THR   A 100 ? 0.8666 0.4713 0.5244 -0.0174 -0.0924 0.1289  790  THR   A O   
1359 C  CB  . THR   A 100 ? 0.7889 0.5024 0.5884 0.0057  -0.0624 0.1236  790  THR   A CB  
1360 O  OG1 . THR   A 100 ? 0.7787 0.5232 0.6087 -0.0047 -0.0723 0.1268  790  THR   A OG1 
1361 C  CG2 . THR   A 100 ? 0.8138 0.4988 0.5808 0.014   -0.0548 0.1135  790  THR   A CG2 
1369 N  N   . GLN   A 101 ? 0.8209 0.4969 0.5485 -0.039  -0.109  0.1394  791  GLN   A N   
1370 C  CA  . GLN   A 101 ? 0.8566 0.4976 0.5341 -0.0616 -0.1275 0.1412  791  GLN   A CA  
1371 C  C   . GLN   A 101 ? 0.8837 0.4831 0.5282 -0.0517 -0.1179 0.1281  791  GLN   A C   
1372 O  O   . GLN   A 101 ? 0.8647 0.4894 0.5464 -0.0368 -0.1035 0.1213  791  GLN   A O   
1373 C  CB  . GLN   A 101 ? 0.8563 0.5434 0.565  -0.0842 -0.144  0.152   791  GLN   A CB  
1374 C  CG  . GLN   A 101 ? 0.9379 0.5941 0.5928 -0.1176 -0.1684 0.1591  791  GLN   A CG  
1375 C  CD  . GLN   A 101 ? 0.9836 0.679  0.662  -0.1402 -0.1804 0.1664  791  GLN   A CD  
1376 O  OE1 . GLN   A 101 ? 0.9678 0.7149 0.7037 -0.1287 -0.1699 0.1656  791  GLN   A OE1 
1377 N  NE2 . GLN   A 101 ? 1.0185 0.6887 0.6488 -0.1751 -0.2031 0.1742  791  GLN   A NE2 
1386 N  N   . LEU   A 102 ? 0.9276 0.4606 0.4987 -0.0577 -0.1255 0.1248  792  LEU   A N   
1387 C  CA  . LEU   A 102 ? 0.9602 0.4461 0.4902 -0.043  -0.1163 0.1134  792  LEU   A CA  
1388 C  C   . LEU   A 102 ? 0.9577 0.4493 0.4942 -0.059  -0.1255 0.1137  792  LEU   A C   
1389 O  O   . LEU   A 102 ? 0.959  0.4578 0.4908 -0.0905 -0.1459 0.123   792  LEU   A O   
1390 C  CB  . LEU   A 102 ? 1.0214 0.4242 0.4599 -0.0434 -0.1226 0.11    792  LEU   A CB  
1391 C  CG  . LEU   A 102 ? 1.0829 0.4213 0.4603 -0.0227 -0.1134 0.099   792  LEU   A CG  
1392 C  CD1 . LEU   A 102 ? 1.0727 0.4369 0.4794 0.0177  -0.0856 0.0915  792  LEU   A CD1 
1393 C  CD2 . LEU   A 102 ? 1.154  0.4027 0.4323 -0.0271 -0.1231 0.0966  792  LEU   A CD2 
1405 N  N   . MET   A 103 ? 0.9507 0.4435 0.4981 -0.0382 -0.1106 0.1049  793  MET   A N   
1406 C  CA  . MET   A 103 ? 0.9533 0.4465 0.5024 -0.0491 -0.1165 0.1041  793  MET   A CA  
1407 C  C   . MET   A 103 ? 1.0161 0.4229 0.4794 -0.0397 -0.1173 0.0971  793  MET   A C   
1408 O  O   . MET   A 103 ? 1.0237 0.417  0.4775 -0.006  -0.0988 0.0888  793  MET   A O   
1409 C  CB  . MET   A 103 ? 0.9142 0.4676 0.5326 -0.0299 -0.099  0.0994  793  MET   A CB  
1410 C  CG  . MET   A 103 ? 0.8854 0.5109 0.5778 -0.0336 -0.0959 0.1049  793  MET   A CG  
1411 S  SD  . MET   A 103 ? 0.8973 0.5671 0.6205 -0.0673 -0.1158 0.1175  793  MET   A SD  
1412 C  CE  . MET   A 103 ? 0.8813 0.5561 0.5982 -0.0796 -0.128  0.1286  793  MET   A CE  
1422 N  N   . PRO   A 104 ? 1.0632 0.4075 0.457  -0.0679 -0.1383 0.101   794  PRO   A N   
1423 C  CA  . PRO   A 104 ? 1.1315 0.3781 0.4298 -0.0556 -0.1386 0.0937  794  PRO   A CA  
1424 C  C   . PRO   A 104 ? 1.1491 0.3741 0.4339 -0.0296 -0.1263 0.0863  794  PRO   A C   
1425 O  O   . PRO   A 104 ? 1.1919 0.3544 0.4151 0.0014  -0.1157 0.0789  794  PRO   A O   
1426 C  CB  . PRO   A 104 ? 1.1794 0.3708 0.4134 -0.1011 -0.167  0.1012  794  PRO   A CB  
1427 C  CG  . PRO   A 104 ? 1.1425 0.4026 0.4321 -0.1308 -0.1797 0.1128  794  PRO   A CG  
1428 C  CD  . PRO   A 104 ? 1.0541 0.412  0.4474 -0.1123 -0.1631 0.1133  794  PRO   A CD  
1436 N  N   . PHE   A 105 ? 1.1156 0.3906 0.4534 -0.0398 -0.1274 0.0891  795  PHE   A N   
1437 C  CA  . PHE   A 105 ? 1.1328 0.3885 0.4567 -0.018  -0.1182 0.0838  795  PHE   A CA  
1438 C  C   . PHE   A 105 ? 1.0899 0.4059 0.4748 0.0236  -0.0925 0.0777  795  PHE   A C   
1439 O  O   . PHE   A 105 ? 1.092  0.4068 0.4764 0.0421  -0.0849 0.0747  795  PHE   A O   
1440 C  CB  . PHE   A 105 ? 1.1257 0.3981 0.4655 -0.052  -0.1333 0.0904  795  PHE   A CB  
1441 C  CG  . PHE   A 105 ? 1.1853 0.3884 0.4501 -0.0942 -0.159  0.0974  795  PHE   A CG  
1442 C  CD1 . PHE   A 105 ? 1.178  0.4158 0.4643 -0.1348 -0.1767 0.1078  795  PHE   A CD1 
1443 C  CD2 . PHE   A 105 ? 1.2624 0.3635 0.4305 -0.0933 -0.1661 0.0945  795  PHE   A CD2 
1444 C  CE1 . PHE   A 105 ? 1.2306 0.4089 0.4463 -0.1787 -0.2022 0.1158  795  PHE   A CE1 
1445 C  CE2 . PHE   A 105 ? 1.3205 0.3511 0.412  -0.1375 -0.1914 0.1013  795  PHE   A CE2 
1446 C  CZ  . PHE   A 105 ? 1.2954 0.3681 0.4126 -0.1824 -0.2099 0.1122  795  PHE   A CZ  
1456 N  N   . GLY   A 106 ? 1.0545 0.4174 0.4835 0.0373  -0.0802 0.0767  796  GLY   A N   
1457 C  CA  . GLY   A 106 ? 1.0214 0.4393 0.5007 0.0714  -0.0573 0.0725  796  GLY   A CA  
1458 C  C   . GLY   A 106 ? 0.9679 0.4623 0.5267 0.0668  -0.0521 0.0729  796  GLY   A C   
1459 O  O   . GLY   A 106 ? 0.9492 0.4693 0.5396 0.0376  -0.0644 0.077   796  GLY   A O   
1463 N  N   . CYS   A 107 ? 0.942  0.4764 0.5326 0.0956  -0.0338 0.0694  797  CYS   A N   
1464 C  CA  . CYS   A 107 ? 0.9004 0.5035 0.5607 0.0915  -0.0285 0.0688  797  CYS   A CA  
1465 C  C   . CYS   A 107 ? 0.9107 0.4971 0.5555 0.087   -0.0358 0.0685  797  CYS   A C   
1466 O  O   . CYS   A 107 ? 0.9542 0.4805 0.5355 0.101   -0.0381 0.0679  797  CYS   A O   
1467 C  CB  . CYS   A 107 ? 0.8811 0.5391 0.5827 0.116   -0.0088 0.0668  797  CYS   A CB  
1468 S  SG  . CYS   A 107 ? 0.9462 0.6052 0.6262 0.1534  0.0041  0.0652  797  CYS   A SG  
1474 N  N   . LEU   A 108 ? 0.8715 0.5062 0.5692 0.0678  -0.0396 0.0694  798  LEU   A N   
1475 C  CA  . LEU   A 108 ? 0.8772 0.5047 0.5676 0.0583  -0.0471 0.0704  798  LEU   A CA  
1476 C  C   . LEU   A 108 ? 0.8771 0.5092 0.5611 0.0874  -0.036  0.0674  798  LEU   A C   
1477 O  O   . LEU   A 108 ? 0.9028 0.498  0.5492 0.087   -0.0429 0.0688  798  LEU   A O   
1478 C  CB  . LEU   A 108 ? 0.8395 0.5249 0.591  0.0327  -0.0516 0.0723  798  LEU   A CB  
1479 C  CG  . LEU   A 108 ? 0.8557 0.544  0.6069 0.0159  -0.0604 0.075   798  LEU   A CG  
1480 C  CD1 . LEU   A 108 ? 0.9037 0.5291 0.5921 -0.0066 -0.0783 0.0814  798  LEU   A CD1 
1481 C  CD2 . LEU   A 108 ? 0.822  0.5746 0.6363 -0.0021 -0.0606 0.0764  798  LEU   A CD2 
1493 N  N   . LEU   A 109 ? 0.8497 0.5256 0.5656 0.1119  -0.0198 0.0648  799  LEU   A N   
1494 C  CA  . LEU   A 109 ? 0.8516 0.5415 0.5627 0.1417  -0.0095 0.0642  799  LEU   A CA  
1495 C  C   . LEU   A 109 ? 0.9111 0.5258 0.5414 0.1678  -0.0101 0.0656  799  LEU   A C   
1496 O  O   . LEU   A 109 ? 0.9294 0.5217 0.531  0.1817  -0.0116 0.0669  799  LEU   A O   
1497 C  CB  . LEU   A 109 ? 0.814  0.5707 0.573  0.1587  0.007   0.0636  799  LEU   A CB  
1498 C  CG  . LEU   A 109 ? 0.821  0.608  0.5797 0.192   0.019   0.0658  799  LEU   A CG  
1499 C  CD1 . LEU   A 109 ? 0.8122 0.6244 0.592  0.1866  0.0148  0.0657  799  LEU   A CD1 
1500 C  CD2 . LEU   A 109 ? 0.7908 0.6463 0.595  0.2003  0.0334  0.0674  799  LEU   A CD2 
1512 N  N   . ASP   A 110 ? 0.9429 0.5133 0.5312 0.1752  -0.0093 0.0653  800  ASP   A N   
1513 C  CA  . ASP   A 110 ? 1.01   0.4965 0.5103 0.201   -0.0097 0.0654  800  ASP   A CA  
1514 C  C   . ASP   A 110 ? 1.0612 0.4686 0.5023 0.175   -0.0295 0.0664  800  ASP   A C   
1515 O  O   . ASP   A 110 ? 1.1076 0.4498 0.4816 0.1945  -0.0314 0.067   800  ASP   A O   
1516 C  CB  . ASP   A 110 ? 1.05   0.5107 0.5199 0.2137  -0.0033 0.0643  800  ASP   A CB  
1517 C  CG  . ASP   A 110 ? 1.0696 0.6011 0.5838 0.2421  0.0172  0.0654  800  ASP   A CG  
1518 O  OD1 . ASP   A 110 ? 1.065  0.6305 0.5887 0.2732  0.0291  0.0676  800  ASP   A OD1 
1519 O  OD2 . ASP   A 110 ? 1.0826 0.6375 0.6205 0.2323  0.021   0.0654  800  ASP   A OD2 
1524 N  N   . TYR   A 111 ? 1.0555 0.4693 0.5187 0.1313  -0.0442 0.0678  801  TYR   A N   
1525 C  CA  . TYR   A 111 ? 1.1018 0.4531 0.515  0.098   -0.0647 0.0713  801  TYR   A CA  
1526 C  C   . TYR   A 111 ? 1.1145 0.4642 0.5249 0.0971  -0.0681 0.0735  801  TYR   A C   
1527 O  O   . TYR   A 111 ? 1.1705 0.4383 0.5042 0.0928  -0.0789 0.0757  801  TYR   A O   
1528 C  CB  . TYR   A 111 ? 1.0768 0.4649 0.5335 0.0534  -0.0777 0.0751  801  TYR   A CB  
1529 C  CG  . TYR   A 111 ? 1.1272 0.4527 0.5262 0.0144  -0.1002 0.081   801  TYR   A CG  
1530 C  CD1 . TYR   A 111 ? 1.1308 0.4698 0.5416 -0.0136 -0.1112 0.0865  801  TYR   A CD1 
1531 C  CD2 . TYR   A 111 ? 1.1873 0.4416 0.5177 0.0026  -0.1112 0.0819  801  TYR   A CD2 
1532 C  CE1 . TYR   A 111 ? 1.1784 0.4637 0.5344 -0.0541 -0.1327 0.0941  801  TYR   A CE1 
1533 C  CE2 . TYR   A 111 ? 1.2362 0.4331 0.5096 -0.0389 -0.1339 0.0886  801  TYR   A CE2 
1534 C  CZ  . TYR   A 111 ? 1.2372 0.4511 0.5239 -0.0682 -0.1448 0.0953  801  TYR   A CZ  
1535 O  OH  . TYR   A 111 ? 1.2914 0.4526 0.5206 -0.114  -0.1682 0.104   801  TYR   A OH  
1545 N  N   . VAL   A 112 ? 1.0628 0.4966 0.5503 0.0996  -0.0596 0.073   802  VAL   A N   
1546 C  CA  . VAL   A 112 ? 1.0713 0.5087 0.5586 0.0992  -0.0624 0.0753  802  VAL   A CA  
1547 C  C   . VAL   A 112 ? 1.1105 0.5058 0.5455 0.1438  -0.0534 0.075   802  VAL   A C   
1548 O  O   . VAL   A 112 ? 1.1389 0.4947 0.5349 0.1442  -0.06   0.0783  802  VAL   A O   
1549 C  CB  . VAL   A 112 ? 1.017  0.5498 0.5935 0.0872  -0.0573 0.0747  802  VAL   A CB  
1550 C  CG1 . VAL   A 112 ? 0.9978 0.5664 0.6174 0.0472  -0.0664 0.0766  802  VAL   A CG1 
1551 C  CG2 . VAL   A 112 ? 0.9822 0.5827 0.613  0.1169  -0.0391 0.0704  802  VAL   A CG2 
1561 N  N   . ARG   A 113 ? 1.1143 0.5184 0.5456 0.1824  -0.0382 0.0723  803  ARG   A N   
1562 C  CA  . ARG   A 113 ? 1.1539 0.5242 0.5346 0.2316  -0.0277 0.0736  803  ARG   A CA  
1563 C  C   . ARG   A 113 ? 1.2503 0.4964 0.5191 0.2402  -0.0363 0.0738  803  ARG   A C   
1564 O  O   . ARG   A 113 ? 1.2931 0.4813 0.4998 0.2672  -0.0363 0.0764  803  ARG   A O   
1565 C  CB  . ARG   A 113 ? 1.1298 0.5605 0.5457 0.2691  -0.0076 0.0726  803  ARG   A CB  
1566 C  CG  . ARG   A 113 ? 1.0778 0.6228 0.5912 0.2645  0.0014  0.0731  803  ARG   A CG  
1567 C  CD  . ARG   A 113 ? 1.0671 0.6723 0.6134 0.292   0.0193  0.0739  803  ARG   A CD  
1568 N  NE  . ARG   A 113 ? 1.0249 0.7332 0.6524 0.2891  0.0273  0.0757  803  ARG   A NE  
1569 C  CZ  . ARG   A 113 ? 1.0049 0.7846 0.6778 0.2995  0.0409  0.0777  803  ARG   A CZ  
1570 N  NH1 . ARG   A 113 ? 1.0115 0.7755 0.6607 0.3161  0.0496  0.0783  803  ARG   A NH1 
1571 N  NH2 . ARG   A 113 ? 0.9509 0.8171 0.6901 0.2909  0.0454  0.0795  803  ARG   A NH2 
1585 N  N   . GLU   A 114 ? 1.2853 0.4866 0.5232 0.2182  -0.044  0.0712  804  GLU   A N   
1586 C  CA  . GLU   A 114 ? 1.3805 0.4566 0.5051 0.2209  -0.0538 0.0705  804  GLU   A CA  
1587 C  C   . GLU   A 114 ? 1.433  0.4416 0.5075 0.1815  -0.0754 0.0747  804  GLU   A C   
1588 O  O   . GLU   A 114 ? 1.4954 0.4138 0.4832 0.2008  -0.0788 0.0761  804  GLU   A O   
1589 C  CB  . GLU   A 114 ? 1.4236 0.4777 0.5326 0.2034  -0.0575 0.0671  804  GLU   A CB  
1590 C  CG  . GLU   A 114 ? 1.4663 0.558  0.5939 0.246   -0.0363 0.0638  804  GLU   A CG  
1591 C  CD  . GLU   A 114 ? 1.5495 0.6418 0.6821 0.2256  -0.039  0.0614  804  GLU   A CD  
1592 O  OE1 . GLU   A 114 ? 1.5986 0.6527 0.6819 0.2582  -0.0281 0.0584  804  GLU   A OE1 
1593 O  OE2 . GLU   A 114 ? 1.5475 0.6807 0.7325 0.1796  -0.0514 0.0632  804  GLU   A OE2 
1600 N  N   . HIS   A 115 ? 1.404  0.4594 0.5328 0.1282  -0.0892 0.0778  805  HIS   A N   
1601 C  CA  . HIS   A 115 ? 1.4461 0.4515 0.5348 0.0837  -0.1102 0.0841  805  HIS   A CA  
1602 C  C   . HIS   A 115 ? 1.4199 0.4752 0.5526 0.0825  -0.1087 0.0883  805  HIS   A C   
1603 O  O   . HIS   A 115 ? 1.4082 0.4853 0.5636 0.0373  -0.1222 0.0941  805  HIS   A O   
1604 C  CB  . HIS   A 115 ? 1.4405 0.473  0.5592 0.0271  -0.1263 0.0878  805  HIS   A CB  
1605 C  CG  . HIS   A 115 ? 1.5048 0.4922 0.582  0.0252  -0.1293 0.0845  805  HIS   A CG  
1606 N  ND1 . HIS   A 115 ? 1.4975 0.5386 0.6233 0.0546  -0.1125 0.0787  805  HIS   A ND1 
1607 C  CD2 . HIS   A 115 ? 1.5811 0.4738 0.5696 -0.0043 -0.1476 0.0867  805  HIS   A CD2 
1608 C  CE1 . HIS   A 115 ? 1.5442 0.5237 0.6118 0.0446  -0.1203 0.0772  805  HIS   A CE1 
1609 N  NE2 . HIS   A 115 ? 1.5996 0.4883 0.583  0.0088  -0.1418 0.0816  805  HIS   A NE2 
1617 N  N   . LYS   A 116 ? 1.4113 0.4848 0.5519 0.132   -0.0926 0.0864  806  LYS   A N   
1618 C  CA  . LYS   A 116 ? 1.3897 0.5082 0.5666 0.1365  -0.0903 0.0903  806  LYS   A CA  
1619 C  C   . LYS   A 116 ? 1.4314 0.4866 0.5542 0.0978  -0.1096 0.0977  806  LYS   A C   
1620 O  O   . LYS   A 116 ? 1.3927 0.5107 0.5727 0.0683  -0.1141 0.1016  806  LYS   A O   
1621 C  CB  . LYS   A 116 ? 1.4259 0.5381 0.5813 0.1983  -0.0743 0.0897  806  LYS   A CB  
1622 C  CG  . LYS   A 116 ? 1.4337 0.6326 0.6569 0.2338  -0.0542 0.0852  806  LYS   A CG  
1623 C  CD  . LYS   A 116 ? 1.5037 0.7041 0.7041 0.2952  -0.039  0.0877  806  LYS   A CD  
1624 C  CE  . LYS   A 116 ? 1.5037 0.8001 0.7738 0.3252  -0.0197 0.0857  806  LYS   A CE  
1625 N  NZ  . LYS   A 116 ? 1.5454 0.8561 0.7965 0.3863  -0.0046 0.0908  806  LYS   A NZ  
1639 N  N   . ASP   A 117 ? 1.5076 0.4363 0.5161 0.0976  -0.1207 0.1     807  ASP   A N   
1640 C  CA  . ASP   A 117 ? 1.5592 0.4122 0.4999 0.0613  -0.1396 0.1084  807  ASP   A CA  
1641 C  C   . ASP   A 117 ? 1.5704 0.3958 0.4894 -0.006  -0.1614 0.1137  807  ASP   A C   
1642 O  O   . ASP   A 117 ? 1.6256 0.3714 0.47   -0.04   -0.179  0.1217  807  ASP   A O   
1643 C  CB  . ASP   A 117 ? 1.6706 0.3905 0.4875 0.0991  -0.1404 0.1092  807  ASP   A CB  
1644 C  CG  . ASP   A 117 ? 1.7228 0.471  0.5545 0.1692  -0.1195 0.1068  807  ASP   A CG  
1645 O  OD1 . ASP   A 117 ? 1.7557 0.4752 0.5556 0.185   -0.1207 0.1129  807  ASP   A OD1 
1646 O  OD2 . ASP   A 117 ? 1.7204 0.5223 0.5948 0.2075  -0.1024 0.1004  807  ASP   A OD2 
1651 N  N   . ASN   A 118 ? 1.5187 0.4093 0.4992 -0.0267 -0.1611 0.1108  808  ASN   A N   
1652 C  CA  . ASN   A 118 ? 1.5223 0.4034 0.4908 -0.0898 -0.182  0.118   808  ASN   A CA  
1653 C  C   . ASN   A 118 ? 1.4235 0.4393 0.5104 -0.1205 -0.1809 0.1217  808  ASN   A C   
1654 O  O   . ASN   A 118 ? 1.4204 0.4483 0.5088 -0.1731 -0.1979 0.1307  808  ASN   A O   
1655 C  CB  . ASN   A 118 ? 1.5837 0.3986 0.4941 -0.0903 -0.1871 0.1133  808  ASN   A CB  
1656 C  CG  . ASN   A 118 ? 1.7071 0.3938 0.5039 -0.0483 -0.1831 0.107   808  ASN   A CG  
1657 O  OD1 . ASN   A 118 ? 1.7897 0.3718 0.4903 -0.0546 -0.194  0.1112  808  ASN   A OD1 
1658 N  ND2 . ASN   A 118 ? 1.7109 0.4009 0.5125 -0.0018 -0.1665 0.0974  808  ASN   A ND2 
1665 N  N   . ILE   A 119 ? 1.3425 0.4578 0.5238 -0.0887 -0.1616 0.1158  809  ILE   A N   
1666 C  CA  . ILE   A 119 ? 1.2581 0.4916 0.5438 -0.1108 -0.1585 0.1179  809  ILE   A CA  
1667 C  C   . ILE   A 119 ? 1.2232 0.4978 0.5357 -0.1371 -0.1635 0.1262  809  ILE   A C   
1668 O  O   . ILE   A 119 ? 1.2251 0.5006 0.5389 -0.1123 -0.1551 0.1241  809  ILE   A O   
1669 C  CB  . ILE   A 119 ? 1.2101 0.523  0.5767 -0.0684 -0.1365 0.1074  809  ILE   A CB  
1670 C  CG1 . ILE   A 119 ? 1.2328 0.5205 0.5828 -0.0529 -0.133  0.1016  809  ILE   A CG1 
1671 C  CG2 . ILE   A 119 ? 1.1458 0.5718 0.6128 -0.0855 -0.1316 0.1087  809  ILE   A CG2 
1672 C  CD1 . ILE   A 119 ? 1.2212 0.5466 0.6106 -0.0039 -0.1117 0.0921  809  ILE   A CD1 
1684 N  N   . GLY   A 120 ? 1.1857 0.5004 0.5212 -0.1861 -0.1766 0.1366  810  GLY   A N   
1685 C  CA  . GLY   A 120 ? 1.1487 0.5141 0.5144 -0.2148 -0.1808 0.1461  810  GLY   A CA  
1686 C  C   . GLY   A 120 ? 1.058  0.5439 0.5313 -0.2029 -0.1653 0.1422  810  GLY   A C   
1687 O  O   . GLY   A 120 ? 1.0282 0.5579 0.5529 -0.1781 -0.1533 0.1333  810  GLY   A O   
1691 N  N   . SER   A 121 ? 1.0156 0.5514 0.5186 -0.2213 -0.1655 0.1492  811  SER   A N   
1692 C  CA  . SER   A 121 ? 0.9384 0.5808 0.5336 -0.2108 -0.1509 0.1455  811  SER   A CA  
1693 C  C   . SER   A 121 ? 0.8814 0.5962 0.5332 -0.2282 -0.1516 0.1498  811  SER   A C   
1694 O  O   . SER   A 121 ? 0.8359 0.6188 0.556  -0.2053 -0.1368 0.1418  811  SER   A O   
1695 C  CB  . SER   A 121 ? 0.9431 0.6146 0.5454 -0.2288 -0.152  0.1533  811  SER   A CB  
1696 O  OG  . SER   A 121 ? 0.99   0.6462 0.5543 -0.2786 -0.17   0.1701  811  SER   A OG  
1702 N  N   . GLN   A 122 ? 0.8804 0.5799 0.5008 -0.269  -0.1694 0.1632  812  GLN   A N   
1703 C  CA  . GLN   A 122 ? 0.8293 0.5997 0.4993 -0.2857 -0.1722 0.1705  812  GLN   A CA  
1704 C  C   . GLN   A 122 ? 0.8074 0.5768 0.5007 -0.2532 -0.1628 0.1585  812  GLN   A C   
1705 O  O   . GLN   A 122 ? 0.7599 0.6038 0.5201 -0.2404 -0.1527 0.1566  812  GLN   A O   
1706 C  CB  . GLN   A 122 ? 0.8707 0.6168 0.4914 -0.3388 -0.1961 0.1886  812  GLN   A CB  
1707 C  CG  . GLN   A 122 ? 0.8608 0.6937 0.5336 -0.3609 -0.2014 0.2013  812  GLN   A CG  
1708 C  CD  . GLN   A 122 ? 0.8515 0.7922 0.5942 -0.3654 -0.1924 0.2098  812  GLN   A CD  
1709 O  OE1 . GLN   A 122 ? 0.867  0.8344 0.5988 -0.4047 -0.2031 0.2265  812  GLN   A OE1 
1710 N  NE2 . GLN   A 122 ? 0.811  0.8148 0.6234 -0.3261 -0.1723 0.1992  812  GLN   A NE2 
1719 N  N   . TYR   A 123 ? 0.8412 0.5248 0.4765 -0.2381 -0.1654 0.1507  813  TYR   A N   
1720 C  CA  . TYR   A 123 ? 0.8289 0.5076 0.4803 -0.2077 -0.1561 0.14    813  TYR   A CA  
1721 C  C   . TYR   A 123 ? 0.7728 0.5002 0.4856 -0.1662 -0.134  0.1266  813  TYR   A C   
1722 O  O   . TYR   A 123 ? 0.7444 0.5158 0.5052 -0.1516 -0.1252 0.1223  813  TYR   A O   
1723 C  CB  . TYR   A 123 ? 0.8963 0.4703 0.4654 -0.1971 -0.1618 0.1347  813  TYR   A CB  
1724 C  CG  . TYR   A 123 ? 0.9517 0.4712 0.4579 -0.2359 -0.1835 0.1451  813  TYR   A CG  
1725 C  CD1 . TYR   A 123 ? 0.9613 0.4863 0.473  -0.2389 -0.1874 0.1455  813  TYR   A CD1 
1726 C  CD2 . TYR   A 123 ? 1.0117 0.4679 0.4462 -0.2709 -0.2011 0.1547  813  TYR   A CD2 
1727 C  CE1 . TYR   A 123 ? 1.0131 0.4865 0.4628 -0.2767 -0.2087 0.1551  813  TYR   A CE1 
1728 C  CE2 . TYR   A 123 ? 1.0656 0.4662 0.435  -0.3114 -0.2229 0.1645  813  TYR   A CE2 
1729 C  CZ  . TYR   A 123 ? 1.0727 0.4832 0.4502 -0.3143 -0.2269 0.1644  813  TYR   A CZ  
1730 O  OH  . TYR   A 123 ? 1.1381 0.494  0.4487 -0.3565 -0.2499 0.1741  813  TYR   A OH  
1740 N  N   . LEU   A 124 ? 0.7575 0.4743 0.4651 -0.1485 -0.1259 0.1208  814  LEU   A N   
1741 C  CA  . LEU   A 124 ? 0.7114 0.4728 0.4715 -0.114  -0.107  0.109   814  LEU   A CA  
1742 C  C   . LEU   A 124 ? 0.6447 0.4929 0.4771 -0.119  -0.0994 0.1095  814  LEU   A C   
1743 O  O   . LEU   A 124 ? 0.6192 0.5024 0.4955 -0.0974 -0.0867 0.1009  814  LEU   A O   
1744 C  CB  . LEU   A 124 ? 0.7266 0.4641 0.4643 -0.0976 -0.1024 0.1053  814  LEU   A CB  
1745 C  CG  . LEU   A 124 ? 0.7885 0.4472 0.4625 -0.0732 -0.1026 0.1015  814  LEU   A CG  
1746 C  CD1 . LEU   A 124 ? 0.8173 0.4425 0.4534 -0.0671 -0.1045 0.1039  814  LEU   A CD1 
1747 C  CD2 . LEU   A 124 ? 0.7806 0.4576 0.4824 -0.0361 -0.0872 0.091   814  LEU   A CD2 
1759 N  N   . LEU   A 125 ? 0.6167 0.498  0.458  -0.1469 -0.1066 0.1201  815  LEU   A N   
1760 C  CA  . LEU   A 125 ? 0.5605 0.5238 0.4651 -0.1479 -0.0982 0.1215  815  LEU   A CA  
1761 C  C   . LEU   A 125 ? 0.5307 0.5255 0.4618 -0.1522 -0.1004 0.1265  815  LEU   A C   
1762 O  O   . LEU   A 125 ? 0.5003 0.5427 0.4804 -0.1335 -0.088  0.1209  815  LEU   A O   
1763 C  CB  . LEU   A 125 ? 0.5514 0.5472 0.4572 -0.174  -0.1035 0.1327  815  LEU   A CB  
1764 C  CG  . LEU   A 125 ? 0.5791 0.5591 0.4705 -0.1661 -0.0984 0.1274  815  LEU   A CG  
1765 C  CD1 . LEU   A 125 ? 0.5929 0.5771 0.4599 -0.1998 -0.1093 0.1418  815  LEU   A CD1 
1766 C  CD2 . LEU   A 125 ? 0.551  0.5834 0.4947 -0.1404 -0.0806 0.1156  815  LEU   A CD2 
1778 N  N   . ASN   A 126 ? 0.5404 0.5037 0.435  -0.1758 -0.1164 0.1367  816  ASN   A N   
1779 C  CA  . ASN   A 126 ? 0.5161 0.5086 0.4332 -0.1792 -0.1199 0.1426  816  ASN   A CA  
1780 C  C   . ASN   A 126 ? 0.5008 0.4762 0.4317 -0.1461 -0.1079 0.1291  816  ASN   A C   
