data_9GL7
# 
_entry.id   9GL7 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.404 
_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   9GL7         pdb_00009gl7 10.2210/pdb9gl7/pdb 
WWPDB D_1292141240 ?            ?                   
# 
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 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-05-14 ? 
2 'Structure model' 1 1 2025-06-11 ? 
# 
_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.country'                 
2  2 'Structure model' '_citation.journal_abbrev'          
3  2 'Structure model' '_citation.journal_id_CSD'          
4  2 'Structure model' '_citation.journal_id_ISSN'         
5  2 'Structure model' '_citation.page_first'              
6  2 'Structure model' '_citation.page_last'               
7  2 'Structure model' '_citation.pdbx_database_id_DOI'    
8  2 'Structure model' '_citation.pdbx_database_id_PubMed' 
9  2 'Structure model' '_citation.title'                   
10 2 'Structure model' '_citation.year'                    
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9GL7 
_pdbx_database_status.recvd_initial_deposition_date   2024-08-27 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              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            'Clin.Cancer Res.' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           1078-0432 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                OF1 
_citation.page_last                 OF17 
_citation.title                     
;STX-721, a Covalent EGFR/HER2 Exon 20 Inhibitor, Utilizes Exon 20-Mutant Dynamic Protein States and Achieves Unique Mutant Selectivity Across Human Cancer Models.
;
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1158/1078-0432.CCR-24-3833 
_citation.pdbx_database_id_PubMed   40465424 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Pagliarini, R.A.' 1  0009-0000-1541-9478 
primary 'Henderson, J.A.'  2  0000-0001-6675-7944 
primary 'Milgram, B.C.'    3  0009-0008-5824-4645 
primary 'Borrelli, D.R.'   4  0009-0004-2136-4740 
primary 'Brooijmans, N.'   5  0000-0003-3514-4189 
primary 'Hilbert, B.J.'    6  0000-0001-9353-1799 
primary 'Huff, M.R.'       7  0009-0003-9351-5854 
primary 'Ito, T.'          8  0000-0002-7933-5393 
primary 'Kryukov, G.V.'    9  0000-0002-6131-9483 
primary 'Ladd, B.'         10 0009-0007-4322-0360 
primary 'Martin, B.R.'     11 0000-0002-7136-2397 
primary 'Motiwala, H.'     12 0000-0001-5926-3743 
primary 
;O'Hearn, E.
;
13 0009-0003-4113-4259 
primary 'Tsai, C.F.'       14 0000-0002-6514-6911 
primary 'Wang, W.'         15 0000-0003-2591-8582 
primary 'Bellier, J.'      16 0000-0003-4002-1212 
primary 'Boland, L.'       17 0009-0006-7484-3213 
primary 'Clark, S.'        18 0009-0005-3832-235X 
primary 'Hensley, E.'      19 0009-0008-1952-8960 
primary 'Hata, A.N.'       20 0000-0002-6127-318X 
primary 'Kuzmic, P.'       21 0000-0001-5250-8381 
primary 'Guzman-Perez, A.' 22 0009-0007-7187-5559 
primary 'Jackson, E.L.'    23 0000-0002-7100-8021 
primary 'Stuart, D.D.'     24 0000-0002-4666-4000 
# 
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 
'3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-[3-[[(2S)-oxolan-2-yl]methoxy]pyridin-4-yl]-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one' 
468.933   1   ?        ?     ? ?               
3 water       nat water 18.015    106 ?        ?     ? ?               
# 
_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 
'3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-[3-[[(2S)-oxolan-2-yl]methoxy]pyridin-4-yl]-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one' 
A1IMS 
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 
A1IMS non-polymer         . 
'3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-[3-[[(2S)-oxolan-2-yl]methoxy]pyridin-4-yl]-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one' 
? 'C24 H25 Cl N4 O4' 468.933 
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  ?    ?   ?   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  991  SER SER A . n 
A 1 302 PRO 302 992  992  PRO PRO A . n 
A 1 303 THR 303 993  993  THR THR A . n 
A 1 304 ASP 304 994  994  ASP ASP A . n 
A 1 305 SER 305 995  995  SER SER A . n 
A 1 306 ASN 306 996  996  ASN ASN A . n 
A 1 307 PHE 307 997  997  PHE PHE A . n 
A 1 308 TYR 308 998  998  TYR TYR A . n 
A 1 309 ARG 309 999  999  ARG ARG A . n 
A 1 310 ALA 310 1000 1000 ALA ALA 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 ?    ?   ?   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        A1IMS 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1IMS 
_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 A1IMS 1   2001 2001 A1IMS SCN A . 
C 3 HOH   1   2101 18   HOH   HOH A . 
C 3 HOH   2   2102 77   HOH   HOH A . 
C 3 HOH   3   2103 81   HOH   HOH A . 
C 3 HOH   4   2104 71   HOH   HOH A . 
C 3 HOH   5   2105 11   HOH   HOH A . 
C 3 HOH   6   2106 13   HOH   HOH A . 
C 3 HOH   7   2107 9    HOH   HOH A . 
C 3 HOH   8   2108 15   HOH   HOH A . 
C 3 HOH   9   2109 68   HOH   HOH A . 
C 3 HOH   10  2110 28   HOH   HOH A . 
C 3 HOH   11  2111 30   HOH   HOH A . 
C 3 HOH   12  2112 23   HOH   HOH A . 
C 3 HOH   13  2113 64   HOH   HOH A . 
C 3 HOH   14  2114 35   HOH   HOH A . 
C 3 HOH   15  2115 73   HOH   HOH A . 
C 3 HOH   16  2116 33   HOH   HOH A . 
C 3 HOH   17  2117 8    HOH   HOH A . 
C 3 HOH   18  2118 32   HOH   HOH A . 
C 3 HOH   19  2119 2    HOH   HOH A . 
C 3 HOH   20  2120 84   HOH   HOH A . 
C 3 HOH   21  2121 7    HOH   HOH A . 
C 3 HOH   22  2122 4    HOH   HOH A . 
C 3 HOH   23  2123 85   HOH   HOH A . 
C 3 HOH   24  2124 16   HOH   HOH A . 
C 3 HOH   25  2125 83   HOH   HOH A . 
C 3 HOH   26  2126 44   HOH   HOH A . 
C 3 HOH   27  2127 52   HOH   HOH A . 
C 3 HOH   28  2128 10   HOH   HOH A . 
C 3 HOH   29  2129 22   HOH   HOH A . 
C 3 HOH   30  2130 72   HOH   HOH A . 
C 3 HOH   31  2131 59   HOH   HOH A . 
C 3 HOH   32  2132 38   HOH   HOH A . 
C 3 HOH   33  2133 79   HOH   HOH A . 