1781 O  O   . ASN   A 126 ? 0.4738 0.4933 0.4463 -0.1349 -0.1016 0.1295  816  ASN   A O   
1782 C  CB  . ASN   A 126 ? 0.5646 0.5212 0.4326 -0.2139 -0.1413 0.1561  816  ASN   A CB  
1783 C  CG  . ASN   A 126 ? 0.6014 0.5984 0.4677 -0.254  -0.155  0.1746  816  ASN   A CG  
1784 O  OD1 . ASN   A 126 ? 0.5924 0.6385 0.4879 -0.2559 -0.1483 0.1776  816  ASN   A OD1 
1785 N  ND2 . ASN   A 126 ? 0.6311 0.6092 0.46   -0.2895 -0.1751 0.1884  816  ASN   A ND2 
1792 N  N   . TRP   A 127 ? 0.5146 0.4288 0.4102 -0.1292 -0.1042 0.1184  817  TRP   A N   
1793 C  CA  . TRP   A 127 ? 0.5023 0.4059 0.4111 -0.0999 -0.0921 0.1071  817  TRP   A CA  
1794 C  C   . TRP   A 127 ? 0.4535 0.41   0.4186 -0.0794 -0.0754 0.0985  817  TRP   A C   
1795 O  O   . TRP   A 127 ? 0.4393 0.414  0.432  -0.0657 -0.0678 0.0949  817  TRP   A O   
1796 C  CB  . TRP   A 127 ? 0.5384 0.3765 0.3995 -0.0835 -0.0899 0.0991  817  TRP   A CB  
1797 C  CG  . TRP   A 127 ? 0.5895 0.359  0.3841 -0.0975 -0.1044 0.1046  817  TRP   A CG  
1798 C  CD1 . TRP   A 127 ? 0.6093 0.3687 0.3879 -0.1175 -0.1168 0.1127  817  TRP   A CD1 
1799 C  CD2 . TRP   A 127 ? 0.636  0.3323 0.366  -0.0892 -0.1074 0.1017  817  TRP   A CD2 
1800 N  NE1 . TRP   A 127 ? 0.664  0.3442 0.3683 -0.1263 -0.1283 0.1143  817  TRP   A NE1 
1801 C  CE2 . TRP   A 127 ? 0.6852 0.3224 0.3566 -0.1071 -0.1221 0.1074  817  TRP   A CE2 
1802 C  CE3 . TRP   A 127 ? 0.6553 0.3292 0.368  -0.0666 -0.0992 0.0954  817  TRP   A CE3 
1803 C  CZ2 . TRP   A 127 ? 0.7477 0.2966 0.339  -0.1022 -0.128  0.1059  817  TRP   A CZ2 
1804 C  CZ3 . TRP   A 127 ? 0.7168 0.3094 0.3545 -0.0587 -0.1046 0.0953  817  TRP   A CZ3 
1805 C  CH2 . TRP   A 127 ? 0.7608 0.288  0.3363 -0.0756 -0.1184 0.0998  817  TRP   A CH2 
1816 N  N   . CYS   A 128 ? 0.4296 0.4072 0.4072 -0.0788 -0.0703 0.0957  818  CYS   A N   
1817 C  CA  . CYS   A 128 ? 0.3937 0.416  0.4167 -0.0627 -0.0557 0.0873  818  CYS   A CA  
1818 C  C   . CYS   A 128 ? 0.361  0.4335 0.4214 -0.0652 -0.0536 0.093   818  CYS   A C   
1819 O  O   . CYS   A 128 ? 0.3488 0.439  0.4374 -0.0475 -0.0422 0.0857  818  CYS   A O   
1820 C  CB  . CYS   A 128 ? 0.3938 0.4268 0.4163 -0.0647 -0.0529 0.0847  818  CYS   A CB  
1821 S  SG  . CYS   A 128 ? 0.4512 0.4312 0.4317 -0.0538 -0.0536 0.079   818  CYS   A SG  
1827 N  N   . VAL   A 129 ? 0.3471 0.4426 0.4052 -0.0869 -0.0647 0.1071  819  VAL   A N   
1828 C  CA  . VAL   A 129 ? 0.3158 0.4675 0.4087 -0.0871 -0.0635 0.1163  819  VAL   A CA  
1829 C  C   . VAL   A 129 ? 0.3165 0.4569 0.4145 -0.0755 -0.0635 0.1162  819  VAL   A C   
1830 O  O   . VAL   A 129 ? 0.2978 0.4657 0.4261 -0.0562 -0.0532 0.1136  819  VAL   A O   
1831 C  CB  . VAL   A 129 ? 0.3146 0.498  0.4005 -0.1177 -0.078  0.135   819  VAL   A CB  
1832 C  CG1 . VAL   A 129 ? 0.2869 0.5326 0.407  -0.116  -0.0787 0.1479  819  VAL   A CG1 
1833 C  CG2 . VAL   A 129 ? 0.3123 0.5167 0.3984 -0.1287 -0.0762 0.1367  819  VAL   A CG2 
1843 N  N   . GLN   A 130 ? 0.34   0.4351 0.403  -0.0866 -0.0749 0.1191  820  GLN   A N   
1844 C  CA  . GLN   A 130 ? 0.3478 0.4292 0.4092 -0.0792 -0.0769 0.1207  820  GLN   A CA  
1845 C  C   . GLN   A 130 ? 0.3509 0.4148 0.425  -0.0522 -0.0617 0.1067  820  GLN   A C   
1846 O  O   . GLN   A 130 ? 0.3433 0.4213 0.4368 -0.0398 -0.0573 0.1081  820  GLN   A O   
1847 C  CB  . GLN   A 130 ? 0.3967 0.4263 0.4087 -0.0983 -0.0925 0.1259  820  GLN   A CB  
1848 C  CG  . GLN   A 130 ? 0.4263 0.4735 0.4224 -0.132  -0.111  0.1429  820  GLN   A CG  
1849 C  CD  . GLN   A 130 ? 0.5197 0.4996 0.453  -0.1535 -0.1267 0.1455  820  GLN   A CD  
1850 O  OE1 . GLN   A 130 ? 0.5664 0.4934 0.4712 -0.1407 -0.1247 0.1372  820  GLN   A OE1 
1851 N  NE2 . GLN   A 130 ? 0.5351 0.5131 0.4409 -0.1876 -0.1428 0.1577  820  GLN   A NE2 
1860 N  N   . ILE   A 131 ? 0.358  0.3949 0.4213 -0.0435 -0.0539 0.0946  821  ILE   A N   
1861 C  CA  . ILE   A 131 ? 0.3575 0.3842 0.4328 -0.0232 -0.0403 0.0828  821  ILE   A CA  
1862 C  C   . ILE   A 131 ? 0.3336 0.3984 0.4456 -0.012  -0.0293 0.0791  821  ILE   A C   
1863 O  O   . ILE   A 131 ? 0.3352 0.3973 0.4585 0.0004  -0.0221 0.076   821  ILE   A O   
1864 C  CB  . ILE   A 131 ? 0.3785 0.3771 0.4342 -0.0171 -0.0355 0.0735  821  ILE   A CB  
1865 C  CG1 . ILE   A 131 ? 0.4194 0.3708 0.4311 -0.0203 -0.044  0.0765  821  ILE   A CG1 
1866 C  CG2 . ILE   A 131 ? 0.3767 0.3794 0.4504 -0.0014 -0.0217 0.0631  821  ILE   A CG2 
1867 C  CD1 . ILE   A 131 ? 0.4546 0.3796 0.4378 -0.0154 -0.0435 0.0723  821  ILE   A CD1 
1879 N  N   . ALA   A 132 ? 0.3135 0.41   0.439  -0.0162 -0.0282 0.0804  822  ALA   A N   
1880 C  CA  . ALA   A 132 ? 0.2973 0.4259 0.4503 -0.0029 -0.0171 0.0768  822  ALA   A CA  
1881 C  C   . ALA   A 132 ? 0.2877 0.4412 0.4565 0.005   -0.0182 0.0872  822  ALA   A C   
1882 O  O   . ALA   A 132 ? 0.2838 0.4409 0.4652 0.0237  -0.0075 0.0824  822  ALA   A O   
1883 C  CB  . ALA   A 132 ? 0.2852 0.4439 0.4456 -0.0091 -0.0156 0.0772  822  ALA   A CB  
1889 N  N   . LYS   A 133 ? 0.2838 0.4526 0.4483 -0.0091 -0.0315 0.102   823  LYS   A N   
1890 C  CA  . LYS   A 133 ? 0.275  0.4737 0.4547 -0.0016 -0.0344 0.1146  823  LYS   A CA  
1891 C  C   . LYS   A 133 ? 0.2946 0.4569 0.4672 0.0119  -0.0312 0.1102  823  LYS   A C   
1892 O  O   . LYS   A 133 ? 0.29   0.4643 0.4765 0.0317  -0.0244 0.1125  823  LYS   A O   
1893 C  CB  . LYS   A 133 ? 0.291  0.5137 0.4634 -0.0261 -0.0523 0.1325  823  LYS   A CB  
1894 C  CG  . LYS   A 133 ? 0.3075 0.5853 0.4937 -0.0398 -0.0559 0.1435  823  LYS   A CG  
1895 C  CD  . LYS   A 133 ? 0.3516 0.6504 0.526  -0.0702 -0.0758 0.1626  823  LYS   A CD  
1896 C  CE  . LYS   A 133 ? 0.3744 0.7325 0.5612 -0.0895 -0.0806 0.1762  823  LYS   A CE  
1897 N  NZ  . LYS   A 133 ? 0.4026 0.7771 0.5717 -0.1267 -0.1025 0.1956  823  LYS   A NZ  
1911 N  N   . GLY   A 134 ? 0.3157 0.4329 0.4639 0.0028  -0.0354 0.1047  824  GLY   A N   
1912 C  CA  . GLY   A 134 ? 0.3352 0.4183 0.4742 0.0129  -0.0319 0.101   824  GLY   A CA  
1913 C  C   . GLY   A 134 ? 0.3365 0.4059 0.4843 0.0302  -0.0163 0.0885  824  GLY   A C   
1914 O  O   . GLY   A 134 ? 0.3433 0.4017 0.493  0.0432  -0.0116 0.0896  824  GLY   A O   
1918 N  N   . MET   A 135 ? 0.3331 0.4008 0.4826 0.0288  -0.0092 0.0774  825  MET   A N   
1919 C  CA  . MET   A 135 ? 0.3389 0.392  0.4917 0.0393  0.0038  0.0652  825  MET   A CA  
1920 C  C   . MET   A 135 ? 0.3349 0.4048 0.5004 0.0561  0.0112  0.0659  825  MET   A C   
1921 O  O   . MET   A 135 ? 0.3436 0.3882 0.5028 0.0674  0.0196  0.0602  825  MET   A O   
1922 C  CB  . MET   A 135 ? 0.3476 0.3998 0.4979 0.0318  0.0075  0.0546  825  MET   A CB  
1923 C  CG  . MET   A 135 ? 0.3788 0.4109 0.5135 0.0232  0.0042  0.0524  825  MET   A CG  
1924 S  SD  . MET   A 135 ? 0.4186 0.4205 0.5423 0.0261  0.0088  0.0509  825  MET   A SD  
1925 C  CE  . MET   A 135 ? 0.3953 0.3937 0.5254 0.0274  0.0205  0.0394  825  MET   A CE  
1935 N  N   . ASN   A 136 ? 0.3189 0.43   0.4986 0.0584  0.0084  0.0739  826  ASN   A N   
1936 C  CA  . ASN   A 136 ? 0.3168 0.4498 0.5074 0.0802  0.0168  0.0766  826  ASN   A CA  
1937 C  C   . ASN   A 136 ? 0.325  0.4506 0.5145 0.0957  0.0156  0.0862  826  ASN   A C   
1938 O  O   . ASN   A 136 ? 0.334  0.4442 0.5182 0.1185  0.0257  0.083   826  ASN   A O   
1939 C  CB  . ASN   A 136 ? 0.3054 0.4951 0.5137 0.0782  0.0137  0.0866  826  ASN   A CB  
1940 C  CG  . ASN   A 136 ? 0.3289 0.5483 0.5482 0.1058  0.0245  0.0902  826  ASN   A CG  
1941 O  OD1 . ASN   A 136 ? 0.3561 0.5524 0.5657 0.1218  0.0376  0.0774  826  ASN   A OD1 
1942 N  ND2 . ASN   A 136 ? 0.3111 0.5821 0.5476 0.1129  0.0194  0.1083  826  ASN   A ND2 
1949 N  N   . TYR   A 137 ? 0.3282 0.4589 0.5171 0.0842  0.003   0.0978  827  TYR   A N   
1950 C  CA  . TYR   A 137 ? 0.3429 0.4658 0.5288 0.0971  0.0003  0.1079  827  TYR   A CA  
1951 C  C   . TYR   A 137 ? 0.3754 0.4399 0.5415 0.1045  0.0088  0.0969  827  TYR   A C   
1952 O  O   . TYR   A 137 ? 0.3855 0.4343 0.5455 0.1261  0.015   0.0993  827  TYR   A O   
1953 C  CB  . TYR   A 137 ? 0.3443 0.4773 0.5269 0.0778  -0.0162 0.1206  827  TYR   A CB  
1954 C  CG  . TYR   A 137 ? 0.3656 0.4837 0.5409 0.0885  -0.0198 0.13    827  TYR   A CG  
1955 C  CD1 . TYR   A 137 ? 0.3993 0.4694 0.5535 0.0806  -0.0212 0.125   827  TYR   A CD1 
1956 C  CD2 . TYR   A 137 ? 0.364  0.5174 0.5528 0.1097  -0.0203 0.1442  827  TYR   A CD2 
1957 C  CE1 . TYR   A 137 ? 0.4203 0.4744 0.5654 0.0902  -0.0241 0.1338  827  TYR   A CE1 
1958 C  CE2 . TYR   A 137 ? 0.3835 0.5215 0.5637 0.1216  -0.0237 0.1534  827  TYR   A CE2 
1959 C  CZ  . TYR   A 137 ? 0.4194 0.5055 0.5769 0.1105  -0.0259 0.1479  827  TYR   A CZ  
1960 O  OH  . TYR   A 137 ? 0.4503 0.5196 0.597  0.1215  -0.0292 0.1576  827  TYR   A OH  
1970 N  N   . LEU   A 138 ? 0.3899 0.4237 0.544  0.0867  0.0092  0.0861  828  LEU   A N   
1971 C  CA  . LEU   A 138 ? 0.4178 0.4034 0.5537 0.0867  0.0164  0.0772  828  LEU   A CA  
1972 C  C   . LEU   A 138 ? 0.4352 0.3998 0.5634 0.0994  0.0289  0.0665  828  LEU   A C   
1973 O  O   . LEU   A 138 ? 0.4563 0.3803 0.5657 0.1066  0.0343  0.0644  828  LEU   A O   
1974 C  CB  . LEU   A 138 ? 0.4248 0.3972 0.5533 0.066   0.0147  0.0699  828  LEU   A CB  
1975 C  CG  . LEU   A 138 ? 0.4409 0.416  0.5634 0.0548  0.0038  0.0781  828  LEU   A CG  
1976 C  CD1 . LEU   A 138 ? 0.4542 0.4196 0.5678 0.0418  0.0049  0.0704  828  LEU   A CD1 
1977 C  CD2 . LEU   A 138 ? 0.4584 0.4118 0.5691 0.0594  0.0013  0.0865  828  LEU   A CD2 
1989 N  N   . GLU   A 139 ? 0.4299 0.4172 0.5673 0.1015  0.0331  0.0601  829  GLU   A N   
1990 C  CA  . GLU   A 139 ? 0.4522 0.4167 0.5763 0.1145  0.0447  0.0493  829  GLU   A CA  
1991 C  C   . GLU   A 139 ? 0.4703 0.4278 0.5872 0.1453  0.0499  0.0569  829  GLU   A C   
1992 O  O   . GLU   A 139 ? 0.4991 0.4064 0.5882 0.157   0.0582  0.0501  829  GLU   A O   
1993 C  CB  . GLU   A 139 ? 0.462  0.4583 0.5976 0.1111  0.0475  0.0425  829  GLU   A CB  
1994 C  CG  . GLU   A 139 ? 0.5333 0.5029 0.6494 0.1237  0.0595  0.0299  829  GLU   A CG  
1995 C  CD  . GLU   A 139 ? 0.5965 0.5908 0.719  0.1164  0.0625  0.0213  829  GLU   A CD  
1996 O  OE1 . GLU   A 139 ? 0.5886 0.6253 0.7329 0.1039  0.0553  0.0268  829  GLU   A OE1 
1997 O  OE2 . GLU   A 139 ? 0.6382 0.6046 0.7391 0.1226  0.0716  0.0091  829  GLU   A OE2 
2004 N  N   . ASP   A 140 ? 0.4496 0.4563 0.5881 0.158   0.0444  0.0721  830  ASP   A N   
2005 C  CA  . ASP   A 140 ? 0.4588 0.4709 0.5942 0.1912  0.0487  0.0829  830  ASP   A CA  
2006 C  C   . ASP   A 140 ? 0.4886 0.4506 0.6018 0.1972  0.0473  0.087   830  ASP   A C   
2007 O  O   . ASP   A 140 ? 0.5072 0.4398 0.5999 0.2262  0.055   0.089   830  ASP   A O   
2008 C  CB  . ASP   A 140 ? 0.448  0.5354 0.615  0.1973  0.0404  0.1017  830  ASP   A CB  
2009 C  CG  . ASP   A 140 ? 0.4869 0.6296 0.6739 0.1992  0.044   0.1019  830  ASP   A CG  
2010 O  OD1 . ASP   A 140 ? 0.5093 0.6303 0.684  0.2035  0.0551  0.0869  830  ASP   A OD1 
2011 O  OD2 . ASP   A 140 ? 0.4863 0.6945 0.6991 0.1939  0.0353  0.1178  830  ASP   A OD2 
2016 N  N   . ARG   A 141 ? 0.4949 0.4437 0.6076 0.1716  0.0382  0.0883  831  ARG   A N   
2017 C  CA  . ARG   A 141 ? 0.5243 0.4263 0.6149 0.1732  0.0367  0.0926  831  ARG   A CA  
2018 C  C   . ARG   A 141 ? 0.5555 0.3926 0.6155 0.1591  0.0442  0.0779  831  ARG   A C   
2019 O  O   . ARG   A 141 ? 0.5758 0.3785 0.6194 0.1483  0.0418  0.0805  831  ARG   A O   
2020 C  CB  . ARG   A 141 ? 0.5347 0.4566 0.6365 0.1536  0.0237  0.1027  831  ARG   A CB  
2021 C  CG  . ARG   A 141 ? 0.5508 0.5359 0.6786 0.1568  0.0125  0.1185  831  ARG   A CG  
2022 C  CD  . ARG   A 141 ? 0.5865 0.5993 0.7213 0.1893  0.0132  0.1333  831  ARG   A CD  
2023 N  NE  . ARG   A 141 ? 0.6561 0.6182 0.7646 0.2111  0.0186  0.1362  831  ARG   A NE  
2024 C  CZ  . ARG   A 141 ? 0.6983 0.6389 0.7946 0.207   0.0112  0.1453  831  ARG   A CZ  
2025 N  NH1 . ARG   A 141 ? 0.723  0.6134 0.7918 0.2278  0.0168  0.1482  831  ARG   A NH1 
2026 N  NH2 . ARG   A 141 ? 0.6842 0.6478 0.7904 0.1823  -0.0018 0.1516  831  ARG   A NH2 
2040 N  N   . ARG   A 142 ? 0.5567 0.379  0.6073 0.1573  0.0526  0.0636  832  ARG   A N   
2041 C  CA  . ARG   A 142 ? 0.584  0.3501 0.6043 0.1393  0.0583  0.0501  832  ARG   A CA  
2042 C  C   . ARG   A 142 ? 0.5742 0.3409 0.5992 0.1064  0.0526  0.0494  832  ARG   A C   
2043 O  O   . ARG   A 142 ? 0.602  0.3232 0.6008 0.0931  0.0546  0.0475  832  ARG   A O   
2044 C  CB  . ARG   A 142 ? 0.6414 0.3385 0.6189 0.1573  0.0646  0.0506  832  ARG   A CB  
2045 C  CG  . ARG   A 142 ? 0.6872 0.3827 0.6558 0.1982  0.0718  0.0534  832  ARG   A CG  
2046 C  CD  . ARG   A 142 ? 0.775  0.3854 0.688  0.2164  0.0801  0.0493  832  ARG   A CD  
2047 N  NE  . ARG   A 142 ? 0.8429 0.3991 0.7202 0.1953  0.0856  0.0315  832  ARG   A NE  
2048 C  CZ  . ARG   A 142 ? 0.8765 0.43   0.7435 0.2041  0.0931  0.0192  832  ARG   A CZ  
2049 N  NH1 . ARG   A 142 ? 0.8465 0.4529 0.7388 0.2354  0.0975  0.023   832  ARG   A NH1 
2050 N  NH2 . ARG   A 142 ? 0.9068 0.4079 0.7373 0.1796  0.0958  0.0037  832  ARG   A NH2 
2064 N  N   . LEU   A 143 ? 0.5344 0.3514 0.5891 0.094   0.0461  0.0515  833  LEU   A N   
2065 C  CA  . LEU   A 143 ? 0.5239 0.3466 0.5821 0.0697  0.0422  0.0518  833  LEU   A CA  
2066 C  C   . LEU   A 143 ? 0.4973 0.3464 0.5681 0.0534  0.0429  0.042   833  LEU   A C   
2067 O  O   . LEU   A 143 ? 0.4771 0.3618 0.5668 0.0581  0.04    0.0416  833  LEU   A O   
2068 C  CB  . LEU   A 143 ? 0.5147 0.3645 0.5872 0.0727  0.033   0.0644  833  LEU   A CB  
2069 C  CG  . LEU   A 143 ? 0.5361 0.3875 0.6059 0.0556  0.0293  0.0676  833  LEU   A CG  
2070 C  CD1 . LEU   A 143 ? 0.5322 0.4124 0.6141 0.043   0.0281  0.0614  833  LEU   A CD1 
2071 C  CD2 . LEU   A 143 ? 0.5643 0.3785 0.6125 0.0452  0.0347  0.0671  833  LEU   A CD2 
2083 N  N   . VAL   A 144 ? 0.4938 0.3281 0.5532 0.0331  0.0461  0.0357  834  VAL   A N   
2084 C  CA  . VAL   A 144 ? 0.4737 0.3364 0.5442 0.0178  0.0463  0.0283  834  VAL   A CA  
2085 C  C   . VAL   A 144 ? 0.4512 0.3357 0.53   0.0092  0.0429  0.035   834  VAL   A C   
2086 O  O   . VAL   A 144 ? 0.4618 0.3308 0.5289 -0.0005 0.0449  0.039   834  VAL   A O   
2087 C  CB  . VAL   A 144 ? 0.4991 0.3387 0.5509 0.0001  0.0512  0.0187  834  VAL   A CB  
2088 C  CG1 . VAL   A 144 ? 0.4907 0.368  0.5564 -0.0146 0.0502  0.0131  834  VAL   A CG1 
2089 C  CG2 . VAL   A 144 ? 0.5235 0.328  0.5558 0.0123  0.0557  0.0114  834  VAL   A CG2 
2099 N  N   . HIS   A 145 ? 0.422  0.3385 0.5163 0.0136  0.0383  0.0367  835  HIS   A N   
2100 C  CA  . HIS   A 145 ? 0.4103 0.341  0.505  0.0112  0.0356  0.0426  835  HIS   A CA  
2101 C  C   . HIS   A 145 ? 0.4026 0.3481 0.4961 -0.0022 0.0406  0.0403  835  HIS   A C   
2102 O  O   . HIS   A 145 ? 0.4051 0.3516 0.4919 -0.0047 0.0425  0.0464  835  HIS   A O   
2103 C  CB  . HIS   A 145 ? 0.4018 0.3534 0.5043 0.0181  0.029   0.044   835  HIS   A CB  
2104 C  CG  . HIS   A 145 ? 0.4165 0.3675 0.5087 0.0208  0.0251  0.0506  835  HIS   A CG  
2105 N  ND1 . HIS   A 145 ? 0.4316 0.3952 0.519  0.0197  0.0282  0.0497  835  HIS   A ND1 
2106 C  CD2 . HIS   A 145 ? 0.4343 0.3727 0.5166 0.0255  0.0183  0.0582  835  HIS   A CD2 
2107 C  CE1 . HIS   A 145 ? 0.4462 0.3982 0.5171 0.0261  0.0244  0.0556  835  HIS   A CE1 
2108 N  NE2 . HIS   A 145 ? 0.4523 0.3875 0.5187 0.0273  0.0176  0.0605  835  HIS   A NE2 
2116 N  N   . ARG   A 146 ? 0.3895 0.3524 0.4898 -0.0101 0.0424  0.0331  836  ARG   A N   
2117 C  CA  . ARG   A 146 ? 0.3808 0.3686 0.4828 -0.0249 0.0462  0.0326  836  ARG   A CA  
2118 C  C   . ARG   A 146 ? 0.3691 0.3888 0.4761 -0.0164 0.0462  0.0384  836  ARG   A C   
2119 O  O   . ARG   A 146 ? 0.3586 0.4091 0.4697 -0.025  0.0499  0.0407  836  ARG   A O   
2120 C  CB  . ARG   A 146 ? 0.4021 0.3709 0.4911 -0.0419 0.0502  0.0352  836  ARG   A CB  
2121 C  CG  . ARG   A 146 ? 0.4481 0.3778 0.522  -0.051  0.0509  0.0282  836  ARG   A CG  
2122 C  CD  . ARG   A 146 ? 0.4915 0.3962 0.5452 -0.0716 0.0538  0.0321  836  ARG   A CD  
2123 N  NE  . ARG   A 146 ? 0.5013 0.4433 0.5593 -0.0954 0.0552  0.0348  836  ARG   A NE  
2124 C  CZ  . ARG   A 146 ? 0.5125 0.4762 0.571  -0.1061 0.0581  0.045   836  ARG   A CZ  
2125 N  NH1 . ARG   A 146 ? 0.5128 0.4557 0.5638 -0.0966 0.0598  0.0523  836  ARG   A NH1 
2126 N  NH2 . ARG   A 146 ? 0.4917 0.5022 0.5583 -0.1264 0.0593  0.0491  836  ARG   A NH2 
2140 N  N   . ASP   A 147 ? 0.3686 0.3814 0.4723 -0.0001 0.042   0.0412  837  ASP   A N   
2141 C  CA  . ASP   A 147 ? 0.3672 0.3975 0.465  0.0117  0.0426  0.046   837  ASP   A CA  
2142 C  C   . ASP   A 147 ? 0.3746 0.3916 0.4645 0.0241  0.0351  0.0456  837  ASP   A C   
2143 O  O   . ASP   A 147 ? 0.3889 0.3921 0.4604 0.0352  0.0331  0.0502  837  ASP   A O   
2144 C  CB  . ASP   A 147 ? 0.3938 0.4182 0.479  0.0156  0.0469  0.0536  837  ASP   A CB  
2145 C  CG  . ASP   A 147 ? 0.4442 0.4945 0.5218 0.0291  0.0519  0.0586  837  ASP   A CG  
2146 O  OD1 . ASP   A 147 ? 0.4398 0.5159 0.5235 0.0349  0.0519  0.0568  837  ASP   A OD1 
2147 O  OD2 . ASP   A 147 ? 0.481  0.5257 0.5444 0.0363  0.0562  0.0648  837  ASP   A OD2 
2152 N  N   . LEU   A 148 ? 0.3631 0.382  0.4624 0.0207  0.031   0.0404  838  LEU   A N   
2153 C  CA  . LEU   A 148 ? 0.3686 0.3776 0.4595 0.0269  0.0232  0.0415  838  LEU   A CA  
2154 C  C   . LEU   A 148 ? 0.368  0.3891 0.4489 0.0356  0.0231  0.042   838  LEU   A C   
2155 O  O   . LEU   A 148 ? 0.3556 0.403  0.4483 0.0333  0.0262  0.0385  838  LEU   A O   
2156 C  CB  . LEU   A 148 ? 0.3633 0.376  0.4678 0.021   0.0201  0.0375  838  LEU   A CB  
2157 C  CG  . LEU   A 148 ? 0.3831 0.393  0.4813 0.0217  0.0115  0.0403  838  LEU   A CG  
2158 C  CD1 . LEU   A 148 ? 0.4037 0.3896 0.4819 0.0231  0.0036  0.0483  838  LEU   A CD1 
2159 C  CD2 . LEU   A 148 ? 0.3815 0.4032 0.4961 0.0176  0.0113  0.0379  838  LEU   A CD2 
2171 N  N   . ALA   A 149 ? 0.3817 0.3805 0.4363 0.0464  0.0195  0.0467  839  ALA   A N   
2172 C  CA  . ALA   A 149 ? 0.3916 0.3903 0.4262 0.0607  0.0196  0.0484  839  ALA   A CA  
2173 C  C   . ALA   A 149 ? 0.4225 0.3759 0.4185 0.0669  0.0113  0.0522  839  ALA   A C   
2174 O  O   . ALA   A 149 ? 0.4336 0.3637 0.4205 0.0605  0.0069  0.0545  839  ALA   A O   
2175 C  CB  . ALA   A 149 ? 0.385  0.4073 0.4198 0.073   0.0296  0.0511  839  ALA   A CB  
2181 N  N   . ALA   A 150 ? 0.4365 0.3736 0.405  0.0782  0.0083  0.0534  840  ALA   A N   
2182 C  CA  . ALA   A 150 ? 0.4785 0.3614 0.3991 0.0812  -0.0008 0.0569  840  ALA   A CA  
2183 C  C   . ALA   A 150 ? 0.503  0.3576 0.3946 0.0932  0.0026  0.0593  840  ALA   A C   
2184 O  O   . ALA   A 150 ? 0.5278 0.3389 0.3872 0.0855  -0.0065 0.0616  840  ALA   A O   
2185 C  CB  . ALA   A 150 ? 0.4989 0.3629 0.3883 0.0949  -0.0031 0.0579  840  ALA   A CB  
2191 N  N   . ARG   A 151 ? 0.494  0.3767 0.3966 0.1098  0.0154  0.0596  841  ARG   A N   
2192 C  CA  . ARG   A 151 ? 0.5171 0.3812 0.3957 0.1219  0.0211  0.0623  841  ARG   A CA  
2193 C  C   . ARG   A 151 ? 0.5284 0.385  0.4199 0.102   0.0166  0.0629  841  ARG   A C   
2194 O  O   . ARG   A 151 ? 0.5524 0.3762 0.4123 0.1069  0.0159  0.0653  841  ARG   A O   
2195 C  CB  . ARG   A 151 ? 0.5073 0.419  0.4038 0.1401  0.0366  0.0646  841  ARG   A CB  
2196 C  CG  . ARG   A 151 ? 0.5024 0.4697 0.4532 0.1216  0.0417  0.0639  841  ARG   A CG  
2197 C  CD  . ARG   A 151 ? 0.5085 0.5281 0.4755 0.1333  0.0553  0.0687  841  ARG   A CD  
2198 N  NE  . ARG   A 151 ? 0.5009 0.5657 0.5126 0.1097  0.0575  0.0675  841  ARG   A NE  
2199 C  CZ  . ARG   A 151 ? 0.4962 0.5959 0.5339 0.1007  0.0561  0.0651  841  ARG   A CZ  