C 3 HOH   34  2134 92   HOH   HOH A . 
C 3 HOH   35  2135 78   HOH   HOH A . 
C 3 HOH   36  2136 99   HOH   HOH A . 
C 3 HOH   37  2137 42   HOH   HOH A . 
C 3 HOH   38  2138 1    HOH   HOH A . 
C 3 HOH   39  2139 17   HOH   HOH A . 
C 3 HOH   40  2140 87   HOH   HOH A . 
C 3 HOH   41  2141 106  HOH   HOH A . 
C 3 HOH   42  2142 39   HOH   HOH A . 
C 3 HOH   43  2143 46   HOH   HOH A . 
C 3 HOH   44  2144 65   HOH   HOH A . 
C 3 HOH   45  2145 25   HOH   HOH A . 
C 3 HOH   46  2146 70   HOH   HOH A . 
C 3 HOH   47  2147 14   HOH   HOH A . 
C 3 HOH   48  2148 27   HOH   HOH A . 
C 3 HOH   49  2149 96   HOH   HOH A . 
C 3 HOH   50  2150 53   HOH   HOH A . 
C 3 HOH   51  2151 69   HOH   HOH A . 
C 3 HOH   52  2152 97   HOH   HOH A . 
C 3 HOH   53  2153 34   HOH   HOH A . 
C 3 HOH   54  2154 57   HOH   HOH A . 
C 3 HOH   55  2155 43   HOH   HOH A . 
C 3 HOH   56  2156 103  HOH   HOH A . 
C 3 HOH   57  2157 49   HOH   HOH A . 
C 3 HOH   58  2158 55   HOH   HOH A . 
C 3 HOH   59  2159 50   HOH   HOH A . 
C 3 HOH   60  2160 80   HOH   HOH A . 
C 3 HOH   61  2161 29   HOH   HOH A . 
C 3 HOH   62  2162 5    HOH   HOH A . 
C 3 HOH   63  2163 36   HOH   HOH A . 
C 3 HOH   64  2164 31   HOH   HOH A . 
C 3 HOH   65  2165 95   HOH   HOH A . 
C 3 HOH   66  2166 58   HOH   HOH A . 
C 3 HOH   67  2167 88   HOH   HOH A . 
C 3 HOH   68  2168 89   HOH   HOH A . 
C 3 HOH   69  2169 41   HOH   HOH A . 
C 3 HOH   70  2170 37   HOH   HOH A . 
C 3 HOH   71  2171 66   HOH   HOH A . 
C 3 HOH   72  2172 12   HOH   HOH A . 
C 3 HOH   73  2173 3    HOH   HOH A . 
C 3 HOH   74  2174 60   HOH   HOH A . 
C 3 HOH   75  2175 26   HOH   HOH A . 
C 3 HOH   76  2176 100  HOH   HOH A . 
C 3 HOH   77  2177 24   HOH   HOH A . 
C 3 HOH   78  2178 51   HOH   HOH A . 
C 3 HOH   79  2179 21   HOH   HOH A . 
C 3 HOH   80  2180 104  HOH   HOH A . 
C 3 HOH   81  2181 62   HOH   HOH A . 
C 3 HOH   82  2182 75   HOH   HOH A . 
C 3 HOH   83  2183 6    HOH   HOH A . 
C 3 HOH   84  2184 48   HOH   HOH A . 
C 3 HOH   85  2185 47   HOH   HOH A . 
C 3 HOH   86  2186 102  HOH   HOH A . 
C 3 HOH   87  2187 19   HOH   HOH A . 
C 3 HOH   88  2188 94   HOH   HOH A . 
C 3 HOH   89  2189 86   HOH   HOH A . 
C 3 HOH   90  2190 91   HOH   HOH A . 
C 3 HOH   91  2191 76   HOH   HOH A . 
C 3 HOH   92  2192 101  HOH   HOH A . 
C 3 HOH   93  2193 67   HOH   HOH A . 
C 3 HOH   94  2194 93   HOH   HOH A . 
C 3 HOH   95  2195 82   HOH   HOH A . 
C 3 HOH   96  2196 45   HOH   HOH A . 
C 3 HOH   97  2197 61   HOH   HOH A . 
C 3 HOH   98  2198 74   HOH   HOH A . 
C 3 HOH   99  2199 105  HOH   HOH A . 
C 3 HOH   100 2200 54   HOH   HOH A . 
C 3 HOH   101 2201 40   HOH   HOH A . 
C 3 HOH   102 2202 63   HOH   HOH A . 
C 3 HOH   103 2203 56   HOH   HOH A . 
C 3 HOH   104 2204 90   HOH   HOH A . 
C 3 HOH   105 2205 20   HOH   HOH A . 
C 3 HOH   106 2206 98   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 20201211' 1 
? 'data reduction'  ? ? ? ? ? ? ? ? ? ? ? XDS       ? ? ? 'Jun 1, 2017'    2 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? Aimless   ? ? ? 0.7.4            3 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? STARANISO ? ? ? 2.3.54           4 
? phasing           ? ? ? ? ? ? ? ? ? ? ? PHASER    ? ? ? .                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                     9GL7 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     39.744 
_cell.length_a_esd                 ? 
_cell.length_b                     105.781 
_cell.length_b_esd                 ? 
_cell.length_c                     174.454 
_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                         9GL7 
_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                   9GL7 
_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             2.37 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          48.11 
_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              8.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.2 M Magnesium Chloride, 0.1 M TRIS-HCl pH 8.5, 20% w/v PEG 4000' 
_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 PILATUS3 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         2021-02-04 
_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                                       9GL7 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.878 
_reflns.d_resolution_low                               34.222 
_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 through the data processing procedure (rejection of overloaded or too partial reflections, outlier/misfit rejection 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                                     16502 
_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                           82.1 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                4.50 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          6.76 
_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                                0.3233 
_reflns.pdbx_Rpim_I_all                                0.1672 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       74289 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.944 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.2739 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
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 
5.050 34.222 ? 13.20 6359 6359 ? 1649 1649 ? ? ? ? ? ? ? ? ? ? ? 3.86 ? ? ? 0.1367 0.0729 ? 1  ? 0.981 ? ? 96.9 ? 0.1143 ? ? ? ? ? 
? ? ? ? 
3.973 5.050  ? 12.23 6697 6697 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 4.06 ? ? ? 0.2139 0.1162 ? 2  ? 0.935 ? ? 96.8 ? 0.1777 ? ? ? ? ? 
? ? ? ? 
3.460 3.973  ? 10.38 7006 7006 ? 1652 1652 ? ? ? ? ? ? ? ? ? ? ? 4.24 ? ? ? 0.3083 0.1628 ? 3  ? 0.876 ? ? 97.5 ? 0.2593 ? ? ? ? ? 