2200 N  NH1 . ARG   A 151 ? 0.4917 0.592  0.5196 0.1146  0.0528  0.0643  841  ARG   A NH1 
2201 N  NH2 . ARG   A 151 ? 0.4703 0.5994 0.5387 0.077   0.0574  0.0634  841  ARG   A NH2 
2215 N  N   . ASN   A 152 ? 0.5087 0.3941 0.443  0.0823  0.0141  0.0611  842  ASN   A N   
2216 C  CA  . ASN   A 152 ? 0.5144 0.3958 0.4625 0.0672  0.0101  0.0629  842  ASN   A CA  
2217 C  C   . ASN   A 152 ? 0.5228 0.3883 0.4691 0.0511  -0.0039 0.0645  842  ASN   A C   
2218 O  O   . ASN   A 152 ? 0.5119 0.3924 0.4844 0.0399  -0.0064 0.0659  842  ASN   A O   
2219 C  CB  . ASN   A 152 ? 0.5045 0.4248 0.4944 0.0599  0.0186  0.0611  842  ASN   A CB  
2220 C  CG  . ASN   A 152 ? 0.5377 0.4804 0.5295 0.07    0.0311  0.0624  842  ASN   A CG  
2221 O  OD1 . ASN   A 152 ? 0.5691 0.4963 0.5346 0.0819  0.0349  0.0662  842  ASN   A OD1 
2222 N  ND2 . ASN   A 152 ? 0.5216 0.5034 0.5422 0.0647  0.0378  0.0603  842  ASN   A ND2 
2229 N  N   . VAL   A 153 ? 0.5431 0.3781 0.4553 0.0504  -0.013  0.0657  843  VAL   A N   
2230 C  CA  . VAL   A 153 ? 0.5566 0.3779 0.4604 0.0314  -0.0279 0.07    843  VAL   A CA  
2231 C  C   . VAL   A 153 ? 0.6028 0.3675 0.4473 0.0309  -0.0371 0.0734  843  VAL   A C   
2232 O  O   . VAL   A 153 ? 0.6243 0.3578 0.4313 0.0467  -0.0334 0.0709  843  VAL   A O   
2233 C  CB  . VAL   A 153 ? 0.5536 0.3896 0.4678 0.0239  -0.0318 0.0688  843  VAL   A CB  
2234 C  CG1 . VAL   A 153 ? 0.5652 0.3931 0.4694 0.0011  -0.0474 0.0759  843  VAL   A CG1 
2235 C  CG2 . VAL   A 153 ? 0.5234 0.409  0.4885 0.0255  -0.0221 0.0639  843  VAL   A CG2 
2245 N  N   . LEU   A 154 ? 0.6172 0.3676 0.45   0.0148  -0.0485 0.0795  844  LEU   A N   
2246 C  CA  . LEU   A 154 ? 0.6692 0.361  0.4403 0.0096  -0.0592 0.0827  844  LEU   A CA  
2247 C  C   . LEU   A 154 ? 0.696  0.3687 0.4427 -0.0176 -0.0781 0.0891  844  LEU   A C   
2248 O  O   . LEU   A 154 ? 0.6684 0.3847 0.4549 -0.034  -0.0834 0.0938  844  LEU   A O   
2249 C  CB  . LEU   A 154 ? 0.6756 0.3628 0.4435 0.0089  -0.0598 0.0861  844  LEU   A CB  
2250 C  CG  . LEU   A 154 ? 0.6797 0.3875 0.4702 0.0306  -0.0419 0.0821  844  LEU   A CG  
2251 C  CD1 . LEU   A 154 ? 0.6846 0.3962 0.4815 0.0248  -0.0442 0.0874  844  LEU   A CD1 
2252 C  CD2 . LEU   A 154 ? 0.7111 0.3854 0.459  0.0549  -0.0313 0.0773  844  LEU   A CD2 
2264 N  N   . VAL   A 155 ? 0.7505 0.3561 0.4274 -0.0231 -0.0881 0.09    845  VAL   A N   
2265 C  CA  . VAL   A 155 ? 0.7876 0.3634 0.4272 -0.0541 -0.108  0.0971  845  VAL   A CA  
2266 C  C   . VAL   A 155 ? 0.8252 0.37   0.4268 -0.0757 -0.1237 0.1041  845  VAL   A C   
2267 O  O   . VAL   A 155 ? 0.8695 0.3496 0.4091 -0.0668 -0.1245 0.1004  845  VAL   A O   
2268 C  CB  . VAL   A 155 ? 0.8387 0.3501 0.4163 -0.0461 -0.109  0.0928  845  VAL   A CB  
2269 C  CG1 . VAL   A 155 ? 0.872  0.3498 0.4078 -0.0833 -0.1303 0.101   845  VAL   A CG1 
2270 C  CG2 . VAL   A 155 ? 0.8193 0.3664 0.4357 -0.0213 -0.0929 0.0864  845  VAL   A CG2 
2280 N  N   . LYS   A 156 ? 0.8058 0.3999 0.4443 -0.1018 -0.1355 0.1146  846  LYS   A N   
2281 C  CA  . LYS   A 156 ? 0.8367 0.4131 0.4439 -0.1272 -0.1535 0.1241  846  LYS   A CA  
2282 C  C   . LYS   A 156 ? 0.9001 0.4093 0.4307 -0.1578 -0.1732 0.1282  846  LYS   A C   
2283 O  O   . LYS   A 156 ? 0.9526 0.3902 0.4117 -0.1644 -0.1822 0.127   846  LYS   A O   
2284 C  CB  . LYS   A 156 ? 0.8114 0.4698 0.4831 -0.1439 -0.1603 0.1366  846  LYS   A CB  
2285 C  CG  . LYS   A 156 ? 0.8717 0.5264 0.5203 -0.1684 -0.1789 0.1485  846  LYS   A CG  
2286 C  CD  . LYS   A 156 ? 0.8762 0.6191 0.5884 -0.1818 -0.1858 0.1634  846  LYS   A CD  
2287 C  CE  . LYS   A 156 ? 0.9296 0.6782 0.6212 -0.2075 -0.2062 0.1778  846  LYS   A CE  
2288 N  NZ  . LYS   A 156 ? 0.9905 0.708  0.6251 -0.2527 -0.2312 0.1878  846  LYS   A NZ  
2302 N  N   . THR   A 157 ? 0.8947 0.4235 0.4363 -0.1771 -0.1796 0.1331  847  THR   A N   
2303 C  CA  . THR   A 157 ? 0.9502 0.4169 0.4215 -0.2087 -0.1976 0.1378  847  THR   A CA  
2304 C  C   . THR   A 157 ? 0.9428 0.423  0.4346 -0.1981 -0.1877 0.1336  847  THR   A C   
2305 O  O   . THR   A 157 ? 0.8944 0.4499 0.4633 -0.1794 -0.1729 0.1314  847  THR   A O   
2306 C  CB  . THR   A 157 ? 0.9603 0.4601 0.4318 -0.2597 -0.2224 0.1558  847  THR   A CB  
2307 O  OG1 . THR   A 157 ? 0.9124 0.521  0.4754 -0.2603 -0.2172 0.1642  847  THR   A OG1 
2308 C  CG2 . THR   A 157 ? 0.9857 0.4558 0.4165 -0.2774 -0.2373 0.1612  847  THR   A CG2 
2316 N  N   . PRO   A 158 ? 0.9879 0.3962 0.4114 -0.2097 -0.1958 0.1329  848  PRO   A N   
2317 C  CA  . PRO   A 158 ? 0.9739 0.4    0.4197 -0.1987 -0.1865 0.1301  848  PRO   A CA  
2318 C  C   . PRO   A 158 ? 0.9105 0.4403 0.4414 -0.2129 -0.1846 0.1382  848  PRO   A C   
2319 O  O   . PRO   A 158 ? 0.8845 0.4512 0.4593 -0.1895 -0.1692 0.132   848  PRO   A O   
2320 C  CB  . PRO   A 158 ? 1.0457 0.3783 0.3974 -0.2244 -0.2032 0.1339  848  PRO   A CB  
2321 C  CG  . PRO   A 158 ? 1.1086 0.352  0.3786 -0.2258 -0.2119 0.1307  848  PRO   A CG  
2322 C  CD  . PRO   A 158 ? 1.0542 0.3549 0.3708 -0.2321 -0.2136 0.1344  848  PRO   A CD  
2330 N  N   . GLN   A 159 ? 0.8831 0.4628 0.4369 -0.2487 -0.1995 0.1524  849  GLN   A N   
2331 C  CA  . GLN   A 159 ? 0.826  0.5067 0.456  -0.2602 -0.1975 0.162   849  GLN   A CA  
2332 C  C   . GLN   A 159 ? 0.7662 0.5264 0.4767 -0.2327 -0.1824 0.1595  849  GLN   A C   
2333 O  O   . GLN   A 159 ? 0.7212 0.5619 0.4922 -0.235  -0.1781 0.1662  849  GLN   A O   
2334 C  CB  . GLN   A 159 ? 0.8477 0.5517 0.4613 -0.3136 -0.2217 0.1822  849  GLN   A CB  
2335 C  CG  . GLN   A 159 ? 0.95   0.5799 0.4839 -0.3497 -0.2388 0.1877  849  GLN   A CG  
2336 C  CD  . GLN   A 159 ? 1.0852 0.6008 0.5214 -0.3603 -0.2522 0.1835  849  GLN   A CD  
2337 O  OE1 . GLN   A 159 ? 1.1147 0.6157 0.5415 -0.3528 -0.2541 0.1809  849  GLN   A OE1 
2338 N  NE2 . GLN   A 159 ? 1.1514 0.5776 0.5068 -0.3772 -0.2617 0.1829  849  GLN   A NE2 
2347 N  N   . HIS   A 160 ? 0.7649 0.5015 0.4728 -0.2068 -0.1743 0.1506  850  HIS   A N   
2348 C  CA  . HIS   A 160 ? 0.718  0.5176 0.4916 -0.1832 -0.1616 0.1492  850  HIS   A CA  
2349 C  C   . HIS   A 160 ? 0.7133 0.4849 0.4911 -0.1432 -0.142  0.1329  850  HIS   A C   
2350 O  O   . HIS   A 160 ? 0.7534 0.461  0.4799 -0.1363 -0.1433 0.1276  850  HIS   A O   
2351 C  CB  . HIS   A 160 ? 0.7315 0.5439 0.4986 -0.2029 -0.1768 0.1616  850  HIS   A CB  
2352 C  CG  . HIS   A 160 ? 0.7259 0.6054 0.5567 -0.183  -0.1675 0.1646  850  HIS   A CG  
2353 N  ND1 . HIS   A 160 ? 0.7105 0.668  0.5848 -0.1971 -0.1749 0.1807  850  HIS   A ND1 
2354 C  CD2 . HIS   A 160 ? 0.7362 0.6118 0.5874 -0.1508 -0.1521 0.155   850  HIS   A CD2 
2355 C  CE1 . HIS   A 160 ? 0.6913 0.6836 0.6083 -0.1697 -0.1634 0.1793  850  HIS   A CE1 
2356 N  NE2 . HIS   A 160 ? 0.7106 0.6534 0.6144 -0.1439 -0.15   0.164   850  HIS   A NE2 
2364 N  N   . VAL   A 161 ? 0.6616 0.4825 0.498  -0.1182 -0.1241 0.126   851  VAL   A N   
2365 C  CA  . VAL   A 161 ? 0.6518 0.4594 0.499  -0.0849 -0.1057 0.1127  851  VAL   A CA  
2366 C  C   . VAL   A 161 ? 0.6021 0.4587 0.5033 -0.0698 -0.0953 0.1124  851  VAL   A C   
2367 O  O   . VAL   A 161 ? 0.5707 0.4796 0.5106 -0.0766 -0.0976 0.12    851  VAL   A O   
2368 C  CB  . VAL   A 161 ? 0.6608 0.4627 0.5112 -0.0687 -0.0937 0.1026  851  VAL   A CB  
2369 C  CG1 . VAL   A 161 ? 0.7089 0.4489 0.4959 -0.0777 -0.1029 0.1027  851  VAL   A CG1 
2370 C  CG2 . VAL   A 161 ? 0.628  0.4905 0.5309 -0.0704 -0.0879 0.103   851  VAL   A CG2 
2380 N  N   . LYS   A 162 ? 0.596  0.4342 0.4958 -0.0484 -0.0835 0.1046  852  LYS   A N   
2381 C  CA  . LYS   A 162 ? 0.566  0.4352 0.5053 -0.0345 -0.0736 0.1041  852  LYS   A CA  
2382 C  C   . LYS   A 162 ? 0.5516 0.4203 0.506  -0.0128 -0.0554 0.0925  852  LYS   A C   
2383 O  O   . LYS   A 162 ? 0.5717 0.4094 0.4976 -0.0043 -0.0509 0.0868  852  LYS   A O   
2384 C  CB  . LYS   A 162 ? 0.6025 0.4497 0.519  -0.0375 -0.0807 0.1104  852  LYS   A CB  
2385 C  CG  . LYS   A 162 ? 0.6486 0.512  0.5606 -0.0599 -0.0991 0.1245  852  LYS   A CG  
2386 C  CD  . LYS   A 162 ? 0.7211 0.5598 0.6072 -0.0619 -0.106  0.13    852  LYS   A CD  
2387 C  CE  . LYS   A 162 ? 0.7627 0.624  0.6453 -0.0851 -0.1257 0.146   852  LYS   A CE  
2388 N  NZ  . LYS   A 162 ? 0.7595 0.6789 0.6926 -0.0751 -0.1229 0.155   852  LYS   A NZ  
2402 N  N   . ILE   A 163 ? 0.5169 0.4185 0.512  -0.0037 -0.0453 0.0902  853  ILE   A N   
2403 C  CA  . ILE   A 163 ? 0.5086 0.413  0.5177 0.0106  -0.0298 0.0808  853  ILE   A CA  
2404 C  C   . ILE   A 163 ? 0.5149 0.3997 0.5113 0.0171  -0.0257 0.0825  853  ILE   A C   
2405 O  O   . ILE   A 163 ? 0.5122 0.3956 0.5088 0.0138  -0.0318 0.0899  853  ILE   A O   
2406 C  CB  . ILE   A 163 ? 0.4897 0.4279 0.5381 0.0142  -0.0218 0.0771  853  ILE   A CB  
2407 C  CG1 . ILE   A 163 ? 0.4892 0.4492 0.5486 0.008   -0.0249 0.0758  853  ILE   A CG1 
2408 C  CG2 . ILE   A 163 ? 0.492  0.4307 0.5503 0.0225  -0.0079 0.0686  853  ILE   A CG2 
2409 C  CD1 . ILE   A 163 ? 0.4823 0.4747 0.5728 0.0109  -0.0211 0.0759  853  ILE   A CD1 
2421 N  N   . THR   A 164 ? 0.5185 0.3927 0.504  0.0266  -0.0155 0.0771  854  THR   A N   
2422 C  CA  . THR   A 164 ? 0.5318 0.3907 0.5035 0.0325  -0.0098 0.0792  854  THR   A CA  
2423 C  C   . THR   A 164 ? 0.5195 0.3973 0.5094 0.0387  0.0053  0.0744  854  THR   A C   
2424 O  O   . THR   A 164 ? 0.5041 0.4049 0.5163 0.0377  0.01    0.069   854  THR   A O   
2425 C  CB  . THR   A 164 ? 0.5754 0.3975 0.4996 0.0366  -0.0146 0.081   854  THR   A CB  
2426 O  OG1 . THR   A 164 ? 0.5989 0.4061 0.5078 0.0403  -0.0114 0.0849  854  THR   A OG1 
2427 C  CG2 . THR   A 164 ? 0.5865 0.4046 0.4947 0.0499  -0.0063 0.0754  854  THR   A CG2 
2435 N  N   . ASP   A 165 ? 0.5242 0.394  0.5033 0.0423  0.0121  0.0775  855  ASP   A N   
2436 C  CA  . ASP   A 165 ? 0.5172 0.4066 0.5079 0.0437  0.0253  0.0762  855  ASP   A CA  
2437 C  C   . ASP   A 165 ? 0.5098 0.4131 0.529  0.0334  0.0285  0.0741  855  ASP   A C   
2438 O  O   . ASP   A 165 ? 0.4973 0.421  0.5348 0.0298  0.0315  0.0684  855  ASP   A O   
2439 C  CB  . ASP   A 165 ? 0.5282 0.4369 0.5152 0.0533  0.0324  0.0727  855  ASP   A CB  
2440 C  CG  . ASP   A 165 ? 0.5661 0.499  0.5549 0.0568  0.0455  0.0758  855  ASP   A CG  
2441 O  OD1 . ASP   A 165 ? 0.5621 0.5085 0.5691 0.0437  0.0502  0.0773  855  ASP   A OD1 
2442 O  OD2 . ASP   A 165 ? 0.5953 0.5329 0.564  0.0728  0.0513  0.0775  855  ASP   A OD2 
2447 N  N   . PHE   A 166 ? 0.5176 0.405  0.5351 0.0292  0.028   0.079   856  PHE   A N   
2448 C  CA  . PHE   A 166 ? 0.5208 0.4068 0.5535 0.0214  0.0313  0.0775  856  PHE   A CA  
2449 C  C   . PHE   A 166 ? 0.5274 0.4161 0.5554 0.0119  0.0414  0.0799  856  PHE   A C   
2450 O  O   . PHE   A 166 ? 0.5371 0.4056 0.5603 0.0049  0.043   0.0831  856  PHE   A O   
2451 C  CB  . PHE   A 166 ? 0.5269 0.392  0.5577 0.0253  0.0238  0.0828  856  PHE   A CB  
2452 C  CG  . PHE   A 166 ? 0.5283 0.4033 0.5686 0.0305  0.0144  0.0821  856  PHE   A CG  
2453 C  CD1 . PHE   A 166 ? 0.5423 0.4159 0.5697 0.0319  0.0051  0.0862  856  PHE   A CD1 
2454 C  CD2 . PHE   A 166 ? 0.5286 0.4139 0.587  0.0323  0.015   0.0776  856  PHE   A CD2 
2455 C  CE1 . PHE   A 166 ? 0.5429 0.429  0.5778 0.0313  -0.0044 0.0873  856  PHE   A CE1 
2456 C  CE2 . PHE   A 166 ? 0.5274 0.4297 0.596  0.0356  0.0071  0.0787  856  PHE   A CE2 
2457 C  CZ  . PHE   A 166 ? 0.5263 0.431  0.5843 0.0331  -0.0029 0.0842  856  PHE   A CZ  
2467 N  N   . GLY   A 167 ? 0.5213 0.4364 0.5494 0.0116  0.048   0.0795  857  GLY   A N   
2468 C  CA  . GLY   A 167 ? 0.5263 0.4586 0.5526 0.0005  0.0578  0.084   857  GLY   A CA  
2469 C  C   . GLY   A 167 ? 0.5267 0.4684 0.5659 -0.0186 0.0607  0.0803  857  GLY   A C   
2470 O  O   . GLY   A 167 ? 0.5357 0.4692 0.5673 -0.0352 0.0648  0.0851  857  GLY   A O   
2474 N  N   . LEU   A 168 ? 0.5197 0.4751 0.5738 -0.0185 0.058   0.0721  858  LEU   A N   
2475 C  CA  . LEU   A 168 ? 0.5252 0.4831 0.5858 -0.0376 0.0593  0.0669  858  LEU   A CA  
2476 C  C   . LEU   A 168 ? 0.5519 0.4688 0.6079 -0.0356 0.0544  0.0608  858  LEU   A C   
2477 O  O   . LEU   A 168 ? 0.5564 0.4607 0.608  -0.0502 0.0555  0.0556  858  LEU   A O   
2478 C  CB  . LEU   A 168 ? 0.507  0.5073 0.5842 -0.039  0.0599  0.0619  858  LEU   A CB  
2479 C  CG  . LEU   A 168 ? 0.5051 0.5546 0.5886 -0.0329 0.0652  0.0682  858  LEU   A CG  
2480 C  CD1 . LEU   A 168 ? 0.4938 0.5829 0.5931 -0.035  0.0645  0.0638  858  LEU   A CD1 
2481 C  CD2 . LEU   A 168 ? 0.5068 0.5768 0.5857 -0.049  0.0725  0.0781  858  LEU   A CD2 
2493 N  N   . ALA   A 169 ? 0.5686 0.4662 0.6233 -0.0177 0.0491  0.062   859  ALA   A N   
2494 C  CA  . ALA   A 169 ? 0.5942 0.4635 0.647  -0.0101 0.0457  0.0583  859  ALA   A CA  
2495 C  C   . ALA   A 169 ? 0.63   0.4577 0.6625 -0.0185 0.0487  0.0597  859  ALA   A C   
2496 O  O   . ALA   A 169 ? 0.6407 0.4545 0.6592 -0.0267 0.0508  0.0671  859  ALA   A O   
2497 C  CB  . ALA   A 169 ? 0.596  0.462  0.6513 0.0078  0.0387  0.0635  859  ALA   A CB  
2503 N  N   . LYS   A 170 ? 0.6487 0.4526 0.6747 -0.016  0.0493  0.0525  860  LYS   A N   
2504 C  CA  . LYS   A 170 ? 0.6901 0.4414 0.6868 -0.0218 0.0522  0.0524  860  LYS   A CA  
2505 C  C   . LYS   A 170 ? 0.7186 0.4428 0.7085 0.0023  0.0517  0.0495  860  LYS   A C   
2506 O  O   . LYS   A 170 ? 0.7085 0.4525 0.7123 0.0112  0.0517  0.0421  860  LYS   A O   
2507 C  CB  . LYS   A 170 ? 0.7162 0.4584 0.6987 -0.0492 0.0555  0.0451  860  LYS   A CB  
2508 C  CG  . LYS   A 170 ? 0.7452 0.527  0.7371 -0.0737 0.057   0.0496  860  LYS   A CG  
2509 C  CD  . LYS   A 170 ? 0.8049 0.5685 0.7785 -0.0874 0.0589  0.0607  860  LYS   A CD  
2510 C  CE  . LYS   A 170 ? 0.8222 0.6416 0.8127 -0.1018 0.0617  0.0676  860  LYS   A CE  
2511 N  NZ  . LYS   A 170 ? 0.8593 0.6661 0.8322 -0.1153 0.0647  0.0795  860  LYS   A NZ  
2525 N  N   . LEU   A 171 ? 0.7526 0.4336 0.7199 0.0146  0.0518  0.0563  861  LEU   A N   
2526 C  CA  . LEU   A 171 ? 0.7819 0.4385 0.7397 0.0429  0.0528  0.0558  861  LEU   A CA  
2527 C  C   . LEU   A 171 ? 0.8281 0.4295 0.7494 0.0379  0.0587  0.0457  861  LEU   A C   
2528 O  O   . LEU   A 171 ? 0.8532 0.4139 0.7444 0.0138  0.0602  0.0449  861  LEU   A O   
2529 C  CB  . LEU   A 171 ? 0.7987 0.4324 0.7447 0.0619  0.0501  0.0691  861  LEU   A CB  
2530 C  CG  . LEU   A 171 ? 0.7953 0.477  0.7705 0.0707  0.0425  0.0799  861  LEU   A CG  
2531 C  CD1 . LEU   A 171 ? 0.8169 0.4716 0.7741 0.078   0.0393  0.0932  861  LEU   A CD1 
2532 C  CD2 . LEU   A 171 ? 0.7845 0.506  0.7849 0.0942  0.0392  0.0815  861  LEU   A CD2 
2544 N  N   . LEU   A 172 ? 0.8395 0.4382 0.7595 0.0591  0.0621  0.0384  862  LEU   A N   
2545 C  CA  . LEU   A 172 ? 0.8908 0.4303 0.7688 0.0583  0.068   0.0272  862  LEU   A CA  
2546 C  C   . LEU   A 172 ? 0.9399 0.424  0.7836 0.0926  0.072   0.0321  862  LEU   A C   
2547 O  O   . LEU   A 172 ? 0.9253 0.442  0.7916 0.1258  0.072   0.0397  862  LEU   A O   
2548 C  CB  . LEU   A 172 ? 0.8769 0.4475 0.7705 0.0636  0.0708  0.0155  862  LEU   A CB  
2549 C  CG  . LEU   A 172 ? 0.8663 0.492  0.7915 0.0353  0.0671  0.0102  862  LEU   A CG  
2550 C  CD1 . LEU   A 172 ? 0.8559 0.5169 0.7998 0.048   0.0694  0.002   862  LEU   A CD1 
2551 C  CD2 . LEU   A 172 ? 0.8939 0.4895 0.7918 -0.0026 0.0667  0.0037  862  LEU   A CD2 
2563 N  N   . GLY   A 173 ? 0.9965 0.3978 0.7837 0.0844  0.0751  0.0288  863  GLY   A N   
2564 C  CA  . GLY   A 173 ? 1.0494 0.3848 0.7931 0.12    0.0798  0.033   863  GLY   A CA  
2565 C  C   . GLY   A 173 ? 1.077  0.397  0.8038 0.1527  0.088   0.0229  863  GLY   A C   
2566 O  O   . GLY   A 173 ? 1.0618 0.4168 0.8075 0.1424  0.0895  0.0116  863  GLY   A O   
2570 N  N   . ALA   A 174 ? 1.1091 0.389  0.8065 0.1974  0.0937  0.029   864  ALA   A N   
2571 C  CA  . ALA   A 174 ? 1.1278 0.4053 0.8133 0.2401  0.1036  0.0227  864  ALA   A CA  
2572 C  C   . ALA   A 174 ? 1.1707 0.3987 0.815  0.2244  0.1094  0.0026  864  ALA   A C   
2573 O  O   . ALA   A 174 ? 1.1586 0.4186 0.8148 0.2481  0.1164  -0.0043 864  ALA   A O   
2574 C  CB  . ALA   A 174 ? 1.1631 0.3848 0.8067 0.2886  0.1095  0.0326  864  ALA   A CB  
2580 N  N   . GLU   A 175 ? 1.2158 0.3735 0.8138 0.1831  0.1059  -0.0056 865  GLU   A N   
2581 C  CA  . GLU   A 175 ? 1.2617 0.3645 0.8114 0.1655  0.1098  -0.0246 865  GLU   A CA  
2582 C  C   . GLU   A 175 ? 1.2467 0.3801 0.8184 0.1038  0.1001  -0.0287 865  GLU   A C   
2583 O  O   . GLU   A 175 ? 1.2921 0.3526 0.8098 0.0666  0.0963  -0.0333 865  GLU   A O   
2584 C  CB  . GLU   A 175 ? 1.3753 0.3446 0.8283 0.1723  0.1141  -0.0298 865  GLU   A CB  
2585 C  CG  . GLU   A 175 ? 1.4755 0.4045 0.9006 0.2333  0.1222  -0.0197 865  GLU   A CG  
2586 C  CD  . GLU   A 175 ? 1.5681 0.5174 0.9944 0.29    0.1348  -0.0245 865  GLU   A CD  
2587 O  OE1 . GLU   A 175 ? 1.6234 0.5195 1.0005 0.2901  0.1414  -0.0417 865  GLU   A OE1 
2588 O  OE2 . GLU   A 175 ? 1.5617 0.5811 1.0357 0.333   0.138   -0.0104 865  GLU   A OE2 
2595 N  N   . GLU   A 176 ? 1.1827 0.4193 0.8271 0.0944  0.0964  -0.0267 866  GLU   A N   
2596 C  CA  . GLU   A 176 ? 1.1597 0.4407 0.8333 0.0425  0.0877  -0.0274 866  GLU   A CA  
2597 C  C   . GLU   A 176 ? 1.102  0.479  0.839  0.0469  0.0869  -0.0298 866  GLU   A C   
2598 O  O   . GLU   A 176 ? 1.0632 0.5087 0.8543 0.0568  0.0838  -0.0188 866  GLU   A O   
2599 C  CB  . GLU   A 176 ? 1.1901 0.4715 0.8721 0.0248  0.082   -0.013  866  GLU   A CB  
2600 C  CG  . GLU   A 176 ? 1.2397 0.5664 0.9475 -0.0247 0.0747  -0.0109 866  GLU   A CG  
2601 C  CD  . GLU   A 176 ? 1.3099 0.6656 1.0441 -0.0318 0.0708  0.005   866  GLU   A CD  
2602 O  OE1 . GLU   A 176 ? 1.3273 0.6687 1.0611 0.0002  0.0724  0.0141  866  GLU   A OE1 
2603 O  OE2 . GLU   A 176 ? 1.3186 0.7139 1.0727 -0.0679 0.0665  0.0089  866  GLU   A OE2 
2610 N  N   . LYS   A 177 ? 1.0934 0.4773 0.824  0.0319  0.0877  -0.043  867  LYS   A N   
2611 C  CA  . LYS   A 177 ? 1.0424 0.5147 0.8306 0.0389  0.0871  -0.0441 867  LYS   A CA  
2612 C  C   . LYS   A 177 ? 0.9991 0.5355 0.8302 0.0021  0.0783  -0.0396 867  LYS   A C   
2613 O  O   . LYS   A 177 ? 0.9607 0.5683 0.8398 0.0084  0.0765  -0.0372 867  LYS   A O   
2614 C  CB  . LYS   A 177 ? 1.0843 0.5344 0.8435 0.0463  0.093   -0.0595 867  LYS   A CB  
2615 C  CG  . LYS   A 177 ? 1.1635 0.5672 0.888  0.0939  0.1042  -0.0624 867  LYS   A CG  
2616 C  CD  . LYS   A 177 ? 1.181  0.6468 0.9546 0.133   0.1069  -0.0483 867  LYS   A CD  
2617 C  CE  . LYS   A 177 ? 1.2472 0.6765 0.9892 0.1845  0.1186  -0.0475 867  LYS   A CE  
2618 N  NZ  . LYS   A 177 ? 1.2332 0.7351 1.0272 0.2175  0.1192  -0.0308 867  LYS   A NZ  
2632 N  N   . GLU   A 178 ? 1.0034 0.5161 0.8157 -0.0337 0.0734  -0.0374 868  GLU   A N   
2633 C  CA  . GLU   A 178 ? 0.9681 0.541  0.8158 -0.0665 0.0666  -0.0315 868  GLU   A CA  
2634 C  C   . GLU   A 178 ? 0.9639 0.5302 0.8083 -0.0894 0.0632  -0.02   868  GLU   A C   
2635 O  O   . GLU   A 178 ? 1.0006 0.5003 0.8045 -0.089  0.0648  -0.0173 868  GLU   A O   
2636 C  CB  . GLU   A 178 ? 1.0081 0.5692 0.8301 -0.0973 0.0643  -0.0436 868  GLU   A CB  
2637 C  CG  . GLU   A 178 ? 1.128  0.5964 0.8793 -0.1183 0.0644  -0.0508 868  GLU   A CG  
2638 C  CD  . GLU   A 178 ? 1.2218 0.6786 0.9439 -0.1537 0.06    -0.0623 868  GLU   A CD  
2639 O  OE1 . GLU   A 178 ? 1.1989 0.7234 0.9584 -0.1583 0.0574  -0.0649 868  GLU   A OE1 
2640 O  OE2 . GLU   A 178 ? 1.295  0.6712 0.9523 -0.1779 0.0582  -0.0683 868  GLU   A OE2 
2647 N  N   . TYR   A 179 ? 0.9188 0.5534 0.8032 -0.1072 0.0593  -0.0125 869  TYR   A N   
2648 C  CA  . TYR   A 179 ? 0.9125 0.5557 0.7987 -0.1291 0.0574  -0.0004 869  TYR   A CA  
2649 C  C   . TYR   A 179 ? 0.8975 0.5848 0.7914 -0.1688 0.0534  0.0007  869  TYR   A C   
2650 O  O   . TYR   A 179 ? 0.8659 0.6161 0.7947 -0.1665 0.052   -0.0009 869  TYR   A O   
2651 C  CB  . TYR   A 179 ? 0.8781 0.569  0.8056 -0.1055 0.0577  0.0105  869  TYR   A CB  
2652 C  CG  . TYR   A 179 ? 0.871  0.5853 0.8053 -0.1262 0.057   0.0228  869  TYR   A CG  
2653 C  CD1 . TYR   A 179 ? 0.8428 0.6289 0.8113 -0.1356 0.0562  0.0278  869  TYR   A CD1 
2654 C  CD2 . TYR   A 179 ? 0.908  0.5716 0.8103 -0.1362 0.0579  0.03    869  TYR   A CD2 
2655 C  CE1 . TYR   A 179 ? 0.8421 0.6549 0.8154 -0.1524 0.0575  0.0398  869  TYR   A CE1 
2656 C  CE2 . TYR   A 179 ? 0.9078 0.5963 0.8149 -0.1568 0.0583  0.0421  869  TYR   A CE2 
2657 C  CZ  . TYR   A 179 ? 0.8793 0.6452 0.823  -0.1643 0.0587  0.047   869  TYR   A CZ  
2658 O  OH  . TYR   A 179 ? 0.8855 0.6806 0.8333 -0.1812 0.0609  0.0599  869  TYR   A OH  
2668 N  N   . HIS   A 180 ? 0.9169 0.575  0.7784 -0.2055 0.0514  0.0056  870  HIS   A N   
2669 C  CA  . HIS   A 180 ? 0.9044 0.6119 0.7728 -0.2474 0.047   0.0102  870  HIS   A CA  
2670 C  C   . HIS   A 180 ? 0.8784 0.6376 0.7727 -0.2563 0.0485  0.0268  870  HIS   A C   
2671 O  O   . HIS   A 180 ? 0.9028 0.6201 0.7716 -0.2658 0.0498  0.0344  870  HIS   A O   
2672 C  CB  . HIS   A 180 ? 0.9595 0.601  0.7688 -0.2892 0.0425  0.0054  870  HIS   A CB  
2673 C  CG  . HIS   A 180 ? 1.0223 0.6092 0.7981 -0.2818 0.0417  -0.0117 870  HIS   A CG  
2674 N  ND1 . HIS   A 180 ? 1.0812 0.5951 0.8288 -0.2454 0.047   -0.0201 870  HIS   A ND1 
2675 C  CD2 . HIS   A 180 ? 1.0382 0.636  0.8028 -0.3053 0.0366  -0.0208 870  HIS   A CD2 
2676 C  CE1 . HIS   A 180 ? 1.1088 0.59   0.8279 -0.246  0.0464  -0.0346 870  HIS   A CE1 
2677 N  NE2 . HIS   A 180 ? 1.0897 0.6165 0.8164 -0.283  0.0396  -0.0362 870  HIS   A NE2 
2685 N  N   . ALA   A 181 ? 0.833  0.6794 0.7722 -0.2537 0.0487  0.0323  871  ALA   A N   
2686 C  CA  . ALA   A 181 ? 0.8097 0.7112 0.7736 -0.2552 0.0522  0.0479  871  ALA   A CA  
2687 C  C   . ALA   A 181 ? 0.8058 0.7334 0.7563 -0.3041 0.0499  0.0586  871  ALA   A C   
2688 O  O   . ALA   A 181 ? 0.8235 0.73   0.7475 -0.3378 0.0438  0.0532  871  ALA   A O   
2689 C  CB  . ALA   A 181 ? 0.7727 0.7499 0.7824 -0.2284 0.054   0.0495  871  ALA   A CB  
2695 N  N   . GLU   A 182 ? 0.7811 0.7541 0.7471 -0.3088 0.0544  0.0741  872  GLU   A N   
2696 C  CA  . GLU   A 182 ? 0.7707 0.7878 0.7304 -0.357  0.0527  0.0879  872  GLU   A CA  
2697 C  C   . GLU   A 182 ? 0.7127 0.8431 0.7193 -0.352  0.0549  0.0969  872  GLU   A C   
2698 O  O   . GLU   A 182 ? 0.7028 0.8596 0.724  -0.3472 0.0505  0.0888  872  GLU   A O   
2699 C  CB  . GLU   A 182 ? 0.8151 0.8109 0.7565 -0.3695 0.0571  0.1014  872  GLU   A CB  
2700 C  CG  . GLU   A 182 ? 0.8957 0.8882 0.8051 -0.43   0.0524  0.1122  872  GLU   A CG  
2701 C  CD  . GLU   A 182 ? 1.0125 0.9496 0.8827 -0.4645 0.0422  0.1005  872  GLU   A CD  
2702 O  OE1 . GLU   A 182 ? 1.0732 0.9095 0.9041 -0.4523 0.0401  0.0865  872  GLU   A OE1 
2703 O  OE2 . GLU   A 182 ? 1.0184 1.0147 0.8956 -0.5025 0.0363  0.1059  872  GLU   A OE2 
2710 N  N   . GLY   A 183 ? 0.6735 0.8669 0.7011 -0.3485 0.0621  0.1134  873  GLY   A N   
2711 C  CA  . GLY   A 183 ? 0.618  0.9231 0.6865 -0.3411 0.0656  0.1244  873  GLY   A CA  
2712 C  C   . GLY   A 183 ? 0.5918 0.9218 0.685  -0.2875 0.075   0.1261  873  GLY   A C   
2713 O  O   . GLY   A 183 ? 0.5568 0.9742 0.6791 -0.272  0.0806  0.1369  873  GLY   A O   
2717 N  N   . GLY   A 184 ? 0.611  0.8648 0.6893 -0.2602 0.0762  0.1163  874  GLY   A N   
2718 C  CA  . GLY   A 184 ? 0.5965 0.8592 0.6895 -0.212  0.0829  0.1162  874  GLY   A CA  
2719 C  C   . GLY   A 184 ? 0.5608 0.8755 0.68   -0.1827 0.0831  0.1127  874  GLY   A C   
2720 O  O   . GLY   A 184 ? 0.5585 0.8757 0.6831 -0.191  0.0762  0.1042  874  GLY   A O   
2724 N  N   . LYS   A 185 ? 0.5321 0.8831 0.6624 -0.1473 0.0911  0.1193  875  LYS   A N   
2725 C  CA  . LYS   A 185 ? 0.5076 0.8973 0.655  -0.1131 0.0918  0.1167  875  LYS   A CA  
2726 C  C   . LYS   A 185 ? 0.522  0.8439 0.6611 -0.0927 0.0848  0.1004  875  LYS   A C   
2727 O  O   . LYS   A 185 ? 0.5491 0.8091 0.6719 -0.0839 0.0841  0.0956  875  LYS   A O   
2728 C  CB  . LYS   A 185 ? 0.5158 0.9479 0.6659 -0.0776 0.1029  0.1276  875  LYS   A CB  
2729 C  CG  . LYS   A 185 ? 0.5333 1.0655 0.7023 -0.083  0.111   0.1452  875  LYS   A CG  
2730 C  CD  . LYS   A 185 ? 0.5829 1.1535 0.7512 -0.0351 0.1225  0.1531  875  LYS   A CD  
2731 C  CE  . LYS   A 185 ? 0.5909 1.2733 0.7819 -0.0335 0.131   0.1718  875  LYS   A CE  
2732 N  NZ  . LYS   A 185 ? 0.6152 1.3297 0.8025 0.022   0.1409  0.1766  875  LYS   A NZ  
2746 N  N   . VAL   A 186 ? 0.4997 0.8383 0.6501 -0.0853 0.0797  0.0939  876  VAL   A N   
2747 C  CA  . VAL   A 186 ? 0.5136 0.7965 0.6578 -0.071  0.0728  0.0796  876  VAL   A CA  
2748 C  C   . VAL   A 186 ? 0.4914 0.8043 0.6451 -0.0435 0.0714  0.0782  876  VAL   A C   
2749 O  O   . VAL   A 186 ? 0.4663 0.8447 0.6337 -0.0427 0.0738  0.0864  876  VAL   A O   
2750 C  CB  . VAL   A 186 ? 0.5349 0.7856 0.674  -0.1029 0.0657  0.0699  876  VAL   A CB  
2751 C  CG1 . VAL   A 186 ? 0.5682 0.7584 0.6873 -0.119  0.0657  0.0679  876  VAL   A CG1 
2752 C  CG2 . VAL   A 186 ? 0.5189 0.8249 0.6677 -0.1335 0.0635  0.0745  876  VAL   A CG2 
2762 N  N   . PRO   A 187 ? 0.4966 0.7655 0.6421 -0.0225 0.0668  0.0692  877  PRO   A N   
2763 C  CA  . PRO   A 187 ? 0.4791 0.7698 0.6274 0.0012  0.0649  0.0688  877  PRO   A CA  
2764 C  C   . PRO   A 187 ? 0.4551 0.7641 0.6154 -0.0144 0.0585  0.0626  877  PRO   A C   
2765 O  O   . PRO   A 187 ? 0.4737 0.7419 0.63   -0.0213 0.0529  0.0521  877  PRO   A O   
2766 C  CB  . PRO   A 187 ? 0.5152 0.7474 0.645  0.0228  0.0616  0.0631  877  PRO   A CB  
2767 C  CG  . PRO   A 187 ? 0.5402 0.725  0.6666 0.005   0.0586  0.057   877  PRO   A CG  
2768 C  CD  . PRO   A 187 ? 0.5149 0.7162 0.6473 -0.0202 0.0628  0.0609  877  PRO   A CD  
2776 N  N   . ILE   A 188 ? 0.4111 0.7854 0.5853 -0.0175 0.0595  0.07    878  ILE   A N   
2777 C  CA  . ILE   A 188 ? 0.3876 0.7864 0.5717 -0.0357 0.0527  0.0656  878  ILE   A CA  
2778 C  C   . ILE   A 188 ? 0.3809 0.7593 0.56   -0.0157 0.0475  0.0586  878  ILE   A C   
2779 O  O   . ILE   A 188 ? 0.387  0.7465 0.5656 -0.032  0.0417  0.0489  878  ILE   A O   
2780 C  CB  . ILE   A 188 ? 0.3575 0.8431 0.5593 -0.0454 0.0543  0.0788  878  ILE   A CB  
2781 C  CG1 . ILE   A 188 ? 0.3579 0.8688 0.5641 -0.0742 0.0585  0.0873  878  ILE   A CG1 
2782 C  CG2 . ILE   A 188 ? 0.3504 0.8656 0.5604 -0.064  0.0458  0.0753  878  ILE   A CG2 
2783 C  CD1 . ILE   A 188 ? 0.3908 0.8573 0.5859 -0.1176 0.0533  0.0785  878  ILE   A CD1 
2795 N  N   . LYS   A 189 ? 0.3701 0.7478 0.5404 0.0189  0.0497  0.0636  879  LYS   A N   
2796 C  CA  . LYS   A 189 ? 0.3731 0.731  0.5336 0.0365  0.0442  0.0594  879  LYS   A CA  
2797 C  C   . LYS   A 189 ? 0.3925 0.6829 0.5404 0.033   0.0396  0.0485  879  LYS   A C   
2798 O  O   . LYS   A 189 ? 0.3989 0.6735 0.5393 0.0401  0.0344  0.045   879  LYS   A O   
2799 C  CB  . LYS   A 189 ? 0.3943 0.764  0.54   0.0748  0.0479  0.0691  879  LYS   A CB  
2800 C  CG  . LYS   A 189 ? 0.4045 0.8549 0.5659 0.0832  0.0519  0.0817  879  LYS   A CG  
2801 C  CD  . LYS   A 189 ? 0.4514 0.9123 0.5935 0.1276  0.0572  0.0919  879  LYS   A CD  
2802 C  CE  . LYS   A 189 ? 0.4548 1.0082 0.6171 0.1373  0.0617  0.1065  879  LYS   A CE  
2803 N  NZ  . LYS   A 189 ? 0.4835 1.0479 0.624  0.1862  0.0662  0.1165  879  LYS   A NZ  
2817 N  N   . TRP   A 190 ? 0.3977 0.6534 0.5438 0.0215  0.0414  0.0446  880  TRP   A N   
2818 C  CA  . TRP   A 190 ? 0.4162 0.6198 0.5549 0.0169  0.0375  0.0365  880  TRP   A CA  
2819 C  C   . TRP   A 190 ? 0.4142 0.6078 0.5612 -0.0087 0.0373  0.0283  880  TRP   A C   
2820 O  O   . TRP   A 190 ? 0.4271 0.5886 0.5708 -0.0109 0.0348  0.0216  880  TRP   A O   
2821 C  CB  . TRP   A 190 ? 0.4314 0.5986 0.5561 0.0284  0.0391  0.0397  880  TRP   A CB  
2822 C  CG  . TRP   A 190 ? 0.4468 0.5979 0.55   0.053   0.0373  0.0446  880  TRP   A CG  
2823 C  CD1 . TRP   A 190 ? 0.4756 0.5872 0.5614 0.0587  0.0306  0.0429  880  TRP   A CD1 
2824 C  CD2 . TRP   A 190 ? 0.4439 0.6146 0.5352 0.0751  0.0422  0.0526  880  TRP   A CD2 
2825 N  NE1 . TRP   A 190 ? 0.4928 0.5884 0.551  0.0808  0.0301  0.0484  880  TRP   A NE1 
2826 C  CE2 . TRP   A 190 ? 0.4771 0.6074 0.5375 0.0946  0.0381  0.054   880  TRP   A CE2 
2827 C  CE3 . TRP   A 190 ? 0.4295 0.6497 0.5311 0.0806  0.0501  0.0599  880  TRP   A CE3 
2828 C  CZ2 . TRP   A 190 ? 0.4939 0.6229 0.5284 0.1234  0.0423  0.0608  880  TRP   A CZ2 
2829 C  CZ3 . TRP   A 190 ? 0.4423 0.6733 0.5252 0.1109  0.0551  0.068   880  TRP   A CZ3 
2830 C  CH2 . TRP   A 190 ? 0.4728 0.6541 0.52   0.134   0.0517  0.0677  880  TRP   A CH2 
2841 N  N   . MET   A 191 ? 0.3969 0.6165 0.551  -0.028  0.0399  0.0297  881  MET   A N   
2842 C  CA  . MET   A 191 ? 0.4077 0.607  0.5587 -0.0532 0.0395  0.0219  881  MET   A CA  
2843 C  C   . MET   A 191 ? 0.4106 0.6147 0.5609 -0.064  0.0355  0.0132  881  MET   A C   
2844 O  O   . MET   A 191 ? 0.3986 0.6405 0.5561 -0.0598 0.0326  0.0157  881  MET   A O   
2845 C  CB  . MET   A 191 ? 0.4041 0.6283 0.5564 -0.076  0.0421  0.0277  881  MET   A CB  
2846 C  CG  . MET   A 191 ? 0.4352 0.6352 0.581  -0.0758 0.0466  0.0327  881  MET   A CG  
2847 S  SD  . MET   A 191 ? 0.4417 0.6972 0.5949 -0.0914 0.0512  0.0467  881  MET   A SD  
2848 C  CE  . MET   A 191 ? 0.4259 0.6855 0.5715 -0.1354 0.0464  0.0423  881  MET   A CE  
2858 N  N   . ALA   A 192 ? 0.4265 0.591  0.5647 -0.0768 0.0357  0.0034  882  ALA   A N   
2859 C  CA  . ALA   A 192 ? 0.435  0.5961 0.5655 -0.0888 0.033   -0.0064 882  ALA   A CA  
2860 C  C   . ALA   A 192 ? 0.4323 0.6211 0.5584 -0.1184 0.0301  -0.0057 882  ALA   A C   
2861 O  O   . ALA   A 192 ? 0.4318 0.6315 0.5581 -0.1326 0.0312  0.0012  882  ALA   A O   
2862 C  CB  . ALA   A 192 ? 0.4604 0.5663 0.5733 -0.088  0.0359  -0.0165 882  ALA   A CB  
2868 N  N   . LEU   A 193 ? 0.4282 0.6309 0.5489 -0.1304 0.0258  -0.012  883  LEU   A N   
2869 C  CA  . LEU   A 193 ? 0.4254 0.6584 0.5399 -0.1628 0.0207  -0.0105 883  LEU   A CA  
2870 C  C   . LEU   A 193 ? 0.4569 0.6457 0.5447 -0.1921 0.0212  -0.0149 883  LEU   A C   
2871 O  O   . LEU   A 193 ? 0.452  0.6715 0.5404 -0.2186 0.0182  -0.0065 883  LEU   A O   
2872 C  CB  . LEU   A 193 ? 0.4232 0.6706 0.531  -0.1707 0.0152  -0.0177 883  LEU   A CB  
2873 C  CG  . LEU   A 193 ? 0.4296 0.7143 0.5294 -0.2077 0.0072  -0.0157 883  LEU   A CG  
2874 C  CD1 . LEU   A 193 ? 0.3994 0.7633 0.5274 -0.2098 0.0047  0.0022  883  LEU   A CD1 
2875 C  CD2 . LEU   A 193 ? 0.4377 0.7286 0.5272 -0.2126 0.0018  -0.0239 883  LEU   A CD2 
2887 N  N   . GLU   A 194 ? 0.4889 0.6072 0.5513 -0.187  0.0251  -0.0264 884  GLU   A N   
2888 C  CA  . GLU   A 194 ? 0.525  0.5873 0.5529 -0.2115 0.0257  -0.0306 884  GLU   A CA  
2889 C  C   . GLU   A 194 ? 0.5246 0.59   0.5613 -0.2133 0.0286  -0.0188 884  GLU   A C   
2890 O  O   . GLU   A 194 ? 0.5408 0.585  0.554  -0.2441 0.0267  -0.0166 884  GLU   A O   
2891 C  CB  . GLU   A 194 ? 0.5884 0.5728 0.5832 -0.1981 0.0306  -0.0449 884  GLU   A CB  
2892 C  CG  . GLU   A 194 ? 0.6431 0.6054 0.651  -0.1602 0.0377  -0.0436 884  GLU   A CG  
2893 C  CD  . GLU   A 194 ? 0.6838 0.6779 0.7189 -0.131  0.039   -0.0439 884  GLU   A CD  
2894 O  OE1 . GLU   A 194 ? 0.6944 0.6707 0.7365 -0.1042 0.0436  -0.0429 884  GLU   A OE1 
2895 O  OE2 . GLU   A 194 ? 0.6869 0.7243 0.7347 -0.1362 0.0348  -0.044  884  GLU   A OE2 
2902 N  N   . SER   A 195 ? 0.507  0.5952 0.5725 -0.1826 0.0328  -0.0111 885  SER   A N   
2903 C  CA  . SER   A 195 ? 0.5076 0.6023 0.581  -0.1816 0.0361  0.0003  885  SER   A CA  
2904 C  C   . SER   A 195 ? 0.4827 0.648  0.5732 -0.202  0.0338  0.0132  885  SER   A C   
2905 O  O   . SER   A 195 ? 0.4857 0.6537 0.5704 -0.2206 0.0353  0.0219  885  SER   A O   
2906 C  CB  . SER   A 195 ? 0.5124 0.6095 0.606  -0.144  0.0401  0.0042  885  SER   A CB  
2907 O  OG  . SER   A 195 ? 0.5574 0.6    0.6387 -0.126  0.0421  -0.0045 885  SER   A OG  
2913 N  N   . ILE   A 196 ? 0.4574 0.6831 0.5685 -0.1979 0.0304  0.0161  886  ILE   A N   
2914 C  CA  . ILE   A 196 ? 0.4318 0.7367 0.5619 -0.2132 0.0285  0.0304  886  ILE   A CA  
2915 C  C   . ILE   A 196 ? 0.4445 0.7521 0.5537 -0.2631 0.0217  0.0304  886  ILE   A C   
2916 O  O   . ILE   A 196 ? 0.4332 0.7737 0.5441 -0.2883 0.0217  0.0427  886  ILE   A O   
2917 C  CB  . ILE   A 196 ? 0.4097 0.777  0.5648 -0.1902 0.0265  0.0346  886  ILE   A CB  
2918 C  CG1 . ILE   A 196 ? 0.4198 0.7769 0.5867 -0.1444 0.0321  0.0357  886  ILE   A CG1 
2919 C  CG2 . ILE   A 196 ? 0.3782 0.8363 0.5531 -0.2048 0.0247  0.0513  886  ILE   A CG2 
2920 C  CD1 . ILE   A 196 ? 0.4219 0.8034 0.5987 -0.1203 0.0291  0.0346  886  ILE   A CD1 
2932 N  N   . LEU   A 197 ? 0.4649 0.735  0.5503 -0.2791 0.0158  0.0168  887  LEU   A N   
2933 C  CA  . LEU   A 197 ? 0.4839 0.7471 0.5401 -0.3294 0.0073  0.0151  887  LEU   A CA  
2934 C  C   . LEU   A 197 ? 0.5286 0.7168 0.5438 -0.3576 0.0079  0.0119  887  LEU   A C   
2935 O  O   . LEU   A 197 ? 0.5335 0.7382 0.5326 -0.4031 0.0017  0.02    887  LEU   A O   
2936 C  CB  . LEU   A 197 ? 0.5013 0.7362 0.5356 -0.3358 0.0013  -0.0002 887  LEU   A CB  
2937 C  CG  . LEU   A 197 ? 0.486  0.7875 0.5494 -0.318  -0.0022 0.0019  887  LEU   A CG  
2938 C  CD1 . LEU   A 197 ? 0.5183 0.773  0.5534 -0.3207 -0.0059 -0.0153 887  LEU   A CD1 
2939 C  CD2 . LEU   A 197 ? 0.4526 0.8494 0.5368 -0.3451 -0.0102 0.0182  887  LEU   A CD2 
2951 N  N   . HIS   A 198 ? 0.5625 0.6676 0.5569 -0.3334 0.0143  0.0009  888  HIS   A N   
2952 C  CA  . HIS   A 198 ? 0.6117 0.6313 0.5587 -0.3548 0.015   -0.0035 888  HIS   A CA  
2953 C  C   . HIS   A 198 ? 0.6223 0.6096 0.5733 -0.3309 0.0232  0.002   888  HIS   A C   
2954 O  O   . HIS   A 198 ? 0.6647 0.5727 0.5728 -0.3428 0.0241  -0.002  888  HIS   A O   
2955 C  CB  . HIS   A 198 ? 0.6692 0.6022 0.5707 -0.3506 0.0145  -0.0231 888  HIS   A CB  
2956 C  CG  . HIS   A 198 ? 0.6983 0.6518 0.59   -0.3702 0.0068  -0.031  888  HIS   A CG  
2957 N  ND1 . HIS   A 198 ? 0.7335 0.6865 0.5922 -0.4239 -0.0037 -0.0297 888  HIS   A ND1 
2958 C  CD2 . HIS   A 198 ? 0.7025 0.6761 0.6106 -0.3449 0.0074  -0.0396 888  HIS   A CD2 
2959 C  CE1 . HIS   A 198 ? 0.7344 0.7076 0.5909 -0.4281 -0.0092 -0.0379 888  HIS   A CE1 
2960 N  NE2 . HIS   A 198 ? 0.72   0.706  0.606  -0.3806 -0.0023 -0.044  888  HIS   A NE2 
2968 N  N   . ARG   A 199 ? 0.5842 0.6229 0.5795 -0.2959 0.0287  0.0101  889  ARG   A N   
2969 C  CA  . ARG   A 199 ? 0.5907 0.6049 0.591  -0.2728 0.0357  0.0163  889  ARG   A CA  
2970 C  C   . ARG   A 199 ? 0.6176 0.5462 0.5918 -0.2477 0.039   0.0043  889  ARG   A C   
2971 O  O   . ARG   A 199 ? 0.6375 0.5241 0.5978 -0.241  0.0426  0.0084  889  ARG   A O   
2972 C  CB  . ARG   A 199 ? 0.6137 0.6329 0.6003 -0.3075 0.0354  0.0293  889  ARG   A CB  
2973 C  CG  . ARG   A 199 ? 0.6121 0.7217 0.6208 -0.3377 0.0316  0.0423  889  ARG   A CG  
2974 C  CD  . ARG   A 199 ? 0.6295 0.7832 0.6541 -0.343  0.0368  0.0602  889  ARG   A CD  
2975 N  NE  . ARG   A 199 ? 0.6298 0.8801 0.6774 -0.3702 0.0343  0.0753  889  ARG   A NE  
2976 C  CZ  . ARG   A 199 ? 0.651  0.9276 0.6884 -0.4119 0.033   0.0898  889  ARG   A CZ  
2977 N  NH1 . ARG   A 199 ? 0.687  0.8864 0.6835 -0.4363 0.0324  0.089   889  ARG   A NH1 
2978 N  NH2 . ARG   A 199 ? 0.6031 0.9851 0.6703 -0.4283 0.0324  0.1065  889  ARG   A NH2 
2992 N  N   . ILE   A 200 ? 0.6127 0.5252 0.5834 -0.232  0.0383  -0.0084 890  ILE   A N   
2993 C  CA  . ILE   A 200 ? 0.6394 0.4818 0.5879 -0.204  0.0427  -0.0187 890  ILE   A CA  
2994 C  C   . ILE   A 200 ? 0.6057 0.4797 0.5925 -0.1627 0.0461  -0.0162 890  ILE   A C   
2995 O  O   . ILE   A 200 ? 0.5801 0.5102 0.5969 -0.1552 0.0443  -0.0155 890  ILE   A O   
2996 C  CB  . ILE   A 200 ? 0.6755 0.4755 0.5888 -0.2129 0.041   -0.0338 890  ILE   A CB  
2997 C  CG1 . ILE   A 200 ? 0.724  0.4761 0.5871 -0.2575 0.0362  -0.0362 890  ILE   A CG1 
2998 C  CG2 . ILE   A 200 ? 0.7055 0.451  0.6029 -0.176  0.0474  -0.043  890  ILE   A CG2 
2999 C  CD1 . ILE   A 200 ? 0.7788 0.473  0.5943 -0.2668 0.0346  -0.0523 890  ILE   A CD1 
3011 N  N   . TYR   A 201 ? 0.6034 0.4409 0.5859 -0.1386 0.05    -0.0138 891  TYR   A N   
3012 C  CA  . TYR   A 201 ? 0.5737 0.4369 0.5873 -0.1045 0.0515  -0.0099 891  TYR   A CA  
3013 C  C   . TYR   A 201 ? 0.5825 0.3997 0.5816 -0.0776 0.055   -0.0152 891  TYR   A C   
3014 O  O   . TYR   A 201 ? 0.612  0.3765 0.5841 -0.0741 0.0575  -0.0141 891  TYR   A O   
3015 C  CB  . TYR   A 201 ? 0.5609 0.442  0.5896 -0.1006 0.0518  0.0029  891  TYR   A CB  
3016 C  CG  . TYR   A 201 ? 0.543  0.4815 0.5906 -0.118  0.0504  0.0103  891  TYR   A CG  
3017 C  CD1 . TYR   A 201 ? 0.5589 0.4992 0.5929 -0.1485 0.0505  0.0159  891  TYR   A CD1 
3018 C  CD2 . TYR   A 201 ? 0.5247 0.5159 0.6014 -0.1025 0.0494  0.0137  891  TYR   A CD2 
3019 C  CE1 . TYR   A 201 ? 0.5411 0.5452 0.5951 -0.1617 0.0503  0.0251  891  TYR   A CE1 
3020 C  CE2 . TYR   A 201 ? 0.512  0.5579 0.6042 -0.1116 0.0496  0.0219  891  TYR   A CE2 
3021 C  CZ  . TYR   A 201 ? 0.5229 0.5805 0.6065 -0.1401 0.0505  0.0281  891  TYR   A CZ  
3022 O  OH  . TYR   A 201 ? 0.5136 0.6357 0.6148 -0.1472 0.0517  0.0384  891  TYR   A OH  
3032 N  N   . THR   A 202 ? 0.5552 0.3951 0.5713 -0.0578 0.0555  -0.0196 892  THR   A N   
3033 C  CA  . THR   A 202 ? 0.5568 0.3722 0.5663 -0.0293 0.0596  -0.0226 892  THR   A CA  
3034 C  C   . THR   A 202 ? 0.5162 0.3802 0.5625 -0.0088 0.0572  -0.0152 892  THR   A C   
3035 O  O   . THR   A 202 ? 0.4954 0.3996 0.5642 -0.0166 0.0527  -0.0101 892  THR   A O   
3036 C  CB  . THR   A 202 ? 0.589  0.3837 0.5753 -0.0305 0.063   -0.036  892  THR   A CB  
3037 O  OG1 . THR   A 202 ? 0.5808 0.4267 0.5906 -0.0387 0.0596  -0.0385 892  THR   A OG1 
3038 C  CG2 . THR   A 202 ? 0.6248 0.3635 0.5658 -0.0551 0.0635  -0.0439 892  THR   A CG2 
3046 N  N   . HIS   A 203 ? 0.5005 0.3613 0.5498 0.0168  0.0599  -0.0136 893  HIS   A N   
3047 C  CA  . HIS   A 203 ? 0.4649 0.3716 0.5445 0.0301  0.0562  -0.0061 893  HIS   A CA  
3048 C  C   . HIS   A 203 ? 0.4338 0.3762 0.5261 0.0215  0.0544  -0.0115 893  HIS   A C   
3049 O  O   . HIS   A 203 ? 0.4169 0.3945 0.5297 0.0218  0.049   -0.005  893  HIS   A O   
3050 C  CB  . HIS   A 203 ? 0.4756 0.3813 0.5566 0.0572  0.0597  -0.0016 893  HIS   A CB  
3051 C  CG  . HIS   A 203 ? 0.5188 0.3921 0.5872 0.0696  0.0607  0.0054  893  HIS   A CG  
3052 N  ND1 . HIS   A 203 ? 0.5382 0.4176 0.6165 0.0642  0.0544  0.0157  893  HIS   A ND1 
3053 C  CD2 . HIS   A 203 ? 0.5534 0.3854 0.5962 0.0886  0.0675  0.0038  893  HIS   A CD2 
3054 C  CE1 . HIS   A 203 ? 0.5606 0.4056 0.622  0.078   0.0568  0.0206  893  HIS   A CE1 
3055 N  NE2 . HIS   A 203 ? 0.5753 0.3897 0.6143 0.0941  0.0646  0.014   893  HIS   A NE2 
3063 N  N   . GLN   A 204 ? 0.429  0.3579 0.5042 0.0128  0.0582  -0.023  894  GLN   A N   
3064 C  CA  . GLN   A 204 ? 0.4062 0.3672 0.4903 0.0037  0.0562  -0.0279 894  GLN   A CA  
3065 C  C   . GLN   A 204 ? 0.3823 0.3674 0.4765 -0.0161 0.0501  -0.0252 894  GLN   A C   
3066 O  O   . GLN   A 204 ? 0.3675 0.3865 0.4748 -0.0186 0.0466  -0.0243 894  GLN   A O   
3067 C  CB  . GLN   A 204 ? 0.437  0.3741 0.4953 0.0016  0.0618  -0.041  894  GLN   A CB  
3068 C  CG  . GLN   A 204 ? 0.4732 0.3977 0.5228 0.0283  0.0698  -0.0429 894  GLN   A CG  
3069 C  CD  . GLN   A 204 ? 0.4859 0.4605 0.5654 0.0421  0.0685  -0.0343 894  GLN   A CD  