? ? ? ? 
3.118 3.460  ? 7.83  6307 6307 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 3.82 ? ? ? 0.4271 0.2286 ? 4  ? 0.804 ? ? 91.0 ? 0.3571 ? ? ? ? ? 
? ? ? ? 
2.837 3.117  ? 6.84  7272 7272 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 4.41 ? ? ? 0.4693 0.2334 ? 5  ? 0.789 ? ? 75.4 ? 0.4035 ? ? ? ? ? 
? ? ? ? 
2.627 2.837  ? 5.37  7571 7571 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 4.59 ? ? ? 0.7135 0.3534 ? 6  ? 0.651 ? ? 71.3 ? 0.6141 ? ? ? ? ? 
? ? ? ? 
2.450 2.627  ? 4.09  7777 7777 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 4.71 ? ? ? 1.1120 0.5557 ? 7  ? 0.461 ? ? 72.4 ? 0.9544 ? ? ? ? ? 
? ? ? ? 
2.281 2.450  ? 3.43  7656 7656 ? 1651 1651 ? ? ? ? ? ? ? ? ? ? ? 4.64 ? ? ? 1.2197 0.6179 ? 8  ? 0.301 ? ? 71.1 ? 1.0404 ? ? ? ? ? 
? ? ? ? 
2.117 2.281  ? 2.51  7982 7982 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 4.84 ? ? ? 1.3299 0.6378 ? 9  ? 0.404 ? ? 84.9 ? 1.1580 ? ? ? ? ? 
? ? ? ? 
1.878 2.117  ? 1.77  9662 9662 ? 1650 1650 ? ? ? ? ? ? ? ? ? ? ? 5.86 ? ? ? 1.6575 0.7033 ? 10 ? 0.477 ? ? 76.4 ? 1.4958 ? ? ? ? ? 
? ? ? ? 
# 
_refine.aniso_B[1][1]                            -13.353 
_refine.aniso_B[1][2]                            0 
_refine.aniso_B[1][3]                            0 
_refine.aniso_B[2][2]                            -3.0164 
_refine.aniso_B[2][3]                            0 
_refine.aniso_B[3][3]                            16.3693 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               46.26 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.849 
_refine.correlation_coeff_Fo_to_Fc_free          0.843 
_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                                 9GL7 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.878 
_refine.ls_d_res_low                             34.22 
_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                     16502 
_refine.ls_number_reflns_R_free                  794 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    53.9 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2693 
_refine.ls_R_factor_R_free                       0.2869 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2683 
_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          0.261 
_refine.pdbx_overall_SU_R_Blow_DPI               0.409 
_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                        9GL7 
_refine_analyze.pdbx_refine_id                  'X-RAY DIFFRACTION' 
_refine_analyze.Luzzati_coordinate_error_free   ? 
_refine_analyze.Luzzati_coordinate_error_obs    0.39 
_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                       1.878 
_refine_hist.d_res_low                        34.22 
_refine_hist.number_atoms_solvent             106 
_refine_hist.number_atoms_total               2550 
_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        2411 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         33 
_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 ? 5008 ? t_bond_d                  2  HARMONIC     
'X-RAY DIFFRACTION' ? 0.97  ? 9090 ? t_angle_deg               2  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 1490 ? t_dihedral_angle_d        2  SINUSOIDAL   
'X-RAY DIFFRACTION' ? ?     ? 778  ? t_gen_planes              5  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 2525 ? t_it                      10 HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 321  ? t_chiral_improper_torsion 5  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? ?     ? 4107 ? t_ideal_dist_contact      4  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? 2.88  ? ?    ? t_omega_torsion           ?  ?            
'X-RAY DIFFRACTION' ? 14.6  ? ?    ? t_other_torsion           ?  ?            
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       1.88 
_refine_ls_shell.d_res_low                        1.98 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                424 
_refine_ls_shell.number_reflns_R_free             17 
_refine_ls_shell.number_reflns_R_work             ? 
_refine_ls_shell.percent_reflns_obs               9.35 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.R_factor_all                     ? 
_refine_ls_shell.R_factor_obs                     0.2791 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.R_factor_R_work                  0.2773 
_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                  0.3168 
# 
_struct.entry_id                     9GL7 
_struct.title                        
;EGFR Exon20 insertion mutant NPG bound with (S)-3-((3-chloro-2-methoxyphenyl)amino)-2-(3-((tetrahydrofuran-2-yl)methoxy)pyridin-4-yl)-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one
;
_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        9GL7 
_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              9GL7 
_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 9GL7 MET A 1   ? UNP P00533 ?   ?   'initiating methionine' 694  1  
1 9GL7 ASN A 78  A UNP P00533 ?   ?   insertion               770  2  
1 9GL7 PRO A 79  B UNP P00533 ?   ?   insertion               770  3  
1 9GL7 GLY A 80  C UNP P00533 ?   ?   insertion               770  4  
1 9GL7 ARG A 258 ? UNP P00533 VAL 948 'engineered mutation'   948  5  
1 9GL7 HIS A 333 ? UNP P00533 ?   ?   'expression tag'        1023 6  
1 9GL7 HIS A 334 ? UNP P00533 ?   ?   'expression tag'        1024 7  
1 9GL7 HIS A 335 ? UNP P00533 ?   ?   'expression tag'        1025 8  
1 9GL7 HIS A 336 ? UNP P00533 ?   ?   'expression tag'        1026 9  
1 9GL7 HIS A 337 ? UNP P00533 ?   ?   'expression tag'        1027 10 
1 9GL7 HIS A 338 ? UNP P00533 ?   ?   'expression tag'        1028 11 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 920   ? 
1 MORE         -7    ? 
1 'SSA (A^2)'  14530 ? 