3070 O  OE1 . GLN   A 204 ? 0.4887 0.4777 0.5846 0.0555  0.067   -0.0232 894  GLN   A OE1 
3071 N  NE2 . GLN   A 204 ? 0.478  0.4808 0.5632 0.0363  0.0678  -0.038  894  GLN   A NE2 
3080 N  N   . SER   A 205 ? 0.3771 0.3475 0.4644 -0.0285 0.0494  -0.0225 895  SER   A N   
3081 C  CA  . SER   A 205 ? 0.3566 0.3584 0.4558 -0.0422 0.0452  -0.017  895  SER   A CA  
3082 C  C   . SER   A 205 ? 0.3322 0.3552 0.4499 -0.0272 0.0421  -0.0066 895  SER   A C   
3083 O  O   . SER   A 205 ? 0.3187 0.3728 0.4463 -0.0278 0.0389  -0.0027 895  SER   A O   
3084 C  CB  . SER   A 205 ? 0.387  0.3705 0.4723 -0.061  0.0463  -0.0155 895  SER   A CB  
3085 O  OG  . SER   A 205 ? 0.4322 0.389  0.5129 -0.0528 0.0481  -0.0093 895  SER   A OG  
3091 N  N   . ASP   A 206 ? 0.3258 0.3298 0.4437 -0.0132 0.0424  -0.0019 896  ASP   A N   
3092 C  CA  . ASP   A 206 ? 0.3142 0.3306 0.4422 -0.002  0.0378  0.0073  896  ASP   A CA  
3093 C  C   . ASP   A 206 ? 0.2963 0.3354 0.4325 0.0033  0.0339  0.0076  896  ASP   A C   
3094 O  O   . ASP   A 206 ? 0.293  0.342  0.4306 0.0066  0.0286  0.0142  896  ASP   A O   
3095 C  CB  . ASP   A 206 ? 0.3385 0.3333 0.4641 0.0093  0.0376  0.0129  896  ASP   A CB  
3096 C  CG  . ASP   A 206 ? 0.3972 0.3702 0.5139 0.0062  0.039   0.0175  896  ASP   A CG  
3097 O  OD1 . ASP   A 206 ? 0.4017 0.3823 0.5165 -0.0043 0.0399  0.0183  896  ASP   A OD1 
3098 O  OD2 . ASP   A 206 ? 0.4281 0.3803 0.54   0.0153  0.0392  0.0216  896  ASP   A OD2 
3103 N  N   . VAL   A 207 ? 0.2876 0.3306 0.4241 0.004   0.0366  0.0008  897  VAL   A N   
3104 C  CA  . VAL   A 207 ? 0.2774 0.3435 0.42   0.0062  0.0337  0.0014  897  VAL   A CA  
3105 C  C   . VAL   A 207 ? 0.2716 0.3557 0.4137 -0.0015 0.0304  0.0007  897  VAL   A C   
3106 O  O   . VAL   A 207 ? 0.2716 0.3671 0.4139 0.0011  0.0251  0.0063  897  VAL   A O   
3107 C  CB  . VAL   A 207 ? 0.2857 0.3522 0.426  0.0106  0.0396  -0.006  897  VAL   A CB  
3108 C  CG1 . VAL   A 207 ? 0.2814 0.3751 0.4265 0.0091  0.0372  -0.0056 897  VAL   A CG1 
3109 C  CG2 . VAL   A 207 ? 0.2924 0.3496 0.4344 0.0251  0.0429  -0.0019 897  VAL   A CG2 
3119 N  N   . TRP   A 208 ? 0.2665 0.353  0.4054 -0.0113 0.0328  -0.0044 898  TRP   A N   
3120 C  CA  . TRP   A 208 ? 0.2579 0.37   0.3985 -0.0158 0.0299  -0.0026 898  TRP   A CA  
3121 C  C   . TRP   A 208 ? 0.2576 0.3718 0.3973 -0.0058 0.0267  0.0072  898  TRP   A C   
3122 O  O   . TRP   A 208 ? 0.2602 0.3858 0.3961 0.0009  0.0228  0.0114  898  TRP   A O   
3123 C  CB  . TRP   A 208 ? 0.2522 0.3726 0.3906 -0.0314 0.0322  -0.0069 898  TRP   A CB  
3124 C  CG  . TRP   A 208 ? 0.2402 0.3988 0.3833 -0.0355 0.0292  -0.0036 898  TRP   A CG  
3125 C  CD1 . TRP   A 208 ? 0.2401 0.4203 0.3874 -0.0253 0.0279  0.0059  898  TRP   A CD1 
3126 C  CD2 . TRP   A 208 ? 0.2335 0.4142 0.3751 -0.0496 0.0274  -0.0088 898  TRP   A CD2 
3127 N  NE1 . TRP   A 208 ? 0.2278 0.4471 0.3792 -0.0291 0.0256  0.0081  898  TRP   A NE1 
3128 C  CE2 . TRP   A 208 ? 0.2249 0.4469 0.3741 -0.0465 0.0244  -0.0006 898  TRP   A CE2 
3129 C  CE3 . TRP   A 208 ? 0.249  0.417  0.3797 -0.0645 0.0282  -0.0194 898  TRP   A CE3 
3130 C  CZ2 . TRP   A 208 ? 0.221  0.4782 0.3717 -0.0582 0.0207  -0.0014 898  TRP   A CZ2 
3131 C  CZ3 . TRP   A 208 ? 0.2503 0.4471 0.3787 -0.0788 0.0243  -0.0217 898  TRP   A CZ3 
3132 C  CH2 . TRP   A 208 ? 0.2312 0.4753 0.3717 -0.0766 0.02    -0.0122 898  TRP   A CH2 
3143 N  N   . SER   A 209 ? 0.2574 0.3554 0.3954 -0.0037 0.0285  0.0109  899  SER   A N   
3144 C  CA  . SER   A 209 ? 0.2624 0.3552 0.3932 0.0069  0.0264  0.0193  899  SER   A CA  
3145 C  C   . SER   A 209 ? 0.269  0.3464 0.3906 0.0144  0.0201  0.0235  899  SER   A C   
3146 O  O   . SER   A 209 ? 0.2793 0.3511 0.3862 0.0231  0.0166  0.0288  899  SER   A O   
3147 C  CB  . SER   A 209 ? 0.286  0.3619 0.4148 0.0058  0.0297  0.0221  899  SER   A CB  
3148 O  OG  . SER   A 209 ? 0.3129 0.403  0.446  -0.0051 0.0347  0.0205  899  SER   A OG  
3154 N  N   . TYR   A 210 ? 0.2627 0.3332 0.3895 0.0111  0.0184  0.022   900  TYR   A N   
3155 C  CA  . TYR   A 210 ? 0.2641 0.328  0.3838 0.0119  0.0112  0.0278  900  TYR   A CA  
3156 C  C   . TYR   A 210 ? 0.2698 0.3428 0.3808 0.0116  0.0075  0.0282  900  TYR   A C   
3157 O  O   . TYR   A 210 ? 0.2851 0.3419 0.3764 0.0134  0.0007  0.0346  900  TYR   A O   
3158 C  CB  . TYR   A 210 ? 0.2513 0.3217 0.3835 0.0095  0.0121  0.0273  900  TYR   A CB  
3159 C  CG  . TYR   A 210 ? 0.2497 0.3257 0.3778 0.0054  0.0043  0.0352  900  TYR   A CG  
3160 C  CD1 . TYR   A 210 ? 0.2509 0.3449 0.3809 0.0008  0.0034  0.0345  900  TYR   A CD1 
3161 C  CD2 . TYR   A 210 ? 0.2611 0.3256 0.3811 0.0031  -0.0031 0.0445  900  TYR   A CD2 
3162 C  CE1 . TYR   A 210 ? 0.2581 0.36   0.3827 -0.0076 -0.0043 0.0437  900  TYR   A CE1 
3163 C  CE2 . TYR   A 210 ? 0.27   0.3417 0.3835 -0.0067 -0.0121 0.0535  900  TYR   A CE2 
3164 C  CZ  . TYR   A 210 ? 0.2726 0.3641 0.389  -0.0127 -0.0125 0.0536  900  TYR   A CZ  
3165 O  OH  . TYR   A 210 ? 0.2857 0.3873 0.3945 -0.0266 -0.0219 0.0643  900  TYR   A OH  
3175 N  N   . GLY   A 211 ? 0.2589 0.3524 0.3795 0.0087  0.0115  0.0217  901  GLY   A N   
3176 C  CA  . GLY   A 211 ? 0.2668 0.3711 0.3793 0.0092  0.0083  0.0224  901  GLY   A CA  
3177 C  C   . GLY   A 211 ? 0.2837 0.3822 0.3798 0.0201  0.0063  0.0273  901  GLY   A C   
3178 O  O   . GLY   A 211 ? 0.3013 0.3875 0.3769 0.0249  0.0006  0.0324  901  GLY   A O   
3182 N  N   . VAL   A 212 ? 0.2774 0.3833 0.3788 0.0252  0.0113  0.0268  902  VAL   A N   
3183 C  CA  . VAL   A 212 ? 0.288  0.3949 0.3743 0.0409  0.0119  0.0326  902  VAL   A CA  
3184 C  C   . VAL   A 212 ? 0.3174 0.3829 0.3752 0.05    0.0073  0.0385  902  VAL   A C   
3185 O  O   . VAL   A 212 ? 0.3384 0.3866 0.3685 0.064   0.0043  0.0434  902  VAL   A O   
3186 C  CB  . VAL   A 212 ? 0.2825 0.4171 0.3837 0.0416  0.0192  0.0324  902  VAL   A CB  
3187 C  CG1 . VAL   A 212 ? 0.2914 0.432  0.3766 0.063   0.0217  0.0403  902  VAL   A CG1 
3188 C  CG2 . VAL   A 212 ? 0.2686 0.4409 0.3899 0.0283  0.0211  0.0274  902  VAL   A CG2 
3198 N  N   . THR   A 213 ? 0.3208 0.3666 0.3804 0.0421  0.0059  0.0385  903  THR   A N   
3199 C  CA  . THR   A 213 ? 0.3481 0.3531 0.378  0.045   -0.0005 0.0441  903  THR   A CA  
3200 C  C   . THR   A 213 ? 0.3711 0.3545 0.3779 0.0387  -0.0102 0.0477  903  THR   A C   
3201 O  O   . THR   A 213 ? 0.4001 0.3447 0.3674 0.0457  -0.0157 0.0525  903  THR   A O   
3202 C  CB  . THR   A 213 ? 0.3568 0.3548 0.3982 0.0353  -0.0011 0.0444  903  THR   A CB  
3203 O  OG1 . THR   A 213 ? 0.355  0.3705 0.4148 0.0385  0.0078  0.0414  903  THR   A OG1 
3204 C  CG2 . THR   A 213 ? 0.3841 0.3413 0.3927 0.0354  -0.009  0.0506  903  THR   A CG2 
3212 N  N   . VAL   A 214 ? 0.3588 0.3641 0.3852 0.0255  -0.0118 0.0458  904  VAL   A N   
3213 C  CA  . VAL   A 214 ? 0.3756 0.3675 0.3824 0.0157  -0.0205 0.0506  904  VAL   A CA  
3214 C  C   . VAL   A 214 ? 0.3964 0.3753 0.3769 0.0292  -0.0213 0.052   904  VAL   A C   
3215 O  O   . VAL   A 214 ? 0.4261 0.3642 0.3656 0.029   -0.0295 0.0581  904  VAL   A O   
3216 C  CB  . VAL   A 214 ? 0.3592 0.3859 0.3955 0.0014  -0.0193 0.0485  904  VAL   A CB  
3217 C  CG1 . VAL   A 214 ? 0.3716 0.3945 0.3902 -0.008  -0.026  0.0533  904  VAL   A CG1 
3218 C  CG2 . VAL   A 214 ? 0.3549 0.3894 0.4073 -0.0086 -0.0208 0.0512  904  VAL   A CG2 
3228 N  N   . TRP   A 215 ? 0.3817 0.3927 0.3814 0.041   -0.0135 0.0475  905  TRP   A N   
3229 C  CA  . TRP   A 215 ? 0.3992 0.407  0.3772 0.0587  -0.0136 0.0505  905  TRP   A CA  
3230 C  C   . TRP   A 215 ? 0.4388 0.4043 0.3759 0.0795  -0.0142 0.0556  905  TRP   A C   
3231 O  O   . TRP   A 215 ? 0.4656 0.3983 0.3626 0.0926  -0.0185 0.0607  905  TRP   A O   
3232 C  CB  . TRP   A 215 ? 0.3692 0.4291 0.3792 0.0651  -0.0057 0.0463  905  TRP   A CB  
3233 C  CG  . TRP   A 215 ? 0.3757 0.4449 0.3688 0.0851  -0.0058 0.0512  905  TRP   A CG  
3234 C  CD1 . TRP   A 215 ? 0.3844 0.464  0.3729 0.0835  -0.0097 0.0526  905  TRP   A CD1 
3235 C  CD2 . TRP   A 215 ? 0.3796 0.4527 0.3579 0.1123  -0.0011 0.0566  905  TRP   A CD2 
3236 N  NE1 . TRP   A 215 ? 0.391  0.4784 0.3617 0.1089  -0.0088 0.0591  905  TRP   A NE1 
3237 C  CE2 . TRP   A 215 ? 0.3896 0.4757 0.3546 0.1284  -0.0029 0.0618  905  TRP   A CE2 
3238 C  CE3 . TRP   A 215 ? 0.389  0.4573 0.3623 0.1266  0.005   0.0584  905  TRP   A CE3 
3239 C  CZ2 . TRP   A 215 ? 0.3986 0.4962 0.3467 0.1609  0.0016  0.0695  905  TRP   A CZ2 
3240 C  CZ3 . TRP   A 215 ? 0.4024 0.4811 0.3579 0.1578  0.0102  0.0654  905  TRP   A CZ3 
3241 C  CH2 . TRP   A 215 ? 0.4019 0.4975 0.3462 0.176   0.0088  0.0712  905  TRP   A CH2 
3252 N  N   . GLU   A 216 ? 0.4424 0.4048 0.3848 0.0841  -0.0095 0.0544  906  GLU   A N   
3253 C  CA  . GLU   A 216 ? 0.4828 0.4036 0.3838 0.1049  -0.0085 0.0584  906  GLU   A CA  
3254 C  C   . GLU   A 216 ? 0.5352 0.3879 0.3842 0.0968  -0.0201 0.0622  906  GLU   A C   
3255 O  O   . GLU   A 216 ? 0.5753 0.3795 0.372  0.1166  -0.0218 0.0659  906  GLU   A O   
3256 C  CB  . GLU   A 216 ? 0.4971 0.4286 0.4152 0.1058  -0.0018 0.0564  906  GLU   A CB  
3257 C  CG  . GLU   A 216 ? 0.5142 0.5022 0.4674 0.1163  0.0097  0.0554  906  GLU   A CG  
3258 C  CD  . GLU   A 216 ? 0.567  0.5604 0.5324 0.1141  0.0157  0.0548  906  GLU   A CD  
3259 O  OE1 . GLU   A 216 ? 0.5913 0.577  0.5351 0.1357  0.022   0.0586  906  GLU   A OE1 
3260 O  OE2 . GLU   A 216 ? 0.5626 0.5666 0.5561 0.0928  0.0148  0.0509  906  GLU   A OE2 
3267 N  N   . LEU   A 217 ? 0.5363 0.3847 0.3958 0.068   -0.0283 0.0624  907  LEU   A N   
3268 C  CA  . LEU   A 217 ? 0.581  0.3708 0.3921 0.0521  -0.0415 0.0679  907  LEU   A CA  
3269 C  C   . LEU   A 217 ? 0.6123 0.378  0.3919 0.0491  -0.0484 0.0721  907  LEU   A C   
3270 O  O   . LEU   A 217 ? 0.6569 0.3557 0.3733 0.0516  -0.0566 0.0768  907  LEU   A O   
3271 C  CB  . LEU   A 217 ? 0.5683 0.3755 0.4054 0.0215  -0.0482 0.0696  907  LEU   A CB  
3272 C  CG  . LEU   A 217 ? 0.5642 0.3974 0.4356 0.0218  -0.0423 0.0665  907  LEU   A CG  
3273 C  CD1 . LEU   A 217 ? 0.5563 0.4088 0.4499 -0.0045 -0.0497 0.0706  907  LEU   A CD1 
3274 C  CD2 . LEU   A 217 ? 0.5978 0.3879 0.4318 0.0371  -0.0412 0.0667  907  LEU   A CD2 
3286 N  N   . MET   A 218 ? 0.5878 0.4026 0.4054 0.0444  -0.0451 0.0704  908  MET   A N   
3287 C  CA  . MET   A 218 ? 0.6104 0.408  0.4016 0.0406  -0.0513 0.075   908  MET   A CA  
3288 C  C   . MET   A 218 ? 0.6461 0.4108 0.3951 0.074   -0.0485 0.077   908  MET   A C   
3289 O  O   . MET   A 218 ? 0.6763 0.3973 0.379  0.0737  -0.0561 0.0828  908  MET   A O   
3290 C  CB  . MET   A 218 ? 0.5761 0.4372 0.4188 0.0285  -0.0474 0.072   908  MET   A CB  
3291 C  CG  . MET   A 218 ? 0.5686 0.4624 0.4479 0.0006  -0.0492 0.0714  908  MET   A CG  
3292 S  SD  . MET   A 218 ? 0.6173 0.4711 0.4583 -0.0321 -0.0648 0.0826  908  MET   A SD  
3293 C  CE  . MET   A 218 ? 0.5515 0.4692 0.4522 -0.0508 -0.0613 0.0817  908  MET   A CE  
3303 N  N   . THR   A 219 ? 0.6412 0.4278 0.404  0.1032  -0.0375 0.0738  909  THR   A N   
3304 C  CA  . THR   A 219 ? 0.6749 0.4391 0.3996 0.1414  -0.0328 0.0774  909  THR   A CA  
3305 C  C   . THR   A 219 ? 0.7333 0.4292 0.3993 0.1613  -0.0325 0.0789  909  THR   A C   
3306 O  O   . THR   A 219 ? 0.7518 0.4331 0.387  0.1998  -0.0255 0.0818  909  THR   A O   
3307 C  CB  . THR   A 219 ? 0.6452 0.488  0.4224 0.1614  -0.0204 0.0753  909  THR   A CB  
3308 O  OG1 . THR   A 219 ? 0.6323 0.5135 0.4534 0.1518  -0.0137 0.0698  909  THR   A OG1 
3309 C  CG2 . THR   A 219 ? 0.6176 0.5127 0.4322 0.1492  -0.0215 0.0746  909  THR   A CG2 
3317 N  N   . PHE   A 220 ? 0.758  0.415  0.407  0.1369  -0.0399 0.0776  910  PHE   A N   
3318 C  CA  . PHE   A 220 ? 0.8145 0.4012 0.4034 0.1496  -0.0413 0.078   910  PHE   A CA  
3319 C  C   . PHE   A 220 ? 0.8137 0.4272 0.4145 0.1859  -0.026  0.0758  910  PHE   A C   
3320 O  O   . PHE   A 220 ? 0.8553 0.4146 0.3963 0.218   -0.0221 0.0776  910  PHE   A O   
3321 C  CB  . PHE   A 220 ? 0.8751 0.3664 0.3739 0.1589  -0.0508 0.0832  910  PHE   A CB  
3322 C  CG  . PHE   A 220 ? 0.8964 0.3624 0.3805 0.1182  -0.0666 0.0875  910  PHE   A CG  
3323 C  CD1 . PHE   A 220 ? 0.924  0.3552 0.3884 0.0789  -0.0798 0.0893  910  PHE   A CD1 
3324 C  CD2 . PHE   A 220 ? 0.8959 0.3816 0.3894 0.1173  -0.0682 0.0911  910  PHE   A CD2 
3325 C  CE1 . PHE   A 220 ? 0.9394 0.3593 0.3944 0.039   -0.0939 0.0955  910  PHE   A CE1 
3326 C  CE2 . PHE   A 220 ? 0.9137 0.3827 0.3956 0.0783  -0.0817 0.0963  910  PHE   A CE2 
3327 C  CZ  . PHE   A 220 ? 0.928  0.366  0.3911 0.0391  -0.0942 0.099   910  PHE   A CZ  
3337 N  N   . GLY   A 221 ? 0.767  0.4611 0.4406 0.1797  -0.0173 0.0724  911  GLY   A N   
3338 C  CA  . GLY   A 221 ? 0.7572 0.4897 0.4516 0.2052  -0.0031 0.0716  911  GLY   A CA  
3339 C  C   . GLY   A 221 ? 0.7385 0.5298 0.4559 0.2371  0.0087  0.0752  911  GLY   A C   
3340 O  O   . GLY   A 221 ? 0.7398 0.5423 0.4458 0.269   0.0201  0.0782  911  GLY   A O   
3344 N  N   . SER   A 222 ? 0.7173 0.5525 0.4682 0.2285  0.0063  0.076   912  SER   A N   
3345 C  CA  . SER   A 222 ? 0.6982 0.6005 0.4762 0.2544  0.0156  0.0808  912  SER   A CA  
3346 C  C   . SER   A 222 ? 0.6596 0.6422 0.5024 0.2423  0.0245  0.0789  912  SER   A C   
3347 O  O   . SER   A 222 ? 0.6464 0.6372 0.5215 0.209   0.0214  0.0725  912  SER   A O   
3348 C  CB  . SER   A 222 ? 0.7046 0.6258 0.4942 0.246   0.0088  0.0824  912  SER   A CB  
3349 O  OG  . SER   A 222 ? 0.7784 0.6288 0.5033 0.2629  0.0019  0.0868  912  SER   A OG  
3355 N  N   . LYS   A 223 ? 0.6408 0.6825 0.4997 0.2693  0.0354  0.0856  913  LYS   A N   
3356 C  CA  . LYS   A 223 ? 0.6088 0.7266 0.5236 0.2548  0.0432  0.0858  913  LYS   A CA  
3357 C  C   . LYS   A 223 ? 0.58   0.7563 0.5427 0.2284  0.0386  0.0838  913  LYS   A C   
3358 O  O   . LYS   A 223 ? 0.5755 0.7734 0.5342 0.2432  0.0364  0.0889  913  LYS   A O   
3359 C  CB  . LYS   A 223 ? 0.6205 0.7868 0.5335 0.2916  0.0566  0.0962  913  LYS   A CB  
3360 C  CG  . LYS   A 223 ? 0.7093 0.8211 0.576  0.3163  0.0635  0.0969  913  LYS   A CG  
3361 C  CD  . LYS   A 223 ? 0.7546 0.9172 0.6153 0.3594  0.0789  0.1085  913  LYS   A CD  
3362 C  CE  . LYS   A 223 ? 0.8563 0.949  0.6427 0.4082  0.0838  0.1118  913  LYS   A CE  
3363 N  NZ  . LYS   A 223 ? 0.9267 0.941  0.6699 0.4055  0.0842  0.1051  913  LYS   A NZ  
3377 N  N   . PRO   A 224 ? 0.562  0.7585 0.5642 0.1909  0.0366  0.0764  914  PRO   A N   
3378 C  CA  . PRO   A 224 ? 0.5379 0.781  0.576  0.1668  0.0322  0.0733  914  PRO   A CA  
3379 C  C   . PRO   A 224 ? 0.5078 0.8341 0.5739 0.1733  0.0375  0.0818  914  PRO   A C   
3380 O  O   . PRO   A 224 ? 0.4943 0.8551 0.5718 0.179   0.0457  0.0874  914  PRO   A O   
3381 C  CB  . PRO   A 224 ? 0.5405 0.7724 0.6027 0.1308  0.0303  0.0634  914  PRO   A CB  
3382 C  CG  . PRO   A 224 ? 0.5578 0.7612 0.609  0.1354  0.0351  0.0638  914  PRO   A CG  
3383 C  CD  . PRO   A 224 ? 0.5605 0.7352 0.5713 0.1711  0.0383  0.0708  914  PRO   A CD  
3391 N  N   . TYR   A 225 ? 0.4956 0.8572 0.5716 0.1718  0.0323  0.0841  915  TYR   A N   
3392 C  CA  . TYR   A 225 ? 0.4672 0.9158 0.5703 0.1748  0.0346  0.0939  915  TYR   A CA  
3393 C  C   . TYR   A 225 ? 0.4691 0.952  0.5616 0.2154  0.0444  0.1081  915  TYR   A C   
3394 O  O   . TYR   A 225 ? 0.4378 0.9921 0.558  0.2111  0.0505  0.1164  915  TYR   A O   
3395 C  CB  . TYR   A 225 ? 0.4395 0.9328 0.5809 0.1333  0.0344  0.0896  915  TYR   A CB  
3396 C  CG  . TYR   A 225 ? 0.4619 0.9107 0.6079 0.0979  0.0282  0.0745  915  TYR   A CG  
3397 C  CD1 . TYR   A 225 ? 0.4878 0.8924 0.633  0.0823  0.0308  0.0664  915  TYR   A CD1 
3398 C  CD2 . TYR   A 225 ? 0.4686 0.926  0.6203 0.0806  0.0206  0.0692  915  TYR   A CD2 
3399 C  CE1 . TYR   A 225 ? 0.5095 0.878  0.6583 0.0551  0.0266  0.054   915  TYR   A CE1 
3400 C  CE2 . TYR   A 225 ? 0.4915 0.9117 0.6456 0.0521  0.017   0.0558  915  TYR   A CE2 
3401 C  CZ  . TYR   A 225 ? 0.5164 0.893  0.6692 0.041   0.0204  0.0485  915  TYR   A CZ  
3402 O  OH  . TYR   A 225 ? 0.5444 0.8871 0.6982 0.0183  0.0182  0.0365  915  TYR   A OH  
3412 N  N   . ASP   A 226 ? 0.5049 0.9349 0.5533 0.2546  0.0462  0.1114  916  ASP   A N   
3413 C  CA  . ASP   A 226 ? 0.5148 0.9629 0.542  0.3007  0.0572  0.1238  916  ASP   A CA  
3414 C  C   . ASP   A 226 ? 0.4779 1.0266 0.5302 0.3202  0.0604  0.1395  916  ASP   A C   
3415 O  O   . ASP   A 226 ? 0.473  1.0402 0.5289 0.3199  0.0524  0.1419  916  ASP   A O   
3416 C  CB  . ASP   A 226 ? 0.5896 0.9462 0.5532 0.3373  0.0564  0.1229  916  ASP   A CB  
3417 C  CG  . ASP   A 226 ? 0.6638 1.0111 0.5915 0.386   0.0691  0.1319  916  ASP   A CG  
3418 O  OD1 . ASP   A 226 ? 0.6623 1.0272 0.6031 0.3813  0.0778  0.1318  916  ASP   A OD1 
3419 O  OD2 . ASP   A 226 ? 0.7188 1.036  0.6006 0.4302  0.0707  0.1389  916  ASP   A OD2 
3424 N  N   . GLY   A 227 ? 0.4489 1.0672 0.5202 0.3343  0.0717  0.1509  917  GLY   A N   
3425 C  CA  . GLY   A 227 ? 0.4087 1.1391 0.5091 0.351   0.0753  0.169   917  GLY   A CA  
3426 C  C   . GLY   A 227 ? 0.3662 1.1809 0.5218 0.2988  0.0692  0.1705  917  GLY   A C   
3427 O  O   . GLY   A 227 ? 0.3236 1.2443 0.5093 0.3033  0.0728  0.1873  917  GLY   A O   
3431 N  N   . ILE   A 228 ? 0.376  1.1451 0.542  0.2488  0.0597  0.1539  918  ILE   A N   
3432 C  CA  . ILE   A 228 ? 0.3472 1.175  0.5535 0.1958  0.0526  0.1525  918  ILE   A CA  
3433 C  C   . ILE   A 228 ? 0.3419 1.1831 0.5644 0.1699  0.0598  0.1524  918  ILE   A C   
3434 O  O   . ILE   A 228 ? 0.376  1.1384 0.5794 0.1679  0.063   0.1408  918  ILE   A O   
3435 C  CB  . ILE   A 228 ? 0.3749 1.1388 0.5764 0.1602  0.0404  0.1343  918  ILE   A CB  
3436 C  CG1 . ILE   A 228 ? 0.3913 1.1535 0.5791 0.1802  0.0325  0.1365  918  ILE   A CG1 
3437 C  CG2 . ILE   A 228 ? 0.3582 1.1577 0.5889 0.1038  0.0341  0.1293  918  ILE   A CG2 
3438 C  CD1 . ILE   A 228 ? 0.4459 1.1182 0.6117 0.1664  0.0247  0.1195  918  ILE   A CD1 
3450 N  N   . PRO   A 229 ? 0.2988 1.2368 0.5541 0.1473  0.0616  0.1658  919  PRO   A N   
3451 C  CA  . PRO   A 229 ? 0.295  1.2367 0.5605 0.1194  0.068   0.1659  919  PRO   A CA  
3452 C  C   . PRO   A 229 ? 0.3188 1.1953 0.5836 0.0669  0.0593  0.1476  919  PRO   A C   
3453 O  O   . PRO   A 229 ? 0.3228 1.1857 0.5896 0.0421  0.0482  0.1386  919  PRO   A O   
3454 C  CB  . PRO   A 229 ? 0.25   1.319  0.5487 0.1074  0.0706  0.1876  919  PRO   A CB  
3455 C  CG  . PRO   A 229 ? 0.2317 1.3578 0.5435 0.1064  0.0602  0.194   919  PRO   A CG  
3456 C  CD  . PRO   A 229 ? 0.2469 1.2955 0.5298 0.1423  0.0568  0.1826  919  PRO   A CD  
3464 N  N   . ALA   A 230 ? 0.3351 1.1685 0.5933 0.0531  0.0651  0.1424  920  ALA   A N   
3465 C  CA  . ALA   A 230 ? 0.3638 1.1287 0.616  0.0105  0.0589  0.1262  920  ALA   A CA  
3466 C  C   . ALA   A 230 ? 0.3501 1.1516 0.6171 -0.0424 0.0492  0.1256  920  ALA   A C   
3467 O  O   . ALA   A 230 ? 0.376  1.116  0.6317 -0.0695 0.0418  0.1099  920  ALA   A O   
3468 C  CB  . ALA   A 230 ? 0.3804 1.111  0.6245 0.0071  0.0674  0.1259  920  ALA   A CB  
3474 N  N   . SER   A 231 ? 0.3072 1.2081 0.5961 -0.0576 0.0492  0.1432  921  SER   A N   
3475 C  CA  . SER   A 231 ? 0.2967 1.2358 0.5945 -0.1126 0.0382  0.1446  921  SER   A CA  
3476 C  C   . SER   A 231 ? 0.2995 1.2382 0.5954 -0.1189 0.0262  0.1368  921  SER   A C   
3477 O  O   . SER   A 231 ? 0.3103 1.2388 0.5996 -0.1657 0.0158  0.1297  921  SER   A O   
3478 C  CB  . SER   A 231 ? 0.2648 1.3212 0.5877 -0.1279 0.0405  0.1686  921  SER   A CB  
3479 O  OG  . SER   A 231 ? 0.2646 1.3981 0.6041 -0.0785 0.0471  0.1849  921  SER   A OG  