# 
_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 LYS A 116 ? ILE A 119 ? LYS A 806 ILE A 809 5 ? 4  
HELX_P HELX_P5  AA5 GLY A 120 ? ARG A 141 ? GLY A 810 ARG A 831 1 ? 22 
HELX_P HELX_P6  AA6 ALA A 149 ? ARG A 151 ? ALA A 839 ARG A 841 5 ? 3  
HELX_P HELX_P7  AA7 PRO A 187 ? MET A 191 ? PRO A 877 MET A 881 5 ? 5  
HELX_P HELX_P8  AA8 ALA A 192 ? ARG A 199 ? ALA A 882 ARG A 889 1 ? 8  
HELX_P HELX_P9  AA9 THR A 202 ? THR A 219 ? THR A 892 THR A 909 1 ? 18 
HELX_P HELX_P10 AB1 PRO A 229 ? SER A 231 ? PRO A 919 SER A 921 5 ? 3  
HELX_P HELX_P11 AB2 GLU A 232 ? LYS A 239 ? GLU A 922 LYS A 929 1 ? 8  
HELX_P HELX_P12 AB3 THR A 250 ? TRP A 261 ? THR A 940 TRP A 951 1 ? 12 
HELX_P HELX_P13 AB4 ASP A 264 ? ARG A 268 ? ASP A 954 ARG A 958 5 ? 5  
HELX_P HELX_P14 AB5 LYS A 270 ? ASP A 284 ? LYS A 960 ASP A 974 1 ? 15 
HELX_P HELX_P15 AB6 ASP A 284 ? LEU A 289 ? ASP A 974 LEU A 979 1 ? 6  
HELX_P HELX_P16 AB7 GLY A 293 ? MET A 297 ? GLY A 983 MET A 987 5 ? 5  
# 
_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       3.28 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 2 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 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 PHE A 19  ? GLY A 28  ? PHE A 712 GLY A 721 
AA1 2 GLY A 31  ? TRP A 38  ? GLY A 724 TRP A 731 
AA1 3 ILE A 47  ? GLU A 53  ? ILE A 740 GLU A 746 
AA1 4 VAL A 96  ? GLN A 101 ? VAL A 786 GLN A 791 
AA1 5 LEU A 87  ? LEU A 92  ? LEU A 777 LEU A 782 
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 
# 
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 LYS A 23  ? N LYS A 716 O LYS A 35  ? O LYS A 728 
AA1 2 3 N THR A 32  ? N THR A 725 O GLU A 53  ? O GLU A 746 
AA1 3 4 N ALA A 50  ? N ALA A 743 O THR A 100 ? O THR A 790 
AA1 4 5 O GLN A 97  ? O GLN A 787 N CYS A 91  ? N CYS A 781 
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 
# 
_pdbx_entry_details.entry_id                   9GL7 
_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_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 ? ? -96.02  -124.08 
2 1 HIS A 805 ? ? -94.58  30.53   
3 1 ASN A 808 ? ? -140.94 10.95   
4 1 ARG A 836 ? ? 64.53   -6.85   
5 1 ASP A 855 ? ? 64.25   98.42   
# 
_pdbx_refine_tls.id               1 
_pdbx_refine_tls.pdbx_refine_id   'X-RAY DIFFRACTION' 
_pdbx_refine_tls.details          ? 
_pdbx_refine_tls.method           ? 
_pdbx_refine_tls.origin_x         2.1618 
_pdbx_refine_tls.origin_y         14.4604 
_pdbx_refine_tls.origin_z         -19.4314 
_pdbx_refine_tls.T[1][1]          -0.304 
_pdbx_refine_tls.T[1][1]_esd      ? 
_pdbx_refine_tls.T[1][2]          0.0079 
_pdbx_refine_tls.T[1][2]_esd      ? 
_pdbx_refine_tls.T[1][3]          -0.0279 
_pdbx_refine_tls.T[1][3]_esd      ? 
_pdbx_refine_tls.T[2][2]          -0.1146 
_pdbx_refine_tls.T[2][2]_esd      ? 
_pdbx_refine_tls.T[2][3]          0.0177 
_pdbx_refine_tls.T[2][3]_esd      ? 
_pdbx_refine_tls.T[3][3]          0.2949 
_pdbx_refine_tls.T[3][3]_esd      ? 
_pdbx_refine_tls.L[1][1]          0.258 
_pdbx_refine_tls.L[1][1]_esd      ? 
_pdbx_refine_tls.L[1][2]          -0.4042 
_pdbx_refine_tls.L[1][2]_esd      ? 
_pdbx_refine_tls.L[1][3]          0.0796 
_pdbx_refine_tls.L[1][3]_esd      ? 
_pdbx_refine_tls.L[2][2]          0.4722 
_pdbx_refine_tls.L[2][2]_esd      ? 
_pdbx_refine_tls.L[2][3]          -0.1734 
_pdbx_refine_tls.L[2][3]_esd      ? 
_pdbx_refine_tls.L[3][3]          3.1974 
_pdbx_refine_tls.L[3][3]_esd      ? 
_pdbx_refine_tls.S[1][1]          -0.1353 
_pdbx_refine_tls.S[1][1]_esd      ? 
_pdbx_refine_tls.S[1][2]          0.1822 
_pdbx_refine_tls.S[1][2]_esd      ? 
_pdbx_refine_tls.S[1][3]          0.0302 
_pdbx_refine_tls.S[1][3]_esd      ? 
_pdbx_refine_tls.S[2][1]          0.1822 
_pdbx_refine_tls.S[2][1]_esd      ? 
_pdbx_refine_tls.S[2][2]          0.0208 
_pdbx_refine_tls.S[2][2]_esd      ? 
_pdbx_refine_tls.S[2][3]          0.1049 
_pdbx_refine_tls.S[2][3]_esd      ? 
_pdbx_refine_tls.S[3][1]          0.0302 
_pdbx_refine_tls.S[3][1]_esd      ? 
_pdbx_refine_tls.S[3][2]          0.1049 
_pdbx_refine_tls.S[3][2]_esd      ? 
_pdbx_refine_tls.S[3][3]          0.1145 
_pdbx_refine_tls.S[3][3]_esd      ? 
# 
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 702  ? ? ? A 1019 ? ? '{ A|* }' 
2 'X-RAY DIFFRACTION' 1 ? ? A 2001 ? ? ? A 2001 ? ? '{ A|* }' 
# 
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 GLN 701  ? A GLN 8   
9  1 Y 1 A ARG 748  ? A ARG 55  
10 1 Y 1 A GLU 749  ? A GLU 56  
11 1 Y 1 A ALA 750  ? A ALA 57  
12 1 Y 1 A THR 751  ? A THR 58  
13 1 Y 1 A SER 752  ? A SER 59  
14 1 Y 1 A PRO 753  ? A PRO 60  
15 1 Y 1 A LYS 754  ? A LYS 61  
16 1 Y 1 A LEU 1001 ? A LEU 311 
17 1 Y 1 A MET 1002 ? A MET 312 
18 1 Y 1 A ASP 1003 ? A ASP 313 
19 1 Y 1 A GLU 1004 ? A GLU 314 
20 1 Y 1 A GLU 1005 ? A GLU 315 
21 1 Y 1 A ASP 1006 ? A ASP 316 
22 1 Y 1 A MET 1007 ? A MET 317 
23 1 Y 1 A ASP 1008 ? A ASP 318 
24 1 Y 1 A ASP 1009 ? A ASP 319 
25 1 Y 1 A VAL 1010 ? A VAL 320 
26 1 Y 1 A VAL 1011 ? A VAL 321 
27 1 Y 1 A ASP 1012 ? A ASP 322 
28 1 Y 1 A ALA 1013 ? A ALA 323 
29 1 Y 1 A ASP 1014 ? A ASP 324 
30 1 Y 1 A GLN 1020 ? A GLN 330 
31 1 Y 1 A GLN 1021 ? A GLN 331 
32 1 Y 1 A GLY 1022 ? A GLY 332 
33 1 Y 1 A HIS 1023 ? A HIS 333 
34 1 Y 1 A HIS 1024 ? A HIS 334 
35 1 Y 1 A HIS 1025 ? A HIS 335 
36 1 Y 1 A HIS 1026 ? A HIS 336 
37 1 Y 1 A HIS 1027 ? A HIS 337 
38 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 
A1IMS C    C  N N 1   
A1IMS N    N  N N 2   
A1IMS CL   CL N N 3   
A1IMS C2   C  Y N 4   
A1IMS C3   C  Y N 5   
A1IMS C4   C  Y N 6   
A1IMS C5   C  Y N 7   
A1IMS C6   C  Y N 8   
A1IMS C1   C  Y N 9   
A1IMS O    O  N N 10  
A1IMS C7   C  Y N 11  
A1IMS C13  C  Y N 12  
A1IMS N2   N  Y N 13  
A1IMS C9   C  Y N 14  
A1IMS C10  C  N N 15  
A1IMS C11  C  N N 16  
A1IMS N1   N  N N 17  
A1IMS C12  C  N N 18  
A1IMS O1   O  N N 19  
A1IMS C8   C  Y N 20  
A1IMS C14  C  Y N 21  
A1IMS C18  C  Y N 22  
A1IMS C17  C  Y N 23  
A1IMS N3   N  Y N 24  
A1IMS C16  C  Y N 25  
A1IMS C15  C  Y N 26  
A1IMS O2   O  N N 27  
A1IMS C19  C  N N 28  
A1IMS C20  C  N S 29  
A1IMS O3   O  N N 30  
A1IMS C23  C  N N 31  
A1IMS C22  C  N N 32  
A1IMS C21  C  N N 33  
A1IMS H3   H  N N 34  
A1IMS H4   H  N N 35  
A1IMS H2   H  N N 36  
A1IMS H8   H  N N 37  
A1IMS H5   H  N N 38  
A1IMS H6   H  N N 39  
A1IMS H7   H  N N 40  
A1IMS H    H  N N 41  
A1IMS H10  H  N N 42  
A1IMS H9   H  N N 43  
A1IMS H12  H  N N 44  
A1IMS H11  H  N N 45  
A1IMS H13  H  N N 46  
A1IMS H16  H  N N 47  
A1IMS H15  H  N N 48  
A1IMS H14  H  N N 49  
A1IMS H17  H  N N 50  
A1IMS H18  H  N N 51  
A1IMS H1   H  N N 52  
A1IMS H24  H  N N 53  
A1IMS H23  H  N N 54  
A1IMS H22  H  N N 55  
A1IMS H21  H  N N 56  
A1IMS H20  H  N N 57  
A1IMS H19  H  N N 58  
ALA   N    N  N N 59  
ALA   CA   C  N S 60  
ALA   C    C  N N 61  
ALA   O    O  N N 62  
ALA   CB   C  N N 63  
ALA   OXT  O  N N 64  
ALA   H    H  N N 65  
ALA   H2   H  N N 66  
ALA   HA   H  N N 67  
ALA   HB1  H  N N 68  
ALA   HB2  H  N N 69  
ALA   HB3  H  N N 70  
ALA   HXT  H  N N 71  
ARG   N    N  N N 72  
ARG   CA   C  N S 73  
ARG   C    C  N N 74  
ARG   O    O  N N 75  
ARG   CB   C  N N 76  
ARG   CG   C  N N 77  
ARG   CD   C  N N 78  
ARG   NE   N  N N 79  
ARG   CZ   C  N N 80  
ARG   NH1  N  N N 81  
ARG   NH2  N  N N 82  
ARG   OXT  O  N N 83  
ARG   H    H  N N 84  
ARG   H2   H  N N 85  
ARG   HA   H  N N 86  
ARG   HB2  H  N N 87  
ARG   HB3  H  N N 88  
ARG   HG2  H  N N 89  
ARG   HG3  H  N N 90  
ARG   HD2  H  N N 91  
ARG   HD3  H  N N 92  
ARG   HE   H  N N 93  
ARG   HH11 H  N N 94  
ARG   HH12 H  N N 95  
ARG   HH21 H  N N 96  
ARG   HH22 H  N N 97  
ARG   HXT  H  N N 98  
ASN   N    N  N N 99  
ASN   CA   C  N S 100 
ASN   C    C  N N 101 
ASN   O    O  N N 102 
ASN   CB   C  N N 103 
ASN   CG   C  N N 104 
ASN   OD1  O  N N 105 
ASN   ND2  N  N N 106 
ASN   OXT  O  N N 107 
ASN   H    H  N N 108 
ASN   H2   H  N N 109 
ASN   HA   H  N N 110 
ASN   HB2  H  N N 111 
ASN   HB3  H  N N 112 
ASN   HD21 H  N N 113 
ASN   HD22 H  N N 114 
ASN   HXT  H  N N 115 
ASP   N    N  N N 116 
ASP   CA   C  N S 117 
ASP   C    C  N N 118 
ASP   O    O  N N 119 
ASP   CB   C  N N 120 
ASP   CG   C  N N 121 
ASP   OD1  O  N N 122 
ASP   OD2  O  N N 123 
ASP   OXT  O  N N 124 
ASP   H    H  N N 125 
ASP   H2   H  N N 126 
ASP   HA   H  N N 127 
ASP   HB2  H  N N 128 
ASP   HB3  H  N N 129 
ASP   HD2  H  N N 130 
ASP   HXT  H  N N 131 
CYS   N    N  N N 132 