3485 N  N   . GLU   A 232 ? 0.2913 1.2346 0.5873 -0.0727 0.0275  0.1381  922  GLU   A N   
3486 C  CA  . GLU   A 232 ? 0.2902 1.2324 0.5827 -0.0745 0.0168  0.1319  922  GLU   A CA  
3487 C  C   . GLU   A 232 ? 0.3249 1.1582 0.5928 -0.0732 0.0142  0.1091  922  GLU   A C   
3488 O  O   . GLU   A 232 ? 0.3336 1.1578 0.5954 -0.076  0.0061  0.1026  922  GLU   A O   
3489 C  CB  . GLU   A 232 ? 0.3    1.2993 0.6004 -0.0232 0.0196  0.1466  922  GLU   A CB  
3490 C  CG  . GLU   A 232 ? 0.3445 1.3905 0.6506 -0.029  0.0078  0.1503  922  GLU   A CG  
3491 C  CD  . GLU   A 232 ? 0.4138 1.49   0.7179 0.028   0.0108  0.1622  922  GLU   A CD  
3492 O  OE1 . GLU   A 232 ? 0.4157 1.5233 0.7229 0.0686  0.0221  0.1758  922  GLU   A OE1 
3493 O  OE2 . GLU   A 232 ? 0.449  1.5141 0.7443 0.0333  0.0021  0.1582  922  GLU   A OE2 
3500 N  N   . ILE   A 233 ? 0.3412 1.0978 0.5956 -0.0697 0.0208  0.0984  923  ILE   A N   
3501 C  CA  . ILE   A 233 ? 0.3701 1.0345 0.6043 -0.0647 0.0193  0.08    923  ILE   A CA  
3502 C  C   . ILE   A 233 ? 0.3778 1.0071 0.6015 -0.1071 0.0116  0.0656  923  ILE   A C   
3503 O  O   . ILE   A 233 ? 0.3926 0.9884 0.6057 -0.1041 0.0072  0.055   923  ILE   A O   
3504 C  CB  . ILE   A 233 ? 0.3984 1.0002 0.622  -0.0456 0.028   0.0756  923  ILE   A CB  
3505 C  CG1 . ILE   A 233 ? 0.4014 1.0224 0.624  0.0008  0.0357  0.0876  923  ILE   A CG1 
3506 C  CG2 . ILE   A 233 ? 0.4385 0.9546 0.6444 -0.0457 0.026   0.0586  923  ILE   A CG2 
3507 C  CD1 . ILE   A 233 ? 0.4245 1.0297 0.6337 0.0377  0.0335  0.0879  923  ILE   A CD1 
3519 N  N   . SER   A 234 ? 0.3695 1.0031 0.5911 -0.1463 0.0103  0.0653  924  SER   A N   
3520 C  CA  . SER   A 234 ? 0.391  0.9814 0.5922 -0.186  0.0033  0.0512  924  SER   A CA  
3521 C  C   . SER   A 234 ? 0.376  1.0034 0.5763 -0.1994 -0.0068 0.0501  924  SER   A C   
3522 O  O   . SER   A 234 ? 0.4012 0.9771 0.5819 -0.2063 -0.0102 0.035   924  SER   A O   
3523 C  CB  . SER   A 234 ? 0.4113 1.0045 0.6046 -0.2283 0.0022  0.0546  924  SER   A CB  
3524 O  OG  . SER   A 234 ? 0.4045 1.093  0.6185 -0.2438 -0.0008 0.0735  924  SER   A OG  
3530 N  N   . SER   A 235 ? 0.3323 1.0519 0.5536 -0.1998 -0.0111 0.0671  925  SER   A N   
3531 C  CA  . SER   A 235 ? 0.3156 1.0819 0.5383 -0.2108 -0.0218 0.0694  925  SER   A CA  
3532 C  C   . SER   A 235 ? 0.318  1.0606 0.5382 -0.1709 -0.021  0.0641  925  SER   A C   
3533 O  O   . SER   A 235 ? 0.3286 1.0605 0.536  -0.1826 -0.0285 0.0558  925  SER   A O   
3534 C  CB  . SER   A 235 ? 0.288  1.1683 0.5373 -0.216  -0.026  0.0924  925  SER   A CB  
3535 O  OG  . SER   A 235 ? 0.2972 1.2195 0.567  -0.1647 -0.0176 0.1065  925  SER   A OG  
3541 N  N   . ILE   A 236 ? 0.3082 1.0397 0.536  -0.1259 -0.0122 0.0691  926  ILE   A N   
3542 C  CA  . ILE   A 236 ? 0.3181 1.0178 0.5378 -0.089  -0.0113 0.0655  926  ILE   A CA  
3543 C  C   . ILE   A 236 ? 0.3438 0.9574 0.5424 -0.0988 -0.0109 0.0455  926  ILE   A C   
3544 O  O   . ILE   A 236 ? 0.3534 0.9522 0.5418 -0.0938 -0.0152 0.0398  926  ILE   A O   
3545 C  CB  . ILE   A 236 ? 0.3256 1.025  0.5493 -0.0411 -0.0023 0.0762  926  ILE   A CB  
3546 C  CG1 . ILE   A 236 ? 0.3082 1.0882 0.5437 -0.0132 -0.0041 0.0954  926  ILE   A CG1 
3547 C  CG2 . ILE   A 236 ? 0.3648 0.984  0.5687 -0.0152 0.0009  0.0662  926  ILE   A CG2 
3548 C  CD1 . ILE   A 236 ? 0.3187 1.119  0.5573 0.0265  0.0055  0.1087  926  ILE   A CD1 
3560 N  N   . LEU   A 237 ? 0.353  0.9138 0.5444 -0.1118 -0.0055 0.0361  927  LEU   A N   
3561 C  CA  . LEU   A 237 ? 0.3813 0.867  0.5538 -0.1169 -0.0036 0.019   927  LEU   A CA  
3562 C  C   . LEU   A 237 ? 0.3895 0.8652 0.5448 -0.1514 -0.0099 0.0076  927  LEU   A C   
3563 O  O   . LEU   A 237 ? 0.4092 0.843  0.549  -0.1484 -0.0094 -0.0042 927  LEU   A O   
3564 C  CB  . LEU   A 237 ? 0.3991 0.8336 0.5676 -0.1162 0.004   0.0142  927  LEU   A CB  
3565 C  CG  . LEU   A 237 ? 0.4112 0.8399 0.5888 -0.0831 0.0103  0.0228  927  LEU   A CG  
3566 C  CD1 . LEU   A 237 ? 0.4306 0.8199 0.6046 -0.0892 0.0162  0.0199  927  LEU   A CD1 
3567 C  CD2 . LEU   A 237 ? 0.432  0.8288 0.6025 -0.0555 0.0105  0.0202  927  LEU   A CD2 
3579 N  N   . GLU   A 238 ? 0.3725 0.8873 0.5274 -0.185  -0.0159 0.0118  928  GLU   A N   
3580 C  CA  . GLU   A 238 ? 0.3867 0.8898 0.5174 -0.2214 -0.0237 0.0014  928  GLU   A CA  
3581 C  C   . GLU   A 238 ? 0.3679 0.9094 0.5    -0.2155 -0.0313 0.0034  928  GLU   A C   
3582 O  O   . GLU   A 238 ? 0.3895 0.9004 0.4963 -0.2326 -0.0351 -0.0094 928  GLU   A O   
3583 C  CB  . GLU   A 238 ? 0.4071 0.9421 0.5332 -0.2646 -0.0303 0.0074  928  GLU   A CB  
3584 C  CG  . GLU   A 238 ? 0.4972 0.9737 0.6069 -0.28   -0.0244 0.0013  928  GLU   A CG  
3585 C  CD  . GLU   A 238 ? 0.5719 1.0822 0.6788 -0.3218 -0.0299 0.0112  928  GLU   A CD  
3586 O  OE1 . GLU   A 238 ? 0.5567 1.1545 0.6844 -0.3353 -0.0374 0.0269  928  GLU   A OE1 
3587 O  OE2 . GLU   A 238 ? 0.629  1.0799 0.7118 -0.3412 -0.0268 0.0048  928  GLU   A OE2 
3594 N  N   . LYS   A 239 ? 0.3316 0.9346 0.4887 -0.1882 -0.0326 0.0193  929  LYS   A N   
3595 C  CA  . LYS   A 239 ? 0.3164 0.9549 0.474  -0.1771 -0.0397 0.0236  929  LYS   A CA  
3596 C  C   . LYS   A 239 ? 0.3298 0.9131 0.4759 -0.1487 -0.0347 0.0146  929  LYS   A C   
3597 O  O   . LYS   A 239 ? 0.3263 0.9308 0.47   -0.1363 -0.0396 0.0187  929  LYS   A O   
3598 C  CB  . LYS   A 239 ? 0.31   1.031  0.4943 -0.1532 -0.0419 0.0457  929  LYS   A CB  
3599 C  CG  . LYS   A 239 ? 0.3486 1.1311 0.5351 -0.153  -0.0527 0.0551  929  LYS   A CG  
3600 C  CD  . LYS   A 239 ? 0.3711 1.2403 0.5833 -0.1265 -0.0537 0.0787  929  LYS   A CD  
3601 C  CE  . LYS   A 239 ? 0.3992 1.3393 0.6148 -0.1299 -0.066  0.0902  929  LYS   A CE  
3602 N  NZ  . LYS   A 239 ? 0.3922 1.4286 0.6342 -0.1045 -0.0666 0.1153  929  LYS   A NZ  
3616 N  N   . GLY   A 240 ? 0.3388 0.8563 0.4775 -0.1399 -0.0256 0.004   930  GLY   A N   
3617 C  CA  . GLY   A 240 ? 0.3489 0.8207 0.4783 -0.1173 -0.021  -0.0024 930  GLY   A CA  
3618 C  C   . GLY   A 240 ? 0.3322 0.8058 0.472  -0.0812 -0.0181 0.0092  930  GLY   A C   
3619 O  O   . GLY   A 240 ? 0.3495 0.7868 0.4802 -0.0658 -0.0155 0.0062  930  GLY   A O   
3623 N  N   . GLU   A 241 ? 0.3004 0.8142 0.4555 -0.0678 -0.0182 0.023   931  GLU   A N   
3624 C  CA  . GLU   A 241 ? 0.2948 0.8033 0.4506 -0.0315 -0.0152 0.0338  931  GLU   A CA  
3625 C  C   . GLU   A 241 ? 0.2963 0.7503 0.4491 -0.0224 -0.0076 0.0291  931  GLU   A C   
3626 O  O   . GLU   A 241 ? 0.2945 0.7387 0.454  -0.0382 -0.0036 0.024   931  GLU   A O   
3627 C  CB  . GLU   A 241 ? 0.3033 0.8758 0.4732 -0.0161 -0.0161 0.0505  931  GLU   A CB  
3628 C  CG  . GLU   A 241 ? 0.3547 0.9857 0.5264 -0.0108 -0.0242 0.0609  931  GLU   A CG  
3629 C  CD  . GLU   A 241 ? 0.4256 1.1262 0.6123 0.0114  -0.0235 0.0798  931  GLU   A CD  
3630 O  OE1 . GLU   A 241 ? 0.4217 1.1948 0.6233 -0.0049 -0.0299 0.0881  931  GLU   A OE1 
3631 O  OE2 . GLU   A 241 ? 0.4676 1.1521 0.6493 0.045   -0.0165 0.0869  931  GLU   A OE2 
3638 N  N   . ARG   A 242 ? 0.298  0.7156 0.4375 0.0015  -0.0066 0.0319  932  ARG   A N   
3639 C  CA  . ARG   A 242 ? 0.3078 0.6751 0.4415 0.01    -0.0015 0.0292  932  ARG   A CA  
3640 C  C   . ARG   A 242 ? 0.3176 0.6667 0.4342 0.0412  -0.0018 0.04    932  ARG   A C   
3641 O  O   . ARG   A 242 ? 0.3158 0.6858 0.4229 0.0582  -0.0055 0.0489  932  ARG   A O   
3642 C  CB  . ARG   A 242 ? 0.3245 0.65   0.4512 -0.0027 -0.0009 0.0182  932  ARG   A CB  
3643 C  CG  . ARG   A 242 ? 0.3334 0.6597 0.4665 -0.0287 0.0012  0.0058  932  ARG   A CG  
3644 C  CD  . ARG   A 242 ? 0.353  0.667  0.494  -0.038  0.0062  0.0021  932  ARG   A CD  
3645 N  NE  . ARG   A 242 ? 0.3795 0.6779 0.5155 -0.0604 0.0083  -0.0104 932  ARG   A NE  
3646 C  CZ  . ARG   A 242 ? 0.3969 0.7164 0.5297 -0.0827 0.0054  -0.0146 932  ARG   A CZ  
3647 N  NH1 . ARG   A 242 ? 0.3711 0.7416 0.5123 -0.0864 -0.0001 -0.0055 932  ARG   A NH1 
3648 N  NH2 . ARG   A 242 ? 0.4109 0.7004 0.5288 -0.1011 0.0076  -0.0271 932  ARG   A NH2 
3662 N  N   . LEU   A 243 ? 0.3284 0.6348 0.4362 0.0492  0.0015  0.0397  933  LEU   A N   
3663 C  CA  . LEU   A 243 ? 0.347  0.6218 0.428  0.0765  0.0008  0.0485  933  LEU   A CA  
3664 C  C   . LEU   A 243 ? 0.3676 0.6154 0.4236 0.0813  -0.0059 0.0509  933  LEU   A C   
3665 O  O   . LEU   A 243 ? 0.3684 0.6094 0.4294 0.0612  -0.0083 0.0442  933  LEU   A O   
3666 C  CB  . LEU   A 243 ? 0.364  0.5935 0.4368 0.0771  0.0036  0.0462  933  LEU   A CB  
3667 C  CG  . LEU   A 243 ? 0.3697 0.6174 0.4587 0.0774  0.0105  0.0466  933  LEU   A CG  
3668 C  CD1 . LEU   A 243 ? 0.3926 0.597  0.4779 0.0696  0.0119  0.0421  933  LEU   A CD1 
3669 C  CD2 . LEU   A 243 ? 0.3744 0.6404 0.4516 0.1068  0.0143  0.0574  933  LEU   A CD2 
3681 N  N   . PRO   A 244 ? 0.383  0.6151 0.409  0.1082  -0.0085 0.061   934  PRO   A N   
3682 C  CA  . PRO   A 244 ? 0.4021 0.6066 0.4004 0.11    -0.0156 0.0645  934  PRO   A CA  
3683 C  C   . PRO   A 244 ? 0.4335 0.5774 0.4078 0.0968  -0.0197 0.0625  934  PRO   A C   
3684 O  O   . PRO   A 244 ? 0.4428 0.5609 0.4173 0.0914  -0.0177 0.0595  934  PRO   A O   
3685 C  CB  . PRO   A 244 ? 0.4201 0.6213 0.3885 0.1462  -0.0165 0.0767  934  PRO   A CB  
3686 C  CG  . PRO   A 244 ? 0.4278 0.6245 0.3944 0.1646  -0.0096 0.0789  934  PRO   A CG  
3687 C  CD  . PRO   A 244 ? 0.3792 0.6172 0.3911 0.1403  -0.0045 0.0705  934  PRO   A CD  
3695 N  N   . GLN   A 245 ? 0.4469 0.5726 0.4008 0.0894  -0.0261 0.0653  935  GLN   A N   
3696 C  CA  . GLN   A 245 ? 0.4773 0.5539 0.4075 0.0724  -0.0314 0.0664  935  GLN   A CA  
3697 C  C   . GLN   A 245 ? 0.5255 0.5368 0.4045 0.089   -0.036  0.0746  935  GLN   A C   
3698 O  O   . GLN   A 245 ? 0.5492 0.538  0.3918 0.1102  -0.0394 0.0826  935  GLN   A O   
3699 C  CB  . GLN   A 245 ? 0.49   0.5705 0.411  0.0587  -0.0365 0.0688  935  GLN   A CB  
3700 C  CG  . GLN   A 245 ? 0.5393 0.5786 0.4366 0.0369  -0.0424 0.0725  935  GLN   A CG  
3701 C  CD  . GLN   A 245 ? 0.5755 0.6287 0.4698 0.0203  -0.0455 0.0748  935  GLN   A CD  
3702 O  OE1 . GLN   A 245 ? 0.5824 0.6603 0.4779 0.029   -0.0456 0.0755  935  GLN   A OE1 
3703 N  NE2 . GLN   A 245 ? 0.581  0.6226 0.4706 -0.0045 -0.0482 0.0773  935  GLN   A NE2 
3712 N  N   . PRO   A 246 ? 0.5424 0.5175 0.4113 0.0809  -0.0368 0.0734  936  PRO   A N   
3713 C  CA  . PRO   A 246 ? 0.589  0.4919 0.3984 0.0949  -0.0423 0.0806  936  PRO   A CA  
3714 C  C   . PRO   A 246 ? 0.6275 0.4809 0.388  0.0843  -0.0529 0.0887  936  PRO   A C   
3715 O  O   . PRO   A 246 ? 0.6183 0.4887 0.3955 0.0551  -0.0564 0.0884  936  PRO   A O   
3716 C  CB  . PRO   A 246 ? 0.6012 0.4837 0.4151 0.0788  -0.0428 0.0771  936  PRO   A CB  
3717 C  CG  . PRO   A 246 ? 0.5634 0.5103 0.4406 0.0676  -0.0348 0.0684  936  PRO   A CG  
3718 C  CD  . PRO   A 246 ? 0.5182 0.5114 0.4229 0.0597  -0.0334 0.0661  936  PRO   A CD  
3726 N  N   . PRO   A 247 ? 0.6693 0.4608 0.3667 0.1075  -0.0575 0.0967  937  PRO   A N   
3727 C  CA  . PRO   A 247 ? 0.7031 0.4427 0.3494 0.0939  -0.0684 0.1054  937  PRO   A CA  
3728 C  C   . PRO   A 247 ? 0.7178 0.4243 0.3474 0.0511  -0.0782 0.1082  937  PRO   A C   
3729 O  O   . PRO   A 247 ? 0.7304 0.4247 0.3407 0.0299  -0.0855 0.1149  937  PRO   A O   
3730 C  CB  . PRO   A 247 ? 0.762  0.4252 0.3342 0.1293  -0.071  0.1125  937  PRO   A CB  
3731 C  CG  . PRO   A 247 ? 0.7447 0.4491 0.3436 0.1679  -0.0592 0.1089  937  PRO   A CG  
3732 C  CD  . PRO   A 247 ? 0.6813 0.4469 0.3475 0.1493  -0.0524 0.0991  937  PRO   A CD  
3740 N  N   . ILE   A 248 ? 0.7141 0.4091 0.3498 0.0377  -0.0788 0.1049  938  ILE   A N   
3741 C  CA  . ILE   A 248 ? 0.7269 0.4003 0.3497 -0.0041 -0.0891 0.1097  938  ILE   A CA  
3742 C  C   . ILE   A 248 ? 0.6767 0.4309 0.3685 -0.0311 -0.0851 0.1066  938  ILE   A C   
3743 O  O   . ILE   A 248 ? 0.6794 0.4325 0.366  -0.0656 -0.093  0.1135  938  ILE   A O   
3744 C  CB  . ILE   A 248 ? 0.7584 0.3816 0.351  -0.0087 -0.0937 0.1093  938  ILE   A CB  
3745 C  CG1 . ILE   A 248 ? 0.7317 0.4106 0.3852 0.0026  -0.0826 0.0994  938  ILE   A CG1 
3746 C  CG2 . ILE   A 248 ? 0.8216 0.3512 0.3313 0.0183  -0.0979 0.1127  938  ILE   A CG2 
3747 C  CD1 . ILE   A 248 ? 0.7572 0.4149 0.4034 -0.0186 -0.0887 0.1002  938  ILE   A CD1 
3759 N  N   . CYS   A 249 ? 0.6303 0.4534 0.3828 -0.0158 -0.0729 0.0972  939  CYS   A N   
3760 C  CA  . CYS   A 249 ? 0.5884 0.4802 0.3999 -0.0348 -0.0671 0.0925  939  CYS   A CA  
3761 C  C   . CYS   A 249 ? 0.5729 0.4941 0.3919 -0.0474 -0.0673 0.0954  939  CYS   A C   
3762 O  O   . CYS   A 249 ? 0.576  0.5035 0.3903 -0.0299 -0.0649 0.094   939  CYS   A O   
3763 C  CB  . CYS   A 249 ? 0.5637 0.5047 0.4274 -0.0162 -0.0549 0.0806  939  CYS   A CB  
3764 S  SG  . CYS   A 249 ? 0.6065 0.5284 0.4741 -0.0088 -0.0531 0.0772  939  CYS   A SG  
3770 N  N   . THR   A 250 ? 0.5492 0.4989 0.3854 -0.0761 -0.0688 0.0996  940  THR   A N   
3771 C  CA  . THR   A 250 ? 0.5295 0.5181 0.3794 -0.088  -0.0662 0.1015  940  THR   A CA  
3772 C  C   . THR   A 250 ? 0.4861 0.5365 0.392  -0.0741 -0.0526 0.0877  940  THR   A C   
3773 O  O   . THR   A 250 ? 0.4744 0.5348 0.4062 -0.0612 -0.0467 0.0791  940  THR   A O   
3774 C  CB  . THR   A 250 ? 0.5401 0.5422 0.386  -0.123  -0.0719 0.1131  940  THR   A CB  
3775 O  OG1 . THR   A 250 ? 0.5268 0.5659 0.4115 -0.1298 -0.0674 0.1107  940  THR   A OG1 
3776 C  CG2 . THR   A 250 ? 0.5875 0.5226 0.3693 -0.1437 -0.0874 0.1277  940  THR   A CG2 
3784 N  N   . ILE   A 251 ? 0.4639 0.5501 0.3829 -0.0776 -0.0479 0.0855  941  ILE   A N   
3785 C  CA  . ILE   A 251 ? 0.4318 0.5662 0.3926 -0.0672 -0.0361 0.0719  941  ILE   A CA  
3786 C  C   . ILE   A 251 ? 0.4084 0.5713 0.4058 -0.0701 -0.0281 0.0657  941  ILE   A C   
3787 O  O   . ILE   A 251 ? 0.3948 0.5722 0.4168 -0.057  -0.0205 0.0539  941  ILE   A O   
3788 C  CB  . ILE   A 251 ? 0.4263 0.5901 0.3873 -0.0734 -0.0331 0.0712  941  ILE   A CB  
3789 C  CG1 . ILE   A 251 ? 0.4129 0.6131 0.4039 -0.062  -0.023  0.056   941  ILE   A CG1 
3790 C  CG2 . ILE   A 251 ? 0.4231 0.6099 0.3861 -0.0958 -0.0318 0.0793  941  ILE   A CG2 
3791 C  CD1 . ILE   A 251 ? 0.4263 0.6196 0.4217 -0.0432 -0.0236 0.0492  941  ILE   A CD1 
3803 N  N   . ASP   A 252 ? 0.403  0.574  0.4017 -0.0874 -0.0304 0.0748  942  ASP   A N   
3804 C  CA  . ASP   A 252 ? 0.3845 0.5855 0.416  -0.0871 -0.0231 0.0717  942  ASP   A CA  
3805 C  C   . ASP   A 252 ? 0.3828 0.5608 0.4216 -0.0748 -0.0236 0.0666  942  ASP   A C   
3806 O  O   . ASP   A 252 ? 0.3684 0.5665 0.4353 -0.0645 -0.0146 0.0578  942  ASP   A O   
3807 C  CB  . ASP   A 252 ? 0.4101 0.6299 0.4394 -0.1096 -0.0279 0.0868  942  ASP   A CB  
3808 C  CG  . ASP   A 252 ? 0.4699 0.7274 0.5002 -0.1218 -0.024  0.0924  942  ASP   A CG  
3809 O  OD1 . ASP   A 252 ? 0.5007 0.7418 0.5002 -0.1418 -0.0338 0.105   942  ASP   A OD1 
3810 O  OD2 . ASP   A 252 ? 0.4769 0.7766 0.5342 -0.1113 -0.0109 0.0845  942  ASP   A OD2 
3815 N  N   . VAL   A 253 ? 0.396  0.5283 0.4052 -0.0748 -0.0335 0.0721  943  VAL   A N   
3816 C  CA  . VAL   A 253 ? 0.3965 0.5059 0.4084 -0.0632 -0.0338 0.0683  943  VAL   A CA  
3817 C  C   . VAL   A 253 ? 0.3785 0.4922 0.4038 -0.0424 -0.0261 0.0561  943  VAL   A C   
3818 O  O   . VAL   A 253 ? 0.369  0.4914 0.4167 -0.034  -0.0199 0.0489  943  VAL   A O   
3819 C  CB  . VAL   A 253 ? 0.4379 0.4928 0.4065 -0.0689 -0.0462 0.078   943  VAL   A CB  
3820 C  CG1 . VAL   A 253 ? 0.452  0.4836 0.421  -0.0544 -0.0451 0.0735  943  VAL   A CG1 
3821 C  CG2 . VAL   A 253 ? 0.4492 0.5033 0.4039 -0.0968 -0.0557 0.0915  943  VAL   A CG2 
3831 N  N   . TYR   A 254 ? 0.3732 0.4836 0.3841 -0.0356 -0.0271 0.055   944  TYR   A N   
3832 C  CA  . TYR   A 254 ? 0.3602 0.4843 0.384  -0.0196 -0.0215 0.046   944  TYR   A CA  
3833 C  C   . TYR   A 254 ? 0.3307 0.4927 0.3872 -0.0224 -0.0119 0.0346  944  TYR   A C   
3834 O  O   . TYR   A 254 ? 0.323  0.4933 0.3948 -0.0151 -0.007  0.027   944  TYR   A O   
3835 C  CB  . TYR   A 254 ? 0.3681 0.4848 0.3678 -0.011  -0.0261 0.0501  944  TYR   A CB  
3836 C  CG  . TYR   A 254 ? 0.3635 0.5031 0.3767 0.0044  -0.022  0.0442  944  TYR   A CG  
3837 C  CD1 . TYR   A 254 ? 0.3733 0.5069 0.3905 0.0183  -0.0197 0.0434  944  TYR   A CD1 
3838 C  CD2 . TYR   A 254 ? 0.3603 0.5314 0.3812 0.0033  -0.0208 0.0406  944  TYR   A CD2 
3839 C  CE1 . TYR   A 254 ? 0.3678 0.5325 0.3997 0.0291  -0.0162 0.0403  944  TYR   A CE1 
3840 C  CE2 . TYR   A 254 ? 0.3567 0.556  0.3902 0.0131  -0.0187 0.0372  944  TYR   A CE2 
3841 C  CZ  . TYR   A 254 ? 0.3658 0.564  0.4051 0.026   -0.0166 0.0381  944  TYR   A CZ  
3842 O  OH  . TYR   A 254 ? 0.368  0.6036 0.4219 0.0327  -0.0148 0.0371  944  TYR   A OH  
3852 N  N   . MET   A 255 ? 0.3155 0.4978 0.3787 -0.0331 -0.0089 0.0339  945  MET   A N   
3853 C  CA  . MET   A 255 ? 0.2978 0.506  0.3826 -0.033  0.0011  0.0223  945  MET   A CA  
3854 C  C   . MET   A 255 ? 0.2892 0.4941 0.3918 -0.0287 0.0068  0.0181  945  MET   A C   
3855 O  O   . MET   A 255 ? 0.2851 0.4947 0.3977 -0.0249 0.0139  0.0072  945  MET   A O   
3856 C  CB  . MET   A 255 ? 0.2988 0.5301 0.3835 -0.0413 0.005   0.0232  945  MET   A CB  
3857 C  CG  . MET   A 255 ? 0.3289 0.5688 0.3986 -0.0449 0.0025  0.0229  945  MET   A CG  
3858 S  SD  . MET   A 255 ? 0.3793 0.6249 0.4493 -0.0388 0.0029  0.0116  945  MET   A SD  
3859 C  CE  . MET   A 255 ? 0.3557 0.6083 0.4418 -0.0383 0.0148  -0.0042 945  MET   A CE  
3869 N  N   . ILE   A 256 ? 0.2867 0.4798 0.3889 -0.0304 0.0027  0.027   946  ILE   A N   
3870 C  CA  . ILE   A 256 ? 0.2826 0.4717 0.4    -0.0249 0.0069  0.0247  946  ILE   A CA  
3871 C  C   . ILE   A 256 ? 0.2838 0.4558 0.4018 -0.0173 0.0078  0.0182  946  ILE   A C   
3872 O  O   . ILE   A 256 ? 0.2808 0.453  0.41   -0.0133 0.0147  0.0099  946  ILE   A O   
3873 C  CB  . ILE   A 256 ? 0.2944 0.4757 0.4082 -0.0309 -0.0003 0.0372  946  ILE   A CB  
3874 C  CG1 . ILE   A 256 ? 0.2951 0.5056 0.4134 -0.0411 -0.0006 0.046   946  ILE   A CG1 
3875 C  CG2 . ILE   A 256 ? 0.2999 0.4731 0.4264 -0.0232 0.0026  0.0355  946  ILE   A CG2 
3876 C  CD1 . ILE   A 256 ? 0.3186 0.5217 0.4242 -0.0561 -0.0121 0.0612  946  ILE   A CD1 
3888 N  N   . MET   A 257 ? 0.2878 0.4445 0.3904 -0.0148 0.0011  0.0229  947  MET   A N   
3889 C  CA  . MET   A 257 ? 0.2876 0.4378 0.391  -0.0066 0.0023  0.0198  947  MET   A CA  
3890 C  C   . MET   A 257 ? 0.2663 0.4381 0.3805 -0.0088 0.0078  0.0099  947  MET   A C   
3891 O  O   . MET   A 257 ? 0.2635 0.4357 0.3869 -0.0091 0.0121  0.0046  947  MET   A O   
3892 C  CB  . MET   A 257 ? 0.3153 0.4494 0.3959 0.0017  -0.0044 0.0276  947  MET   A CB  
3893 C  CG  . MET   A 257 ? 0.3719 0.4722 0.4318 0.0024  -0.0108 0.0364  947  MET   A CG  
3894 S  SD  . MET   A 257 ? 0.4768 0.5458 0.4983 0.0184  -0.0169 0.044   947  MET   A SD  
3895 C  CE  . MET   A 257 ? 0.4847 0.5182 0.4713 0.0047  -0.0278 0.0537  947  MET   A CE  
3905 N  N   A ARG   A 258 ? 0.2557 0.4437 0.3656 -0.0132 0.007   0.0078  948  ARG   A N   
3906 N  N   B ARG   A 258 ? 0.2572 0.4452 0.367  -0.0131 0.0069  0.0079  948  ARG   A N   
3907 C  CA  A ARG   A 258 ? 0.2476 0.4547 0.3622 -0.0191 0.0103  -0.0015 948  ARG   A CA  
3908 C  CA  B ARG   A 258 ? 0.2505 0.4575 0.3652 -0.0191 0.0103  -0.0015 948  ARG   A CA  
3909 C  C   A ARG   A 258 ? 0.2513 0.4529 0.372  -0.0246 0.0182  -0.0121 948  ARG   A C   
3910 C  C   B ARG   A 258 ? 0.2527 0.4537 0.3736 -0.0244 0.0182  -0.012  948  ARG   A C   
3911 O  O   A ARG   A 258 ? 0.254  0.457  0.3743 -0.0315 0.0207  -0.0203 948  ARG   A O   
3912 O  O   B ARG   A 258 ? 0.2554 0.4574 0.3764 -0.0311 0.0208  -0.02   948  ARG   A O   