CYS   CA   C  N R 133 
CYS   C    C  N N 134 
CYS   O    O  N N 135 
CYS   CB   C  N N 136 
CYS   SG   S  N N 137 
CYS   OXT  O  N N 138 
CYS   H    H  N N 139 
CYS   H2   H  N N 140 
CYS   HA   H  N N 141 
CYS   HB2  H  N N 142 
CYS   HB3  H  N N 143 
CYS   HG   H  N N 144 
CYS   HXT  H  N N 145 
GLN   N    N  N N 146 
GLN   CA   C  N S 147 
GLN   C    C  N N 148 
GLN   O    O  N N 149 
GLN   CB   C  N N 150 
GLN   CG   C  N N 151 
GLN   CD   C  N N 152 
GLN   OE1  O  N N 153 
GLN   NE2  N  N N 154 
GLN   OXT  O  N N 155 
GLN   H    H  N N 156 
GLN   H2   H  N N 157 
GLN   HA   H  N N 158 
GLN   HB2  H  N N 159 
GLN   HB3  H  N N 160 
GLN   HG2  H  N N 161 
GLN   HG3  H  N N 162 
GLN   HE21 H  N N 163 
GLN   HE22 H  N N 164 
GLN   HXT  H  N N 165 
GLU   N    N  N N 166 
GLU   CA   C  N S 167 
GLU   C    C  N N 168 
GLU   O    O  N N 169 
GLU   CB   C  N N 170 
GLU   CG   C  N N 171 
GLU   CD   C  N N 172 
GLU   OE1  O  N N 173 
GLU   OE2  O  N N 174 
GLU   OXT  O  N N 175 
GLU   H    H  N N 176 
GLU   H2   H  N N 177 
GLU   HA   H  N N 178 
GLU   HB2  H  N N 179 
GLU   HB3  H  N N 180 
GLU   HG2  H  N N 181 
GLU   HG3  H  N N 182 
GLU   HE2  H  N N 183 
GLU   HXT  H  N N 184 
GLY   N    N  N N 185 
GLY   CA   C  N N 186 
GLY   C    C  N N 187 
GLY   O    O  N N 188 
GLY   OXT  O  N N 189 
GLY   H    H  N N 190 
GLY   H2   H  N N 191 
GLY   HA2  H  N N 192 
GLY   HA3  H  N N 193 
GLY   HXT  H  N N 194 
HIS   N    N  N N 195 
HIS   CA   C  N S 196 
HIS   C    C  N N 197 
HIS   O    O  N N 198 
HIS   CB   C  N N 199 
HIS   CG   C  Y N 200 
HIS   ND1  N  Y N 201 
HIS   CD2  C  Y N 202 
HIS   CE1  C  Y N 203 
HIS   NE2  N  Y N 204 
HIS   OXT  O  N N 205 
HIS   H    H  N N 206 
HIS   H2   H  N N 207 
HIS   HA   H  N N 208 
HIS   HB2  H  N N 209 
HIS   HB3  H  N N 210 
HIS   HD1  H  N N 211 
HIS   HD2  H  N N 212 
HIS   HE1  H  N N 213 
HIS   HE2  H  N N 214 
HIS   HXT  H  N N 215 
HOH   O    O  N N 216 
HOH   H1   H  N N 217 
HOH   H2   H  N N 218 
ILE   N    N  N N 219 
ILE   CA   C  N S 220 
ILE   C    C  N N 221 
ILE   O    O  N N 222 
ILE   CB   C  N S 223 
ILE   CG1  C  N N 224 
ILE   CG2  C  N N 225 
ILE   CD1  C  N N 226 
ILE   OXT  O  N N 227 
ILE   H    H  N N 228 
ILE   H2   H  N N 229 
ILE   HA   H  N N 230 
ILE   HB   H  N N 231 
ILE   HG12 H  N N 232 
ILE   HG13 H  N N 233 
ILE   HG21 H  N N 234 
ILE   HG22 H  N N 235 
ILE   HG23 H  N N 236 
ILE   HD11 H  N N 237 
ILE   HD12 H  N N 238 
ILE   HD13 H  N N 239 
ILE   HXT  H  N N 240 
LEU   N    N  N N 241 
LEU   CA   C  N S 242 
LEU   C    C  N N 243 
LEU   O    O  N N 244 
LEU   CB   C  N N 245 
LEU   CG   C  N N 246 
LEU   CD1  C  N N 247 
LEU   CD2  C  N N 248 
LEU   OXT  O  N N 249 
LEU   H    H  N N 250 
LEU   H2   H  N N 251 
LEU   HA   H  N N 252 
LEU   HB2  H  N N 253 
LEU   HB3  H  N N 254 
LEU   HG   H  N N 255 
LEU   HD11 H  N N 256 
LEU   HD12 H  N N 257 
LEU   HD13 H  N N 258 
LEU   HD21 H  N N 259 
LEU   HD22 H  N N 260 
LEU   HD23 H  N N 261 
LEU   HXT  H  N N 262 
LYS   N    N  N N 263 
LYS   CA   C  N S 264 
LYS   C    C  N N 265 
LYS   O    O  N N 266 
LYS   CB   C  N N 267 
LYS   CG   C  N N 268 
LYS   CD   C  N N 269 
LYS   CE   C  N N 270 
LYS   NZ   N  N N 271 
LYS   OXT  O  N N 272 
LYS   H    H  N N 273 
LYS   H2   H  N N 274 
LYS   HA   H  N N 275 
LYS   HB2  H  N N 276 
LYS   HB3  H  N N 277 
LYS   HG2  H  N N 278 
LYS   HG3  H  N N 279 
LYS   HD2  H  N N 280 
LYS   HD3  H  N N 281 
LYS   HE2  H  N N 282 
LYS   HE3  H  N N 283 
LYS   HZ1  H  N N 284 
LYS   HZ2  H  N N 285 
LYS   HZ3  H  N N 286 
LYS   HXT  H  N N 287 
MET   N    N  N N 288 
MET   CA   C  N S 289 
MET   C    C  N N 290 
MET   O    O  N N 291 
MET   CB   C  N N 292 
MET   CG   C  N N 293 
MET   SD   S  N N 294 
MET   CE   C  N N 295 
MET   OXT  O  N N 296 
MET   H    H  N N 297 
MET   H2   H  N N 298 
MET   HA   H  N N 299 
MET   HB2  H  N N 300 
MET   HB3  H  N N 301 
MET   HG2  H  N N 302 
MET   HG3  H  N N 303 
MET   HE1  H  N N 304 
MET   HE2  H  N N 305 
MET   HE3  H  N N 306 
MET   HXT  H  N N 307 
PHE   N    N  N N 308 
PHE   CA   C  N S 309 
PHE   C    C  N N 310 
PHE   O    O  N N 311 
PHE   CB   C  N N 312 
PHE   CG   C  Y N 313 
PHE   CD1  C  Y N 314 
PHE   CD2  C  Y N 315 
PHE   CE1  C  Y N 316 
PHE   CE2  C  Y N 317 
PHE   CZ   C  Y N 318 