3913 C  CB  A ARG   A 258 ? 0.2529 0.477  0.3576 -0.0222 0.0067  -0.0005 948  ARG   A CB  
3914 C  CB  B ARG   A 258 ? 0.2598 0.4836 0.3648 -0.0227 0.0071  -0.001  948  ARG   A CB  
3915 C  CG  A ARG   A 258 ? 0.2738 0.5014 0.3666 -0.0131 -0.0009 0.0099  948  ARG   A CG  
3916 C  CG  B ARG   A 258 ? 0.2854 0.5206 0.3817 -0.0156 0.0002  0.0068  948  ARG   A CG  
3917 C  CD  A ARG   A 258 ? 0.2819 0.5293 0.3806 -0.0076 -0.002  0.011   948  ARG   A CD  
3918 C  CD  B ARG   A 258 ? 0.2987 0.5593 0.4037 -0.0174 0.0001  0.004   948  ARG   A CD  
3919 N  NE  A ARG   A 258 ? 0.2836 0.5603 0.3889 -0.0199 -0.0014 0.0036  948  ARG   A NE  
3920 N  NE  B ARG   A 258 ? 0.3111 0.5879 0.4181 -0.0332 0.002   -0.0065 948  ARG   A NE  
3921 C  CZ  A ARG   A 258 ? 0.2833 0.5879 0.3837 -0.0204 -0.0065 0.0066  948  ARG   A CZ  
3922 C  CZ  B ARG   A 258 ? 0.3224 0.5927 0.4338 -0.0451 0.0069  -0.0166 948  ARG   A CZ  
3923 N  NH1 A ARG   A 258 ? 0.2631 0.5919 0.3671 -0.0362 -0.007  -0.0007 948  ARG   A NH1 
3924 N  NH1 B ARG   A 258 ? 0.3171 0.5937 0.4201 -0.0601 0.0074  -0.0263 948  ARG   A NH1 
3925 N  NH2 A ARG   A 258 ? 0.2814 0.5866 0.3687 -0.0055 -0.0118 0.0174  948  ARG   A NH2 
3926 N  NH2 B ARG   A 258 ? 0.3103 0.5622 0.429  -0.0427 0.0108  -0.017  948  ARG   A NH2 
3953 N  N   . LYS   A 259 ? 0.2525 0.4471 0.3757 -0.0214 0.0219  -0.0111 949  LYS   A N   
3954 C  CA  . LYS   A 259 ? 0.2585 0.4439 0.3831 -0.0194 0.0307  -0.02   949  LYS   A CA  
3955 C  C   . LYS   A 259 ? 0.2591 0.4237 0.3881 -0.0167 0.0324  -0.0211 949  LYS   A C   
3956 O  O   . LYS   A 259 ? 0.2657 0.4139 0.3879 -0.0182 0.0382  -0.0305 949  LYS   A O   
3957 C  CB  . LYS   A 259 ? 0.2835 0.4785 0.4118 -0.0131 0.0348  -0.0158 949  LYS   A CB  
3958 C  CG  . LYS   A 259 ? 0.3368 0.5517 0.4575 -0.0166 0.0367  -0.0175 949  LYS   A CG  
3959 C  CD  . LYS   A 259 ? 0.3832 0.6196 0.51   -0.0137 0.0387  -0.0078 949  LYS   A CD  
3960 C  CE  . LYS   A 259 ? 0.4255 0.6829 0.5433 -0.0175 0.042   -0.0095 949  LYS   A CE  
3961 N  NZ  . LYS   A 259 ? 0.4436 0.7306 0.5686 -0.0173 0.0444  0.0022  949  LYS   A NZ  
3976 N  N   . CYS   A 260 ? 0.2562 0.4167 0.3911 -0.0137 0.0272  -0.0119 950  CYS   A N   
3977 C  CA  . CYS   A 260 ? 0.2642 0.4074 0.4021 -0.012  0.0284  -0.0115 950  CYS   A CA  
3978 C  C   . CYS   A 260 ? 0.2703 0.4162 0.4052 -0.0213 0.0285  -0.0166 950  CYS   A C   
3979 O  O   . CYS   A 260 ? 0.2778 0.4085 0.412  -0.0241 0.0311  -0.0182 950  CYS   A O   
3980 C  CB  . CYS   A 260 ? 0.2677 0.4053 0.4073 -0.0065 0.0226  -0.0004 950  CYS   A CB  
3981 S  SG  . CYS   A 260 ? 0.2881 0.4253 0.4307 -0.0025 0.0201  0.0083  950  CYS   A SG  
3987 N  N   . TRP   A 261 ? 0.2658 0.4341 0.3985 -0.0271 0.0249  -0.0171 951  TRP   A N   
3988 C  CA  . TRP   A 261 ? 0.269  0.4532 0.4013 -0.0383 0.0235  -0.019  951  TRP   A CA  
3989 C  C   . TRP   A 261 ? 0.2907 0.479  0.4123 -0.0535 0.0242  -0.0295 951  TRP   A C   
3990 O  O   . TRP   A 261 ? 0.2852 0.5003 0.4067 -0.0645 0.0198  -0.0285 951  TRP   A O   
3991 C  CB  . TRP   A 261 ? 0.2489 0.4612 0.3853 -0.0313 0.018   -0.0091 951  TRP   A CB  
3992 C  CG  . TRP   A 261 ? 0.2495 0.4495 0.3858 -0.0154 0.0167  0.0003  951  TRP   A CG  
3993 C  CD1 . TRP   A 261 ? 0.263  0.4424 0.4012 -0.0115 0.0192  0.0025  951  TRP   A CD1 
3994 C  CD2 . TRP   A 261 ? 0.2489 0.4516 0.3765 -0.002  0.0118  0.0089  951  TRP   A CD2 
3995 N  NE1 . TRP   A 261 ? 0.2716 0.4402 0.4019 0.0023  0.016   0.0111  951  TRP   A NE1 
3996 C  CE2 . TRP   A 261 ? 0.2667 0.4457 0.388  0.0086  0.0115  0.015   951  TRP   A CE2 
3997 C  CE3 . TRP   A 261 ? 0.2513 0.4685 0.3706 0.0021  0.0073  0.0122  951  TRP   A CE3 
3998 C  CZ2 . TRP   A 261 ? 0.2831 0.4469 0.3856 0.0224  0.0068  0.0234  951  TRP   A CZ2 
3999 C  CZ3 . TRP   A 261 ? 0.2721 0.4744 0.3741 0.0172  0.0029  0.0214  951  TRP   A CZ3 
4000 C  CH2 . TRP   A 261 ? 0.2856 0.4587 0.3773 0.0268  0.0027  0.0265  951  TRP   A CH2 
4011 N  N   . MET   A 262 ? 0.3138 0.4767 0.424  -0.0536 0.0297  -0.0388 952  MET   A N   
4012 C  CA  . MET   A 262 ? 0.3395 0.4957 0.4304 -0.0678 0.0308  -0.0504 952  MET   A CA  
4013 C  C   . MET   A 262 ? 0.3709 0.5058 0.4477 -0.0861 0.031   -0.056  952  MET   A C   
4014 O  O   . MET   A 262 ? 0.3798 0.4948 0.4594 -0.0832 0.0335  -0.0531 952  MET   A O   
4015 C  CB  . MET   A 262 ? 0.3583 0.4926 0.4362 -0.0572 0.0384  -0.0583 952  MET   A CB  
4016 C  CG  . MET   A 262 ? 0.3718 0.5322 0.4582 -0.0478 0.0374  -0.0532 952  MET   A CG  
4017 S  SD  . MET   A 262 ? 0.4429 0.5911 0.523  -0.0305 0.0481  -0.057  952  MET   A SD  
4018 C  CE  . MET   A 262 ? 0.4394 0.5722 0.4869 -0.0393 0.0529  -0.073  952  MET   A CE  
4028 N  N   . ILE   A 263 ? 0.3854 0.5228 0.4436 -0.1076 0.0274  -0.0632 953  ILE   A N   
4029 C  CA  . ILE   A 263 ? 0.4154 0.5312 0.4539 -0.1326 0.0255  -0.0676 953  ILE   A CA  
4030 C  C   . ILE   A 263 ? 0.4567 0.5079 0.4682 -0.127  0.0337  -0.077  953  ILE   A C   
4031 O  O   . ILE   A 263 ? 0.4693 0.4981 0.4769 -0.133  0.0345  -0.0742 953  ILE   A O   
4032 C  CB  . ILE   A 263 ? 0.4262 0.5563 0.4444 -0.161  0.0181  -0.0735 953  ILE   A CB  
4033 C  CG1 . ILE   A 263 ? 0.4062 0.607  0.4519 -0.165  0.0093  -0.0613 953  ILE   A CG1 
4034 C  CG2 . ILE   A 263 ? 0.4561 0.5502 0.4421 -0.1926 0.0155  -0.0796 953  ILE   A CG2 
4035 C  CD1 . ILE   A 263 ? 0.3996 0.642  0.4689 -0.1722 0.0051  -0.0472 953  ILE   A CD1 
4047 N  N   . ASP   A 264 ? 0.4782 0.5012 0.4705 -0.1125 0.0404  -0.0869 954  ASP   A N   
4048 C  CA  . ASP   A 264 ? 0.5178 0.4808 0.482  -0.099  0.0497  -0.0949 954  ASP   A CA  
4049 C  C   . ASP   A 264 ? 0.5106 0.4813 0.5039 -0.0725 0.0541  -0.0846 954  ASP   A C   
4050 O  O   . ASP   A 264 ? 0.4936 0.4973 0.5119 -0.0541 0.0557  -0.0787 954  ASP   A O   
4051 C  CB  . ASP   A 264 ? 0.5598 0.4993 0.4953 -0.0866 0.057   -0.1071 954  ASP   A CB  
4052 C  CG  . ASP   A 264 ? 0.6572 0.5325 0.557  -0.0669 0.0681  -0.1156 954  ASP   A CG  
4053 O  OD1 . ASP   A 264 ? 0.6923 0.5185 0.5651 -0.0784 0.0674  -0.1184 954  ASP   A OD1 
4054 O  OD2 . ASP   A 264 ? 0.6885 0.5635 0.5852 -0.0392 0.0778  -0.1184 954  ASP   A OD2 
4059 N  N   . ALA   A 265 ? 0.5218 0.4632 0.5103 -0.0739 0.055   -0.0812 955  ALA   A N   
4060 C  CA  . ALA   A 265 ? 0.5173 0.4645 0.5304 -0.052  0.0576  -0.0708 955  ALA   A CA  
4061 C  C   . ALA   A 265 ? 0.5264 0.4609 0.5367 -0.0215 0.0665  -0.0721 955  ALA   A C   
4062 O  O   . ALA   A 265 ? 0.5065 0.47   0.5456 -0.0049 0.0664  -0.0617 955  ALA   A O   
4063 C  CB  . ALA   A 265 ? 0.5346 0.4484 0.5364 -0.0616 0.0569  -0.0677 955  ALA   A CB  
4069 N  N   . ASP   A 266 ? 0.554  0.4463 0.5273 -0.0138 0.0741  -0.0839 956  ASP   A N   
4070 C  CA  . ASP   A 266 ? 0.5646 0.4515 0.5342 0.0194  0.0845  -0.0841 956  ASP   A CA  
4071 C  C   . ASP   A 266 ? 0.5359 0.4779 0.5304 0.028   0.0856  -0.0809 956  ASP   A C   
4072 O  O   . ASP   A 266 ? 0.5238 0.4907 0.5357 0.0522  0.091   -0.0732 956  ASP   A O   
4073 C  CB  . ASP   A 266 ? 0.6325 0.4513 0.5471 0.029   0.0938  -0.098  956  ASP   A CB  
4074 C  CG  . ASP   A 266 ? 0.7283 0.4832 0.6102 0.019   0.0925  -0.1003 956  ASP   A CG  
4075 O  OD1 . ASP   A 266 ? 0.7232 0.4915 0.6307 0.0133  0.087   -0.0892 956  ASP   A OD1 
4076 O  OD2 . ASP   A 266 ? 0.8009 0.4882 0.627  0.0158  0.0969  -0.113  956  ASP   A OD2 
4081 N  N   . SER   A 267 ? 0.5229 0.4873 0.519  0.0071  0.0797  -0.0849 957  SER   A N   
4082 C  CA  . SER   A 267 ? 0.4996 0.5139 0.5167 0.0113  0.0792  -0.0806 957  SER   A CA  
4083 C  C   . SER   A 267 ? 0.4648 0.5248 0.5231 0.0113  0.0715  -0.0646 957  SER   A C   
4084 O  O   . SER   A 267 ? 0.4497 0.5468 0.5238 0.0167  0.0713  -0.058  957  SER   A O   
4085 C  CB  . SER   A 267 ? 0.5231 0.5446 0.5263 -0.0109 0.074   -0.0888 957  SER   A CB  
4086 O  OG  . SER   A 267 ? 0.5879 0.566  0.5469 -0.0112 0.0809  -0.1041 957  SER   A OG  
4092 N  N   . ARG   A 268 ? 0.4527 0.5069 0.5234 0.0042  0.0652  -0.0581 958  ARG   A N   
4093 C  CA  . ARG   A 268 ? 0.4286 0.5143 0.5286 0.0049  0.058   -0.044  958  ARG   A CA  
4094 C  C   . ARG   A 268 ? 0.4156 0.5141 0.5285 0.0244  0.0619  -0.0351 958  ARG   A C   
4095 O  O   . ARG   A 268 ? 0.4265 0.5049 0.5279 0.0404  0.0705  -0.0388 958  ARG   A O   
4096 C  CB  . ARG   A 268 ? 0.4433 0.5162 0.5482 -0.0041 0.0525  -0.0399 958  ARG   A CB  
4097 C  CG  . ARG   A 268 ? 0.4731 0.551  0.5729 -0.0241 0.0472  -0.0436 958  ARG   A CG  
4098 C  CD  . ARG   A 268 ? 0.509  0.5727 0.6092 -0.0323 0.0451  -0.0403 958  ARG   A CD  
4099 N  NE  . ARG   A 268 ? 0.5387 0.6082 0.6299 -0.0541 0.0417  -0.0444 958  ARG   A NE  
4100 C  CZ  . ARG   A 268 ? 0.5652 0.6241 0.6511 -0.0681 0.0406  -0.0428 958  ARG   A CZ  
4101 N  NH1 . ARG   A 268 ? 0.5575 0.6319 0.6367 -0.0911 0.0365  -0.0446 958  ARG   A NH1 
4102 N  NH2 . ARG   A 268 ? 0.5682 0.6044 0.655  -0.0609 0.0431  -0.0381 958  ARG   A NH2 
4116 N  N   . PRO   A 269 ? 0.3921 0.5224 0.5253 0.0238  0.0554  -0.0223 959  PRO   A N   
4117 C  CA  . PRO   A 269 ? 0.3784 0.528  0.5243 0.0381  0.0576  -0.0117 959  PRO   A CA  
4118 C  C   . PRO   A 269 ? 0.3822 0.5107 0.5304 0.0473  0.0577  -0.0076 959  PRO   A C   
4119 O  O   . PRO   A 269 ? 0.3935 0.4938 0.5351 0.0399  0.0548  -0.0111 959  PRO   A O   
4120 C  CB  . PRO   A 269 ? 0.3715 0.5516 0.5308 0.0266  0.0475  0.0009  959  PRO   A CB  
4121 C  CG  . PRO   A 269 ? 0.381  0.5574 0.5322 0.0126  0.0427  -0.0043 959  PRO   A CG  
4122 C  CD  . PRO   A 269 ? 0.3757 0.523  0.5166 0.0104  0.0453  -0.0156 959  PRO   A CD  
4130 N  N   . LYS   A 270 ? 0.3694 0.516  0.527  0.0638  0.0612  0.0012  960  LYS   A N   
4131 C  CA  . LYS   A 270 ? 0.3744 0.506  0.5347 0.0745  0.0604  0.0078  960  LYS   A CA  
4132 C  C   . LYS   A 270 ? 0.3567 0.5162 0.5352 0.0647  0.0486  0.0235  960  LYS   A C   
4133 O  O   . LYS   A 270 ? 0.3433 0.5352 0.5303 0.0538  0.0432  0.0302  960  LYS   A O   
4134 C  CB  . LYS   A 270 ? 0.3979 0.5322 0.5538 0.1027  0.0716  0.0088  960  LYS   A CB  
4135 C  CG  . LYS   A 270 ? 0.4696 0.5739 0.5987 0.1144  0.0841  -0.007  960  LYS   A CG  
4136 C  CD  . LYS   A 270 ? 0.5564 0.5977 0.6568 0.105   0.0849  -0.0207 960  LYS   A CD  
4137 C  CE  . LYS   A 270 ? 0.6263 0.6342 0.6933 0.1097  0.0947  -0.0369 960  LYS   A CE  
4138 N  NZ  . LYS   A 270 ? 0.649  0.6694 0.716  0.0853  0.0902  -0.0446 960  LYS   A NZ  
4152 N  N   . PHE   A 271 ? 0.3575 0.5008 0.537  0.0666  0.0438  0.0298  961  PHE   A N   
4153 C  CA  . PHE   A 271 ? 0.3507 0.5128 0.5399 0.0555  0.0315  0.044   961  PHE   A CA  
4154 C  C   . PHE   A 271 ? 0.3347 0.5479 0.5402 0.0582  0.0284  0.0589  961  PHE   A C   
4155 O  O   . PHE   A 271 ? 0.3282 0.5611 0.5361 0.0394  0.0176  0.0685  961  PHE   A O   
4156 C  CB  . PHE   A 271 ? 0.357  0.4901 0.5408 0.0566  0.0272  0.0474  961  PHE   A CB  
4157 C  CG  . PHE   A 271 ? 0.3784 0.4736 0.5485 0.0468  0.0272  0.0375  961  PHE   A CG  
4158 C  CD1 . PHE   A 271 ? 0.3884 0.483  0.5537 0.0317  0.0208  0.0366  961  PHE   A CD1 
4159 C  CD2 . PHE   A 271 ? 0.4004 0.4616 0.5603 0.0531  0.0333  0.0312  961  PHE   A CD2 
4160 C  CE1 . PHE   A 271 ? 0.4067 0.4777 0.5622 0.0259  0.0219  0.0297  961  PHE   A CE1 
4161 C  CE2 . PHE   A 271 ? 0.4201 0.4573 0.57   0.0418  0.0333  0.0246  961  PHE   A CE2 
4162 C  CZ  . PHE   A 271 ? 0.4131 0.4601 0.5632 0.0295  0.028   0.0244  961  PHE   A CZ  
4172 N  N   . ARG   A 272 ? 0.3285 0.563  0.5414 0.081   0.0386  0.0607  962  ARG   A N   
4173 C  CA  . ARG   A 272 ? 0.3081 0.6055 0.5403 0.0872  0.0381  0.0768  962  ARG   A CA  
4174 C  C   . ARG   A 272 ? 0.2947 0.6244 0.5305 0.0748  0.0394  0.0764  962  ARG   A C   
4175 O  O   . ARG   A 272 ? 0.2746 0.6568 0.5247 0.0639  0.0331  0.0924  962  ARG   A O   
4176 C  CB  . ARG   A 272 ? 0.3297 0.6354 0.5637 0.1226  0.0519  0.0769  962  ARG   A CB  
4177 C  CG  . ARG   A 272 ? 0.391  0.6729 0.6082 0.1393  0.0675  0.0599  962  ARG   A CG  
4178 C  CD  . ARG   A 272 ? 0.4489 0.7152 0.6538 0.1775  0.0817  0.0572  962  ARG   A CD  
4179 N  NE  . ARG   A 272 ? 0.5194 0.725  0.7062 0.182   0.0801  0.0516  962  ARG   A NE  
4180 C  CZ  . ARG   A 272 ? 0.5815 0.7217 0.7364 0.1903  0.0886  0.035   962  ARG   A CZ  
4181 N  NH1 . ARG   A 272 ? 0.5979 0.6862 0.7367 0.1884  0.0855  0.0323  962  ARG   A NH1 
4182 N  NH2 . ARG   A 272 ? 0.5939 0.7191 0.7295 0.1979  0.0996  0.0215  962  ARG   A NH2 
4196 N  N   . GLU   A 273 ? 0.3038 0.6044 0.5258 0.0741  0.0465  0.06    963  GLU   A N   
4197 C  CA  . GLU   A 273 ? 0.2993 0.6226 0.5202 0.0627  0.0482  0.0577  963  GLU   A CA  
4198 C  C   . GLU   A 273 ? 0.3039 0.6188 0.5198 0.0324  0.0327  0.0632  963  GLU   A C   
4199 O  O   . GLU   A 273 ? 0.2955 0.6427 0.5139 0.0164  0.0275  0.0726  963  GLU   A O   
4200 C  CB  . GLU   A 273 ? 0.3411 0.6324 0.5446 0.0697  0.059   0.0383  963  GLU   A CB  
4201 C  CG  . GLU   A 273 ? 0.3954 0.6891 0.5924 0.0995  0.0755  0.0315  963  GLU   A CG  
4202 C  CD  . GLU   A 273 ? 0.4918 0.7383 0.6622 0.1036  0.0842  0.0109  963  GLU   A CD  
4203 O  OE1 . GLU   A 273 ? 0.5132 0.7366 0.6758 0.0821  0.0773  0.0029  963  GLU   A OE1 
4204 O  OE2 . GLU   A 273 ? 0.5298 0.7617 0.6841 0.1289  0.0976  0.0033  963  GLU   A OE2 
4211 N  N   . LEU   A 274 ? 0.3183 0.5874 0.5229 0.0256  0.0261  0.0575  964  LEU   A N   
4212 C  CA  . LEU   A 274 ? 0.3306 0.581  0.5224 0.0033  0.0127  0.0617  964  LEU   A CA  
4213 C  C   . LEU   A 274 ? 0.3291 0.6002 0.5227 -0.0117 -0.0001 0.0799  964  LEU   A C   
4214 O  O   . LEU   A 274 ? 0.3406 0.6039 0.5185 -0.0328 -0.0112 0.0862  964  LEU   A O   
4215 C  CB  . LEU   A 274 ? 0.3511 0.553  0.5301 0.0047  0.0112  0.0521  964  LEU   A CB  
4216 C  CG  . LEU   A 274 ? 0.3757 0.5575 0.5485 0.0101  0.0195  0.0361  964  LEU   A CG  
4217 C  CD1 . LEU   A 274 ? 0.3944 0.5413 0.5604 0.013   0.02    0.0297  964  LEU   A CD1 
4218 C  CD2 . LEU   A 274 ? 0.3853 0.5691 0.5478 -0.0017 0.0155  0.0345  964  LEU   A CD2 
4230 N  N   . ILE   A 275 ? 0.3153 0.6108 0.5242 -0.0019 0.0004  0.089   965  ILE   A N   
4231 C  CA  . ILE   A 275 ? 0.3115 0.6353 0.5232 -0.019  -0.0131 0.108   965  ILE   A CA  
4232 C  C   . ILE   A 275 ? 0.2964 0.6725 0.5155 -0.0345 -0.0152 0.1198  965  ILE   A C   
4233 O  O   . ILE   A 275 ? 0.3019 0.6784 0.5059 -0.0633 -0.0295 0.131   965  ILE   A O   
4234 C  CB  . ILE   A 275 ? 0.3051 0.6532 0.5347 -0.0017 -0.0114 0.1167  965  ILE   A CB  
4235 C  CG1 . ILE   A 275 ? 0.3379 0.6319 0.5556 0.0071  -0.0122 0.1083  965  ILE   A CG1 
4236 C  CG2 . ILE   A 275 ? 0.292  0.6899 0.5295 -0.0218 -0.0256 0.1397  965  ILE   A CG2 
4237 C  CD1 . ILE   A 275 ? 0.3434 0.6492 0.5748 0.0317  -0.0065 0.1127  965  ILE   A CD1 
4249 N  N   . ILE   A 276 ? 0.2797 0.6953 0.5168 -0.0159 -0.0008 0.1172  966  ILE   A N   
4250 C  CA  . ILE   A 276 ? 0.2669 0.7408 0.5136 -0.0274 0.0004  0.1288  966  ILE   A CA  
4251 C  C   . ILE   A 276 ? 0.2884 0.7355 0.5124 -0.0511 -0.0053 0.1243  966  ILE   A C   
4252 O  O   . ILE   A 276 ? 0.2847 0.7544 0.5011 -0.0798 -0.0166 0.1392  966  ILE   A O   
4253 C  CB  . ILE   A 276 ? 0.2543 0.7705 0.5205 0.0052  0.0202  0.1248  966  ILE   A CB  
4254 C  CG1 . ILE   A 276 ? 0.2479 0.8057 0.536  0.0286  0.0242  0.1366  966  ILE   A CG1 
4255 C  CG2 . ILE   A 276 ? 0.2393 0.81   0.5113 -0.0051 0.0247  0.1329  966  ILE   A CG2 
4256 C  CD1 . ILE   A 276 ? 0.2665 0.8226 0.5586 0.0723  0.0448  0.1251  966  ILE   A CD1 
4268 N  N   . GLU   A 277 ? 0.3094 0.7093 0.5206 -0.0403 0.0016  0.1051  967  GLU   A N   
4269 C  CA  . GLU   A 277 ? 0.3338 0.7076 0.5229 -0.0568 -0.0028 0.1004  967  GLU   A CA  
4270 C  C   . GLU   A 277 ? 0.3559 0.6923 0.5177 -0.0834 -0.0209 0.109   967  GLU   A C   
4271 O  O   . GLU   A 277 ? 0.3606 0.7021 0.5055 -0.107  -0.0293 0.1189  967  GLU   A O   
4272 C  CB  . GLU   A 277 ? 0.3846 0.7189 0.567  -0.039  0.0069  0.0794  967  GLU   A CB  
4273 C  CG  . GLU   A 277 ? 0.4728 0.7827 0.6338 -0.0505 0.0033  0.074   967  GLU   A CG  
4274 C  CD  . GLU   A 277 ? 0.5596 0.9034 0.7214 -0.0546 0.0094  0.0752  967  GLU   A CD  
4275 O  OE1 . GLU   A 277 ? 0.5889 0.912  0.735  -0.0574 0.0092  0.0674  967  GLU   A OE1 
4276 O  OE2 . GLU   A 277 ? 0.5729 0.9675 0.751  -0.054  0.0148  0.0847  967  GLU   A OE2 
4283 N  N   . PHE   A 278 ? 0.373  0.6679 0.525  -0.0798 -0.0268 0.1056  968  PHE   A N   
4284 C  CA  . PHE   A 278 ? 0.4067 0.6568 0.5244 -0.1013 -0.0431 0.1124  968  PHE   A CA  
4285 C  C   . PHE   A 278 ? 0.4136 0.6905 0.5268 -0.1284 -0.0569 0.1326  968  PHE   A C   
4286 O  O   . PHE   A 278 ? 0.4386 0.6808 0.5149 -0.1541 -0.0714 0.1405  968  PHE   A O   
4287 C  CB  . PHE   A 278 ? 0.4242 0.6226 0.5296 -0.0878 -0.0439 0.1027  968  PHE   A CB  
4288 C  CG  . PHE   A 278 ? 0.4428 0.6038 0.5358 -0.0735 -0.0376 0.0878  968  PHE   A CG  
4289 C  CD1 . PHE   A 278 ? 0.4751 0.5977 0.5328 -0.0824 -0.0452 0.0887  968  PHE   A CD1 
4290 C  CD2 . PHE   A 278 ? 0.4426 0.6072 0.5563 -0.0516 -0.0247 0.0742  968  PHE   A CD2 
4291 C  CE1 . PHE   A 278 ? 0.4929 0.5915 0.542  -0.0668 -0.0395 0.0774  968  PHE   A CE1 
4292 C  CE2 . PHE   A 278 ? 0.4608 0.601  0.565  -0.0417 -0.0202 0.063   968  PHE   A CE2 
4293 C  CZ  . PHE   A 278 ? 0.4766 0.5891 0.5515 -0.048  -0.0274 0.0651  968  PHE   A CZ  
4303 N  N   . SER   A 279 ? 0.3893 0.7266 0.5358 -0.1235 -0.0533 0.1421  969  SER   A N   
4304 C  CA  . SER   A 279 ? 0.3906 0.7688 0.5373 -0.152  -0.0672 0.1642  969  SER   A CA  
4305 C  C   . SER   A 279 ? 0.395  0.8072 0.5354 -0.1778 -0.0708 0.176   969  SER   A C   
4306 O  O   . SER   A 279 ? 0.4103 0.8159 0.5235 -0.2148 -0.088  0.1913  969  SER   A O   
4307 C  CB  . SER   A 279 ? 0.3711 0.8148 0.558  -0.1349 -0.0609 0.1729  969  SER   A CB  
4308 O  OG  . SER   A 279 ? 0.4072 0.8179 0.5941 -0.1183 -0.0616 0.1664  969  SER   A OG  
4314 N  N   . LYS   A 280 ? 0.3873 0.8306 0.5473 -0.1607 -0.0551 0.1687  970  LYS   A N   
4315 C  CA  . LYS   A 280 ? 0.3948 0.8687 0.5478 -0.1826 -0.0561 0.1784  970  LYS   A CA  
4316 C  C   . LYS   A 280 ? 0.4512 0.8515 0.5534 -0.2079 -0.0698 0.1768  970  LYS   A C   
4317 O  O   . LYS   A 280 ? 0.4606 0.8668 0.539  -0.2443 -0.0827 0.1932  970  LYS   A O   
4318 C  CB  . LYS   A 280 ? 0.4023 0.9064 0.5788 -0.1538 -0.0353 0.166   970  LYS   A CB  
4319 C  CG  . LYS   A 280 ? 0.4507 0.9847 0.6191 -0.1729 -0.0339 0.1739  970  LYS   A CG  
4320 C  CD  . LYS   A 280 ? 0.5068 1.0497 0.6872 -0.1435 -0.0144 0.1571  970  LYS   A CD  
4321 C  CE  . LYS   A 280 ? 0.5922 1.0617 0.7449 -0.1379 -0.0153 0.1388  970  LYS   A CE  
4322 N  NZ  . LYS   A 280 ? 0.6199 1.0961 0.7822 -0.1114 0.002   0.1218  970  LYS   A NZ  
4336 N  N   . MET   A 281 ? 0.4868 0.818  0.57   -0.1886 -0.0673 0.1585  971  MET   A N   
4337 C  CA  . MET   A 281 ? 0.5404 0.797  0.5726 -0.2025 -0.0783 0.156   971  MET   A CA  
4338 C  C   . MET   A 281 ? 0.5846 0.7959 0.5756 -0.2313 -0.0981 0.1679  971  MET   A C   
4339 O  O   . MET   A 281 ? 0.6188 0.7816 0.5606 -0.2559 -0.1107 0.1747  971  MET   A O   
4340 C  CB  . MET   A 281 ? 0.5611 0.7683 0.5886 -0.1703 -0.0692 0.1353  971  MET   A CB  
4341 C  CG  . MET   A 281 ? 0.5593 0.7947 0.6112 -0.1495 -0.0535 0.1234  971  MET   A CG  
4342 S  SD  . MET   A 281 ? 0.5908 0.7786 0.6376 -0.1184 -0.0453 0.1024  971  MET   A SD  
4343 C  CE  . MET   A 281 ? 0.5511 0.7734 0.6133 -0.1097 -0.0331 0.0946  971  MET   A CE  
4353 N  N   . ALA   A 282 ? 0.5854 0.807  0.5906 -0.2287 -0.1016 0.1706  972  ALA   A N   
4354 C  CA  . ALA   A 282 ? 0.6283 0.8084 0.5928 -0.2574 -0.1211 0.1817  972  ALA   A CA  
4355 C  C   . ALA   A 282 ? 0.6343 0.8534 0.5871 -0.3039 -0.1366 0.2055  972  ALA   A C   
4356 O  O   . ALA   A 282 ? 0.6703 0.84   0.5725 -0.3371 -0.1558 0.2154  972  ALA   A O   
4357 C  CB  . ALA   A 282 ? 0.6199 0.8093 0.6068 -0.2414 -0.1199 0.1789  972  ALA   A CB  
4363 N  N   . ARG   A 283 ? 0.5991 0.9062 0.595  -0.3077 -0.1284 0.2153  973  ARG   A N   
4364 C  CA  . ARG   A 283 ? 0.5972 0.9561 0.5871 -0.3535 -0.1419 0.2404  973  ARG   A CA  
4365 C  C   . ARG   A 283 ? 0.6453 0.9523 0.5806 -0.3853 -0.1519 0.2456  973  ARG   A C   
4366 O  O   . ARG   A 283 ? 0.6584 0.9683 0.5614 -0.434  -0.1702 0.2661  973  ARG   A O   
4367 C  CB  . ARG   A 283 ? 0.5542 1.0307 0.6087 -0.3419 -0.1275 0.2502  973  ARG   A CB  
4368 C  CG  . ARG   A 283 ? 0.5556 1.085  0.6568 -0.3151 -0.1209 0.2507  973  ARG   A CG  
4369 C  CD  . ARG   A 283 ? 0.5313 1.1813 0.6855 -0.3118 -0.1121 0.2685  973  ARG   A CD  
4370 N  NE  . ARG   A 283 ? 0.5333 1.2193 0.718  -0.2771 -0.0886 0.2574  973  ARG   A NE  
4371 C  CZ  . ARG   A 283 ? 0.5376 1.2248 0.7511 -0.2274 -0.0688 0.239   973  ARG   A CZ  
4372 N  NH1 . ARG   A 283 ? 0.5382 1.1936 0.7573 -0.2049 -0.0688 0.2297  973  ARG   A NH1 
4373 N  NH2 . ARG   A 283 ? 0.5147 1.23   0.7468 -0.2014 -0.0492 0.2298  973  ARG   A NH2 
4387 N  N   . ASP   A 284 ? 0.6684 0.9293 0.5915 -0.3597 -0.1408 0.2287  974  ASP   A N   
4388 C  CA  . ASP   A 284 ? 0.7173 0.9181 0.5847 -0.3815 -0.1489 0.2317  974  ASP   A CA  
4389 C  C   . ASP   A 284 ? 0.7611 0.8693 0.5964 -0.3467 -0.1444 0.2101  974  ASP   A C   
4390 O  O   . ASP   A 284 ? 0.7554 0.8669 0.6076 -0.317  -0.13   0.197   974  ASP   A O   
4391 C  CB  . ASP   A 284 ? 0.7114 0.9793 0.6091 -0.381  -0.1364 0.236   974  ASP   A CB  
4392 C  CG  . ASP   A 284 ? 0.8124 1.0294 0.6546 -0.4076 -0.1452 0.243   974  ASP   A CG  
4393 O  OD1 . ASP   A 284 ? 0.8763 1.0033 0.6503 -0.4311 -0.1629 0.2471  974  ASP   A OD1 
4394 O  OD2 . ASP   A 284 ? 0.8189 1.0822 0.6811 -0.4045 -0.1343 0.2446  974  ASP   A OD2 
4399 N  N   . PRO   A 285 ? 0.7999 0.8321 0.5924 -0.3468 -0.1553 0.206   975  PRO   A N   
4400 C  CA  . PRO   A 285 ? 0.8335 0.7938 0.6039 -0.3077 -0.1481 0.1866  975  PRO   A CA  
4401 C  C   . PRO   A 285 ? 0.8784 0.7721 0.5981 -0.3015 -0.1492 0.1829  975  PRO   A C   
4402 O  O   . PRO   A 285 ? 0.8795 0.7613 0.6116 -0.2625 -0.1363 0.1676  975  PRO   A O   
4403 C  CB  . PRO   A 285 ? 0.875  0.773  0.605  -0.3141 -0.1606 0.1866  975  PRO   A CB  
4404 C  CG  . PRO   A 285 ? 0.8864 0.7911 0.5885 -0.3667 -0.1802 0.2075  975  PRO   A CG  
4405 C  CD  . PRO   A 285 ? 0.8083 0.8234 0.5731 -0.3803 -0.1737 0.219   975  PRO   A CD  
4413 N  N   . GLN   A 286 ? 0.9131 0.7632 0.5739 -0.3395 -0.1649 0.1976  976  GLN   A N   
4414 C  CA  . GLN   A 286 ? 0.9626 0.7411 0.5667 -0.3327 -0.1672 0.1959  976  GLN   A CA  
4415 C  C   . GLN   A 286 ? 0.9274 0.7686 0.5776 -0.316  -0.1523 0.1919  976  GLN   A C   
4416 O  O   . GLN   A 286 ? 0.9529 0.75   0.5737 -0.296  -0.1493 0.1865  976  GLN   A O   
4417 C  CB  . GLN   A 286 ? 1.0356 0.7454 0.5584 -0.3819 -0.189  0.214   976  GLN   A CB  
4418 C  CG  . GLN   A 286 ? 1.1361 0.755  0.5914 -0.3943 -0.2047 0.2151  976  GLN   A CG  
4419 C  CD  . GLN   A 286 ? 1.2369 0.8053 0.62   -0.4548 -0.2281 0.2353  976  GLN   A CD  
4420 O  OE1 . GLN   A 286 ? 1.2689 0.8325 0.6263 -0.4817 -0.2336 0.2474  976  GLN   A OE1 
4421 N  NE2 . GLN   A 286 ? 1.27   0.7973 0.6147 -0.4807 -0.2435 0.2403  976  GLN   A NE2 
4430 N  N   . ARG   A 287 ? 0.8699 0.8111 0.5888 -0.3203 -0.1423 0.1941  977  ARG   A N   
4431 C  CA  . ARG   A 287 ? 0.8409 0.8391 0.6006 -0.3024 -0.1269 0.1883  977  ARG   A CA  
4432 C  C   . ARG   A 287 ? 0.8306 0.8256 0.6191 -0.2532 -0.1119 0.167   977  ARG   A C   
4433 O  O   . ARG   A 287 ? 0.8337 0.825  0.6194 -0.2363 -0.1053 0.1609  977  ARG   A O   
4434 C  CB  . ARG   A 287 ? 0.8045 0.9077 0.6251 -0.3157 -0.1187 0.196   977  ARG   A CB  
4435 C  CG  . ARG   A 287 ? 0.8087 0.9704 0.6693 -0.2956 -0.1015 0.1885  977  ARG   A CG  
4436 C  CD  . ARG   A 287 ? 0.7989 1.0607 0.7119 -0.3061 -0.0928 0.1978  977  ARG   A CD  
4437 N  NE  . ARG   A 287 ? 0.8138 1.1299 0.7613 -0.2853 -0.0751 0.1897  977  ARG   A NE  
4438 C  CZ  . ARG   A 287 ? 0.8036 1.2073 0.7936 -0.2862 -0.0636 0.1962  977  ARG   A CZ  
4439 N  NH1 . ARG   A 287 ? 0.7778 1.2323 0.7854 -0.3075 -0.0687 0.2128  977  ARG   A NH1 
4440 N  NH2 . ARG   A 287 ? 0.784  1.2257 0.7966 -0.265  -0.0471 0.1867  977  ARG   A NH2 
4454 N  N   . TYR   A 288 ? 0.8171 0.8159 0.6313 -0.2335 -0.1074 0.1573  978  TYR   A N   
4455 C  CA  . TYR   A 288 ? 0.8089 0.8122 0.6529 -0.1919 -0.0935 0.1388  978  TYR   A CA  
4456 C  C   . TYR   A 288 ? 0.8559 0.7854 0.6604 -0.1672 -0.0962 0.1307  978  TYR   A C   
4457 O  O   . TYR   A 288 ? 0.8452 0.7847 0.6709 -0.1362 -0.0853 0.1182  978  TYR   A O   
4458 C  CB  . TYR   A 288 ? 0.767  0.8265 0.6666 -0.1832 -0.0847 0.1334  978  TYR   A CB  
4459 C  CG  . TYR   A 288 ? 0.7302 0.8699 0.6727 -0.1949 -0.0773 0.1394  978  TYR   A CG  
4460 C  CD1 . TYR   A 288 ? 0.7146 0.8956 0.6879 -0.1771 -0.063  0.1299  978  TYR   A CD1 
4461 C  CD2 . TYR   A 288 ? 0.7275 0.9018 0.6745 -0.2249 -0.0854 0.156   978  TYR   A CD2 
4462 C  CE1 . TYR   A 288 ? 0.6897 0.9418 0.6968 -0.1838 -0.0545 0.1353  978  TYR   A CE1 
4463 C  CE2 . TYR   A 288 ? 0.6976 0.9526 0.6835 -0.2321 -0.0771 0.1635  978  TYR   A CE2 
4464 C  CZ  . TYR   A 288 ? 0.6852 0.9768 0.6999 -0.2094 -0.0607 0.1525  978  TYR   A CZ  
4465 O  OH  . TYR   A 288 ? 0.6638 1.0331 0.7124 -0.2122 -0.0508 0.1596  978  TYR   A OH  
4475 N  N   . LEU   A 289 ? 0.9065 0.7639 0.6517 -0.18   -0.11   0.1382  979  LEU   A N   
4476 C  CA  . LEU   A 289 ? 0.958  0.7429 0.6585 -0.1521 -0.1111 0.1317  979  LEU   A CA  
4477 C  C   . LEU   A 289 ? 1.0266 0.7275 0.6448 -0.1684 -0.1258 0.1427  979  LEU   A C   
4478 O  O   . LEU   A 289 ? 1.046  0.7221 0.6305 -0.2065 -0.1396 0.1549  979  LEU   A O   
4479 C  CB  . LEU   A 289 ? 0.9666 0.7316 0.6676 -0.1426 -0.1114 0.1266  979  LEU   A CB  
4480 C  CG  . LEU   A 289 ? 0.9368 0.7701 0.709  -0.1268 -0.0983 0.1165  979  LEU   A CG  
4481 C  CD1 . LEU   A 289 ? 0.9563 0.7626 0.7178 -0.1261 -0.1023 0.1156  979  LEU   A CD1 
4482 C  CD2 . LEU   A 289 ? 0.9262 0.7836 0.7292 -0.0906 -0.0837 0.1036  979  LEU   A CD2 
4494 N  N   . VAL   A 290 ? 1.0631 0.7202 0.6462 -0.1403 -0.1234 0.1397  980  VAL   A N   
4495 C  CA  . VAL   A 290 ? 1.1393 0.7065 0.6365 -0.1489 -0.1361 0.1498  980  VAL   A CA  
4496 C  C   . VAL   A 290 ? 1.2068 0.687  0.6429 -0.1188 -0.1382 0.1455  980  VAL   A C   
4497 O  O   . VAL   A 290 ? 1.2064 0.6843 0.646  -0.0748 -0.128  0.138   980  VAL   A O   
4498 C  CB  . VAL   A 290 ? 1.1459 0.7254 0.641  -0.1374 -0.1325 0.152   980  VAL   A CB  
4499 C  CG1 . VAL   A 290 ? 1.2183 0.6993 0.6189 -0.1484 -0.1465 0.1643  980  VAL   A CG1 
4500 C  CG2 . VAL   A 290 ? 1.1    0.7706 0.6579 -0.1624 -0.1275 0.1544  980  VAL   A CG2 
4510 N  N   . ILE   A 291 ? 1.2629 0.6753 0.6426 -0.1428 -0.1512 0.1509  981  ILE   A N   
4511 C  CA  . ILE   A 291 ? 1.3378 0.656  0.6469 -0.1171 -0.154  0.1472  981  ILE   A CA  
4512 C  C   . ILE   A 291 ? 1.431  0.6359 0.6328 -0.1447 -0.1725 0.1591  981  ILE   A C   
4513 O  O   . ILE   A 291 ? 1.4352 0.64   0.6249 -0.1976 -0.1865 0.1699  981  ILE   A O   
4514 C  CB  . ILE   A 291 ? 1.3313 0.664  0.6643 -0.1209 -0.1529 0.1411  981  ILE   A CB  
4515 C  CG1 . ILE   A 291 ? 1.271  0.7136 0.708  -0.1003 -0.1358 0.1306  981  ILE   A CG1 
4516 C  CG2 . ILE   A 291 ? 1.3956 0.6307 0.6527 -0.0899 -0.1536 0.1363  981  ILE   A CG2 
4517 C  CD1 . ILE   A 291 ? 1.2608 0.7405 0.7367 -0.1181 -0.1367 0.1285  981  ILE   A CD1 
4529 N  N   . GLN   A 292 ? 1.5062 0.6153 0.6275 -0.1093 -0.1727 0.1584  982  GLN   A N   
4530 C  CA  . GLN   A 292 ? 1.6087 0.5924 0.6142 -0.1324 -0.1904 0.1691  982  GLN   A CA  
4531 C  C   . GLN   A 292 ? 1.6703 0.5851 0.6185 -0.1665 -0.2049 0.1708  982  GLN   A C   
4532 O  O   . GLN   A 292 ? 1.67   0.5805 0.6256 -0.1414 -0.1981 0.1609  982  GLN   A O   
4533 C  CB  . GLN   A 292 ? 1.6891 0.5813 0.6172 -0.0772 -0.1854 0.1672  982  GLN   A CB  
4534 C  CG  . GLN   A 292 ? 1.7215 0.6458 0.6677 -0.0548 -0.1791 0.1715  982  GLN   A CG  
4535 C  CD  . GLN   A 292 ? 1.8583 0.6624 0.6966 -0.0152 -0.1817 0.176   982  GLN   A CD  
4536 O  OE1 . GLN   A 292 ? 1.9272 0.6526 0.7029 0.0217  -0.1787 0.1708  982  GLN   A OE1 
4537 N  NE2 . GLN   A 292 ? 1.8811 0.6653 0.6907 -0.0195 -0.1867 0.1861  982  GLN   A NE2 
4546 N  N   . GLY   A 293 ? 1.7195 0.5811 0.6082 -0.225  -0.2252 0.1842  983  GLY   A N   
4547 C  CA  . GLY   A 293 ? 1.7823 0.577  0.6095 -0.2677 -0.2429 0.1884  983  GLY   A CA  
4548 C  C   . GLY   A 293 ? 1.7377 0.6355 0.6548 -0.2863 -0.24   0.185   983  GLY   A C   
4549 O  O   . GLY   A 293 ? 1.7624 0.6217 0.6531 -0.2827 -0.2431 0.1791  983  GLY   A O   
4553 N  N   . ASP   A 294 ? 1.6726 0.6991 0.6922 -0.3045 -0.234  0.189   984  ASP   A N   
4554 C  CA  . ASP   A 294 ? 1.6249 0.7579 0.7358 -0.3173 -0.2296 0.1868  984  ASP   A CA  
4555 C  C   . ASP   A 294 ? 1.6596 0.7769 0.7367 -0.3807 -0.2516 0.2003  984  ASP   A C   
4556 O  O   . ASP   A 294 ? 1.6423 0.7882 0.7471 -0.3839 -0.2525 0.1969  984  ASP   A O   
4557 C  CB  . ASP   A 294 ? 1.5639 0.8296 0.7827 -0.3154 -0.2162 0.1877  984  ASP   A CB  
4558 C  CG  . ASP   A 294 ? 1.5452 0.9167 0.8645 -0.2975 -0.2022 0.1789  984  ASP   A CG  
4559 O  OD1 . ASP   A 294 ? 1.5546 0.9182 0.8701 -0.307  -0.2079 0.178   984  ASP   A OD1 
4560 O  OD2 . ASP   A 294 ? 1.5175 0.9752 0.9144 -0.2747 -0.1862 0.1731  984  ASP   A OD2 
4565 N  N   . GLU   A 295 ? 1.7055 0.7808 0.723  -0.4331 -0.2701 0.2168  985  GLU   A N   
4566 C  CA  . GLU   A 295 ? 1.7407 0.8039 0.7212 -0.5008 -0.2937 0.2326  985  GLU   A CA  
4567 C  C   . GLU   A 295 ? 1.8325 0.7658 0.7094 -0.5048 -0.3076 0.2279  985  GLU   A C   
4568 O  O   . GLU   A 295 ? 1.8319 0.7772 0.7046 -0.543  -0.3217 0.2343  985  GLU   A O   
4569 C  CB  . GLU   A 295 ? 1.794  0.84   0.7291 -0.5587 -0.3104 0.2528  985  GLU   A CB  
4570 C  CG  . GLU   A 295 ? 1.7803 0.9613 0.8134 -0.5667 -0.2994 0.261   985  GLU   A CG  
4571 C  CD  . GLU   A 295 ? 1.8823 1.0351 0.8958 -0.5458 -0.2912 0.2603  985  GLU   A CD  
4572 O  OE1 . GLU   A 295 ? 1.8489 1.0761 0.9407 -0.4983 -0.2694 0.249   985  GLU   A OE1 
4573 O  OE2 . GLU   A 295 ? 1.9775 1.0316 0.894  -0.5786 -0.3074 0.2717  985  GLU   A OE2 
4580 N  N   . ARG   A 296 ? 1.9093 0.7204 0.7013 -0.4635 -0.3033 0.2172  986  ARG   A N   
4581 C  CA  . ARG   A 296 ? 2.0057 0.6803 0.6874 -0.4597 -0.3141 0.2111  986  ARG   A CA  
4582 C  C   . ARG   A 296 ? 1.9875 0.6909 0.7124 -0.4161 -0.3004 0.1953  986  ARG   A C   
4583 O  O   . ARG   A 296 ? 2.0469 0.6577 0.6919 -0.4233 -0.311  0.1918  986  ARG   A O   
4584 C  CB  . ARG   A 296 ? 2.1126 0.6471 0.6861 -0.4217 -0.3116 0.2055  986  ARG   A CB  
4585 C  CG  . ARG   A 296 ? 2.2144 0.6734 0.7048 -0.4692 -0.3301 0.2217  986  ARG   A CG  
4586 C  CD  . ARG   A 296 ? 2.2752 0.7111 0.7566 -0.4205 -0.3158 0.2188  986  ARG   A CD  
4587 N  NE  . ARG   A 296 ? 2.3812 0.7071 0.7877 -0.3515 -0.3045 0.2047  986  ARG   A NE  
4588 C  CZ  . ARG   A 296 ? 2.418  0.7324 0.8247 -0.2908 -0.288  0.1994  986  ARG   A CZ  
4589 N  NH1 . ARG   A 296 ? 2.3611 0.7632 0.8381 -0.2916 -0.2812 0.2057  986  ARG   A NH1 
4590 N  NH2 . ARG   A 296 ? 2.4762 0.6951 0.8125 -0.2274 -0.2779 0.1885  986  ARG   A NH2 
4604 N  N   . MET   A 297 ? 1.9099 0.7323 0.7519 -0.3719 -0.2771 0.1858  987  MET   A N   
4605 C  CA  . MET   A 297 ? 1.8928 0.7438 0.7763 -0.33   -0.2629 0.1717  987  MET   A CA  
4606 C  C   . MET   A 297 ? 1.8704 0.7728 0.7863 -0.3711 -0.2748 0.1774  987  MET   A C   
4607 O  O   . MET   A 297 ? 1.8315 0.8109 0.793  -0.4208 -0.286  0.1916  987  MET   A O   
4608 C  CB  . MET   A 297 ? 1.8259 0.7858 0.8199 -0.2764 -0.2363 0.1613  987  MET   A CB  
4609 C  CG  . MET   A 297 ? 1.8758 0.7842 0.8372 -0.2208 -0.2218 0.153   987  MET   A CG  
4610 S  SD  . MET   A 297 ? 1.8344 0.8774 0.9222 -0.1766 -0.1963 0.1455  987  MET   A SD  
4611 C  CE  . MET   A 297 ? 1.8542 0.8159 0.8772 -0.1151 -0.1848 0.1391  987  MET   A CE  
4621 N  N   . HIS   A 298 ? 1.8904 0.7535 0.7822 -0.3482 -0.2719 0.1673  988  HIS   A N   
4622 C  CA  . HIS   A 298 ? 1.8757 0.7782 0.7905 -0.3808 -0.283  0.1718  988  HIS   A CA  
4623 C  C   . HIS   A 298 ? 1.8749 0.7697 0.8017 -0.3305 -0.2673 0.1564  988  HIS   A C   
4624 O  O   . HIS   A 298 ? 1.9324 0.7331 0.7898 -0.2888 -0.2588 0.1451  988  HIS   A O   
4625 C  CB  . HIS   A 298 ? 1.959  0.7604 0.7626 -0.4435 -0.3132 0.1836  988  HIS   A CB  
4626 C  CG  . HIS   A 298 ? 1.9857 0.8021 0.7887 -0.4736 -0.3267 0.1874  988  HIS   A CG  
4627 N  ND1 . HIS   A 298 ? 2.0669 0.7865 0.7942 -0.4534 -0.3279 0.1762  988  HIS   A ND1 
4628 C  CD2 . HIS   A 298 ? 1.9451 0.8645 0.8134 -0.5195 -0.339  0.2018  988  HIS   A CD2 
4629 C  CE1 . HIS   A 298 ? 2.0508 0.8157 0.7998 -0.4896 -0.3417 0.1837  988  HIS   A CE1 
4630 N  NE2 . HIS   A 298 ? 1.981  0.8677 0.8152 -0.5293 -0.349  0.1998  988  HIS   A NE2 
4638 N  N   . LEU   A 299 ? 1.8093 0.8022 0.8205 -0.3337 -0.2634 0.157   989  LEU   A N   
4639 C  CA  . LEU   A 299 ? 1.8058 0.8004 0.8328 -0.2933 -0.2499 0.1447  989  LEU   A CA  
4640 C  C   . LEU   A 299 ? 1.81   0.8092 0.8242 -0.3345 -0.2684 0.1524  989  LEU   A C   
4641 O  O   . LEU   A 299 ? 1.7775 0.8422 0.8278 -0.3837 -0.2838 0.1675  989  LEU   A O   
4642 C  CB  . LEU   A 299 ? 1.7287 0.8421 0.8756 -0.2522 -0.2253 0.1378  989  LEU   A CB  
4643 C  CG  . LEU   A 299 ? 1.7374 0.8588 0.9064 -0.2059 -0.2051 0.1291  989  LEU   A CG  
4644 C  CD1 . LEU   A 299 ? 1.6634 0.911  0.9517 -0.1865 -0.1875 0.1263  989  LEU   A CD1 
4645 C  CD2 . LEU   A 299 ? 1.7904 0.8332 0.9018 -0.1531 -0.1914 0.1164  989  LEU   A CD2 
4657 N  N   . PRO   A 300 ? 1.8448 0.7832 0.8101 -0.3164 -0.2674 0.1439  990  PRO   A N   
4658 C  CA  . PRO   A 300 ? 1.8458 0.7948 0.8014 -0.358  -0.2864 0.1525  990  PRO   A CA  
4659 C  C   . PRO   A 300 ? 1.7613 0.8527 0.8385 -0.3605 -0.2805 0.159   990  PRO   A C   
4660 O  O   . PRO   A 300 ? 1.7263 0.8874 0.8417 -0.4061 -0.2959 0.1751  990  PRO   A O   
4661 C  CB  . PRO   A 300 ? 1.9105 0.7649 0.791  -0.3266 -0.2813 0.1394  990  PRO   A CB  
4662 C  CG  . PRO   A 300 ? 1.954  0.7369 0.7901 -0.2734 -0.2625 0.1261  990  PRO   A CG  
4663 C  CD  . PRO   A 300 ? 1.8787 0.7433 0.797  -0.2576 -0.2489 0.1276  990  PRO   A CD  
4725 N  N   . ILE   A 328 ? 0.8825 0.9435 0.8532 -0.0524 -0.0029 0.0321  1018 ILE   A N   
4726 C  CA  . ILE   A 328 ? 0.8985 0.96   0.8692 -0.0525 -0.0025 0.0331  1018 ILE   A CA  
4727 C  C   . ILE   A 328 ? 0.9098 0.9713 0.8822 -0.0526 -0.0024 0.0335  1018 ILE   A C   
4728 O  O   . ILE   A 328 ? 0.9099 0.9714 0.8829 -0.0524 -0.0021 0.0332  1018 ILE   A O   
4729 C  CB  . ILE   A 328 ? 0.908  0.9702 0.8779 -0.0523 -0.0016 0.0333  1018 ILE   A CB  
4730 C  CG1 . ILE   A 328 ? 0.9231 0.9854 0.8905 -0.0521 -0.0016 0.0331  1018 ILE   A CG1 
4731 C  CG2 . ILE   A 328 ? 0.9137 0.9764 0.8849 -0.0525 -0.0013 0.0344  1018 ILE   A CG2 
4732 C  CD1 . ILE   A 328 ? 0.9405 1.0033 0.9073 -0.0523 -0.0021 0.0342  1018 ILE   A CD1 
4744 N  N   . PRO   A 329 ? 0.9182 0.9799 0.8914 -0.0528 -0.0026 0.0341  1019 PRO   A N   
4745 C  CA  . PRO   A 329 ? 0.9264 0.9881 0.9006 -0.0526 -0.0025 0.0341  1019 PRO   A CA  
4746 C  C   . PRO   A 329 ? 0.9402 1.0022 0.9149 -0.0524 -0.0022 0.034   1019 PRO   A C   
4747 O  O   . PRO   A 329 ? 0.9428 1.0051 0.9177 -0.0526 -0.002  0.0343  1019 PRO   A O   
4748 C  CB  . PRO   A 329 ? 0.9329 0.9946 0.9079 -0.0528 -0.0027 0.0346  1019 PRO   A CB  
4749 C  CG  . PRO   A 329 ? 0.9353 0.9972 0.9101 -0.0531 -0.0031 0.0351  1019 PRO   A CG  
4750 C  CD  . PRO   A 329 ? 0.9132 0.9749 0.8863 -0.0531 -0.0031 0.0347  1019 PRO   A CD  
4758 N  N   . GLN   A 330 ? 0.945  1.007  0.9201 -0.0521 -0.0023 0.0337  1020 GLN   A N   
4759 C  CA  . GLN   A 330 ? 0.9562 1.0184 0.9321 -0.0519 -0.0024 0.0334  1020 GLN   A CA  
4760 C  C   . GLN   A 330 ? 0.9606 1.0227 0.9363 -0.0514 -0.0027 0.0328  1020 GLN   A C   
4761 O  O   . GLN   A 330 ? 0.9619 1.0241 0.9385 -0.0512 -0.0032 0.0323  1020 GLN   A O   
4762 C  CB  . GLN   A 330 ? 0.9808 1.043  0.9568 -0.0518 -0.0023 0.0332  1020 GLN   A CB  
4763 C  CG  . GLN   A 330 ? 1.0287 1.0907 1.004  -0.0517 -0.0023 0.0331  1020 GLN   A CG  
4764 C  CD  . GLN   A 330 ? 1.0878 1.1498 1.0637 -0.0516 -0.0022 0.033   1020 GLN   A CD  
4765 O  OE1 . GLN   A 330 ? 1.1072 1.1693 1.0841 -0.0517 -0.002  0.033   1020 GLN   A OE1 
4766 N  NE2 . GLN   A 330 ? 1.0962 1.1581 1.0721 -0.0515 -0.0022 0.0331  1020 GLN   A NE2 
4775 N  N1  . A1IEZ B .   ? 0.7834 0.4649 0.5107 0.1011  0.0041  0.0777  2001 A1IEZ A N1  
4776 N  N3  . A1IEZ B .   ? 0.7318 0.4789 0.558  0.0597  -0.0037 0.0883  2001 A1IEZ A N3  
4777 C  C4  . A1IEZ B .   ? 0.6932 0.5218 0.541  0.117   0.0367  0.0745  2001 A1IEZ A C4  
4778 C  C5  . A1IEZ B .   ? 0.6878 0.5032 0.5553 0.0857  0.0263  0.0797  2001 A1IEZ A C5  
4779 C  C6  . A1IEZ B .   ? 0.7245 0.489  0.5419 0.0893  0.0159  0.08    2001 A1IEZ A C6  
4780 C  C7  . A1IEZ B .   ? 0.7484 0.4858 0.525  0.107   0.0175  0.0771  2001 A1IEZ A C7  
4781 C  C8  . A1IEZ B .   ? 0.7792 0.4592 0.5187 0.0797  -0.0068 0.0822  2001 A1IEZ A C8  
4782 C  C10 . A1IEZ B .   ? 0.7985 0.441  0.5139 0.0419  -0.0382 0.0913  2001 A1IEZ A C10 
4783 C  C13 . A1IEZ B .   ? 0.8503 0.4194 0.4755 0.0721  -0.0297 0.0823  2001 A1IEZ A C13 
4784 C  C15 . A1IEZ B .   ? 0.7425 0.477  0.5558 0.0573  -0.0043 0.0941  2001 A1IEZ A C15 
4785 C  C17 . A1IEZ B .   ? 0.7799 0.4673 0.5312 0.0625  -0.0039 0.1016  2001 A1IEZ A C17 
4786 C  C20 . A1IEZ B .   ? 0.7264 0.4802 0.5731 0.0461  -0.0078 0.0993  2001 A1IEZ A C20 
4787 C  C21 . A1IEZ B .   ? 0.6827 0.4921 0.6008 0.0433  0.0055  0.0947  2001 A1IEZ A C21 
4788 CL CL  . A1IEZ B .   ? 0.7254 0.4806 0.5894 0.0347  -0.0157 0.1145  2001 A1IEZ A CL  
4789 C  C19 . A1IEZ B .   ? 0.7378 0.4771 0.5697 0.0436  -0.0101 0.1064  2001 A1IEZ A C19 
4790 C  C18 . A1IEZ B .   ? 0.7619 0.4699 0.5478 0.0502  -0.0084 0.1077  2001 A1IEZ A C18 
4791 C  C16 . A1IEZ B .   ? 0.771  0.4706 0.5352 0.067   -0.0019 0.0953  2001 A1IEZ A C16 
4792 O  O2  . A1IEZ B .   ? 0.7019 0.4856 0.5909 0.0403  -0.0085 0.0975  2001 A1IEZ A O2  
4793 C  C14 . A1IEZ B .   ? 0.7444 0.4754 0.5408 0.0749  0.0014  0.0837  2001 A1IEZ A C14 
4794 O  O1  . A1IEZ B .   ? 0.6711 0.5016 0.5661 0.0728  0.0263  0.0823  2001 A1IEZ A O1  
4795 N  N   . A1IEZ B .   ? 0.6739 0.5196 0.5539 0.0976  0.036   0.077   2001 A1IEZ A N   
4796 C  C9  . A1IEZ B .   ? 0.8092 0.4399 0.5034 0.065   -0.0244 0.085   2001 A1IEZ A C9  
4797 F  F   . A1IEZ B .   ? 0.8636 0.4161 0.4599 0.0994  -0.0167 0.0775  2001 A1IEZ A F   
4798 C  C12 . A1IEZ B .   ? 0.881  0.403  0.4619 0.0498  -0.0499 0.0856  2001 A1IEZ A C12 
4799 N  N2  . A1IEZ B .   ? 0.8656 0.4093 0.4731 0.0234  -0.0644 0.0929  2001 A1IEZ A N2  
4800 C  C11 . A1IEZ B .   ? 0.8241 0.4284 0.4989 0.0228  -0.0576 0.0957  2001 A1IEZ A C11 
4801 C  C3  . A1IEZ B .   ? 0.7379 0.5046 0.5221 0.1286  0.0312  0.075   2001 A1IEZ A C3  
4802 C  C2  . A1IEZ B .   ? 0.7632 0.4989 0.514  0.1403  0.0259  0.0716  2001 A1IEZ A C2  
4803 C  C1  . A1IEZ B .   ? 0.8171 0.4792 0.4912 0.1538  0.0207  0.0709  2001 A1IEZ A C1  
4804 O  O   . A1IEZ B .   ? 0.826  0.4905 0.4808 0.1753  0.0348  0.0731  2001 A1IEZ A O   
4805 C  C   . A1IEZ B .   ? 0.8727 0.4676 0.4582 0.1816  0.0296  0.0723  2001 A1IEZ A C   
# 