PHE   OXT  O  N N 319 
PHE   H    H  N N 320 
PHE   H2   H  N N 321 
PHE   HA   H  N N 322 
PHE   HB2  H  N N 323 
PHE   HB3  H  N N 324 
PHE   HD1  H  N N 325 
PHE   HD2  H  N N 326 
PHE   HE1  H  N N 327 
PHE   HE2  H  N N 328 
PHE   HZ   H  N N 329 
PHE   HXT  H  N N 330 
PRO   N    N  N N 331 
PRO   CA   C  N S 332 
PRO   C    C  N N 333 
PRO   O    O  N N 334 
PRO   CB   C  N N 335 
PRO   CG   C  N N 336 
PRO   CD   C  N N 337 
PRO   OXT  O  N N 338 
PRO   H    H  N N 339 
PRO   HA   H  N N 340 
PRO   HB2  H  N N 341 
PRO   HB3  H  N N 342 
PRO   HG2  H  N N 343 
PRO   HG3  H  N N 344 
PRO   HD2  H  N N 345 
PRO   HD3  H  N N 346 
PRO   HXT  H  N N 347 
SER   N    N  N N 348 
SER   CA   C  N S 349 
SER   C    C  N N 350 
SER   O    O  N N 351 
SER   CB   C  N N 352 
SER   OG   O  N N 353 
SER   OXT  O  N N 354 
SER   H    H  N N 355 
SER   H2   H  N N 356 
SER   HA   H  N N 357 
SER   HB2  H  N N 358 
SER   HB3  H  N N 359 
SER   HG   H  N N 360 
SER   HXT  H  N N 361 
THR   N    N  N N 362 
THR   CA   C  N S 363 
THR   C    C  N N 364 
THR   O    O  N N 365 
THR   CB   C  N R 366 
THR   OG1  O  N N 367 
THR   CG2  C  N N 368 
THR   OXT  O  N N 369 
THR   H    H  N N 370 
THR   H2   H  N N 371 
THR   HA   H  N N 372 
THR   HB   H  N N 373 
THR   HG1  H  N N 374 
THR   HG21 H  N N 375 
THR   HG22 H  N N 376 
THR   HG23 H  N N 377 
THR   HXT  H  N N 378 
TRP   N    N  N N 379 
TRP   CA   C  N S 380 
TRP   C    C  N N 381 
TRP   O    O  N N 382 
TRP   CB   C  N N 383 
TRP   CG   C  Y N 384 
TRP   CD1  C  Y N 385 
TRP   CD2  C  Y N 386 
TRP   NE1  N  Y N 387 
TRP   CE2  C  Y N 388 
TRP   CE3  C  Y N 389 
TRP   CZ2  C  Y N 390 
TRP   CZ3  C  Y N 391 
TRP   CH2  C  Y N 392 
TRP   OXT  O  N N 393 
TRP   H    H  N N 394 
TRP   H2   H  N N 395 
TRP   HA   H  N N 396 
TRP   HB2  H  N N 397 
TRP   HB3  H  N N 398 
TRP   HD1  H  N N 399 
TRP   HE1  H  N N 400 
TRP   HE3  H  N N 401 
TRP   HZ2  H  N N 402 
TRP   HZ3  H  N N 403 
TRP   HH2  H  N N 404 
TRP   HXT  H  N N 405 
TYR   N    N  N N 406 
TYR   CA   C  N S 407 
TYR   C    C  N N 408 
TYR   O    O  N N 409 
TYR   CB   C  N N 410 
TYR   CG   C  Y N 411 
TYR   CD1  C  Y N 412 
TYR   CD2  C  Y N 413 
TYR   CE1  C  Y N 414 
TYR   CE2  C  Y N 415 
TYR   CZ   C  Y N 416 
TYR   OH   O  N N 417 
TYR   OXT  O  N N 418 
TYR   H    H  N N 419 
TYR   H2   H  N N 420 
TYR   HA   H  N N 421 
TYR   HB2  H  N N 422 
TYR   HB3  H  N N 423 
TYR   HD1  H  N N 424 
TYR   HD2  H  N N 425 
TYR   HE1  H  N N 426 
TYR   HE2  H  N N 427 
TYR   HH   H  N N 428 
TYR   HXT  H  N N 429 
VAL   N    N  N N 430 
VAL   CA   C  N S 431 
VAL   C    C  N N 432 
VAL   O    O  N N 433 
VAL   CB   C  N N 434 
VAL   CG1  C  N N 435 
VAL   CG2  C  N N 436 
VAL   OXT  O  N N 437 
VAL   H    H  N N 438 
VAL   H2   H  N N 439 
VAL   HA   H  N N 440 
VAL   HB   H  N N 441 
VAL   HG11 H  N N 442 
VAL   HG12 H  N N 443 
VAL   HG13 H  N N 444 
VAL   HG21 H  N N 445 
VAL   HG22 H  N N 446 
VAL   HG23 H  N N 447 
VAL   HXT  H  N N 448 
# 
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 
A1IMS C   O    sing N N 1   
A1IMS O   C1   sing N N 2   
A1IMS C1  C2   doub Y N 3   
A1IMS C3  C2   sing Y N 4   
A1IMS C4  C3   doub Y N 5   
A1IMS C5  C4   sing Y N 6   
A1IMS C6  C5   doub Y N 7   
A1IMS C1  C6   sing Y N 8   
A1IMS N   C6   sing N N 9   
A1IMS C7  N    sing N N 10  
A1IMS C7  C8   sing Y N 11  
A1IMS C8  C9   doub Y N 12  
A1IMS C10 C9   sing N N 13  
A1IMS C11 C10  sing N N 14  
A1IMS N1  C11  sing N N 15  
A1IMS C12 N1   sing N N 16  
A1IMS C8  C12  sing N N 17  
A1IMS O1  C12  doub N N 18  
A1IMS C9  N2   sing Y N 19  
A1IMS N2  C13  sing Y N 20  
A1IMS C13 C7   doub Y N 21  
A1IMS C14 C13  sing N N 22  
A1IMS C14 C15  doub Y N 23  
A1IMS C15 C16  sing Y N 24  
A1IMS C16 N3   doub Y N 25  
A1IMS N3  C17  sing Y N 26  
A1IMS C17 C18  doub Y N 27  
A1IMS C18 C14  sing Y N 28  
A1IMS O2  C18  sing N N 29  
A1IMS C19 O2   sing N N 30  
A1IMS C20 C19  sing N N 31  
A1IMS C20 C21  sing N N 32  
A1IMS C21 C22  sing N N 33  
A1IMS C22 C23  sing N N 34  
A1IMS C23 O3   sing N N 35  
A1IMS O3  C20  sing N N 36  
A1IMS C2  CL   sing N N 37  
A1IMS C   H3   sing N N 38  
A1IMS C   H4   sing N N 39  
A1IMS C   H2   sing N N 40  
A1IMS N   H8   sing N N 41  
A1IMS C3  H5   sing N N 42  
A1IMS C4  H6   sing N N 43  
A1IMS C5  H7   sing N N 44  
A1IMS N2  H    sing N N 45  
A1IMS C10 H10  sing N N 46  
A1IMS C10 H9   sing N N 47  
A1IMS C11 H12  sing N N 48  
A1IMS C11 H11  sing N N 49  
A1IMS N1  H13  sing N N 50  
A1IMS C17 H16  sing N N 51  
A1IMS C16 H15  sing N N 52  
A1IMS C15 H14  sing N N 53  
A1IMS C19 H17  sing N N 54  
A1IMS C19 H18  sing N N 55  
A1IMS C20 H1   sing N N 56  
A1IMS C23 H24  sing N N 57  
A1IMS C23 H23  sing N N 58  
A1IMS C22 H22  sing N N 59  
A1IMS C22 H21  sing N N 60  
A1IMS C21 H20  sing N N 61  
A1IMS C21 H19  sing N N 62  
ALA   N   CA   sing N N 63  
ALA   N   H    sing N N 64  
ALA   N   H2   sing N N 65  
ALA   CA  C    sing N N 66  
ALA   CA  CB   sing N N 67  
ALA   CA  HA   sing N N 68  
ALA   C   O    doub N N 69  
ALA   C   OXT  sing N N 70  
ALA   CB  HB1  sing N N 71  
ALA   CB  HB2  sing N N 72  
ALA   CB  HB3  sing N N 73  
ALA   OXT HXT  sing N N 74  
ARG   N   CA   sing N N 75  
ARG   N   H    sing N N 76  
ARG   N   H2   sing N N 77  
ARG   CA  C    sing N N 78  
ARG   CA  CB   sing N N 79  
ARG   CA  HA   sing N N 80  
ARG   C   O    doub N N 81  
ARG   C   OXT  sing N N 82  
ARG   CB  CG   sing N N 83  
ARG   CB  HB2  sing N N 84  
ARG   CB  HB3  sing N N 85  
ARG   CG  CD   sing N N 86  
ARG   CG  HG2  sing N N 87  
ARG   CG  HG3  sing N N 88  
ARG   CD  NE   sing N N 89  
ARG   CD  HD2  sing N N 90  
ARG   CD  HD3  sing N N 91  
ARG   NE  CZ   sing N N 92  
ARG   NE  HE   sing N N 93  
ARG   CZ  NH1  sing N N 94  
ARG   CZ  NH2  doub N N 95  
ARG   NH1 HH11 sing N N 96  
ARG   NH1 HH12 sing N N 97  
ARG   NH2 HH21 sing N N 98  
ARG   NH2 HH22 sing N N 99  
ARG   OXT HXT  sing N N 100 
ASN   N   CA   sing N N 101 
ASN   N   H    sing N N 102 
ASN   N   H2   sing N N 103 
ASN   CA  C    sing N N 104 
ASN   CA  CB   sing N N 105 
ASN   CA  HA   sing N N 106 
ASN   C   O    doub N N 107 
ASN   C   OXT  sing N N 108 
ASN   CB  CG   sing N N 109 
ASN   CB  HB2  sing N N 110 
ASN   CB  HB3  sing N N 111 
ASN   CG  OD1  doub N N 112 
ASN   CG  ND2  sing N N 113 
ASN   ND2 HD21 sing N N 114 
ASN   ND2 HD22 sing N N 115 
ASN   OXT HXT  sing N N 116 
ASP   N   CA   sing N N 117 
ASP   N   H    sing N N 118 
ASP   N   H2   sing N N 119 
ASP   CA  C    sing N N 120 
ASP   CA  CB   sing N N 121 
ASP   CA  HA   sing N N 122 
ASP   C   O    doub N N 123 
ASP   C   OXT  sing N N 124 
ASP   CB  CG   sing N N 125 
ASP   CB  HB2  sing N N 126 
ASP   CB  HB3  sing N N 127 
ASP   CG  OD1  doub N N 128 
ASP   CG  OD2  sing N N 129 
ASP   OD2 HD2  sing N N 130 
ASP   OXT HXT  sing N N 131 
CYS   N   CA   sing N N 132 
CYS   N   H    sing N N 133 
CYS   N   H2   sing N N 134 
CYS   CA  C    sing N N 135 
CYS   CA  CB   sing N N 136 
CYS   CA  HA   sing N N 137 
CYS   C   O    doub N N 138 
CYS   C   OXT  sing N N 139 
CYS   CB  SG   sing N N 140 
CYS   CB  HB2  sing N N 141 
CYS   CB  HB3  sing N N 142 
CYS   SG  HG   sing N N 143 
CYS   OXT HXT  sing N N 144 
GLN   N   CA   sing N N 145 
GLN   N   H    sing N N 146 
GLN   N   H2   sing N N 147 
GLN   CA  C    sing N N 148 
GLN   CA  CB   sing N N 149 
GLN   CA  HA   sing N N 150 
GLN   C   O    doub N N 151 
GLN   C   OXT  sing N N 152 
GLN   CB  CG   sing N N 153 
GLN   CB  HB2  sing N N 154 
GLN   CB  HB3  sing N N 155 
GLN   CG  CD   sing N N 156 
GLN   CG  HG2  sing N N 157 
GLN   CG  HG3  sing N N 158 
GLN   CD  OE1  doub N N 159 
GLN   CD  NE2  sing N N 160 
GLN   NE2 HE21 sing N N 161 
GLN   NE2 HE22 sing N N 162 
GLN   OXT HXT  sing N N 163 
GLU   N   CA   sing N N 164 
GLU   N   H    sing N N 165 
GLU   N   H2   sing N N 166 
GLU   CA  C    sing N N 167 
GLU   CA  CB   sing N N 168 
GLU   CA  HA   sing N N 169 
GLU   C   O    doub N N 170 
GLU   C   OXT  sing N N 171 
GLU   CB  CG   sing N N 172 
GLU   CB  HB2  sing N N 173 
GLU   CB  HB3  sing N N 174 
GLU   CG  CD   sing N N 175 
GLU   CG  HG2  sing N N 176 
GLU   CG  HG3  sing N N 177 
GLU   CD  OE1  doub N N 178 
GLU   CD  OE2  sing N N 179 
GLU   OE2 HE2  sing N N 180 
GLU   OXT HXT  sing N N 181 
GLY   N   CA   sing N N 182 
GLY   N   H    sing N N 183 
GLY   N   H2   sing N N 184 
GLY   CA  C    sing N N 185 
GLY   CA  HA2  sing N N 186 
GLY   CA  HA3  sing N N 187 
GLY   C   O    doub N N 188 
GLY   C   OXT  sing N N 189 
GLY   OXT HXT  sing N N 190 
HIS   N   CA   sing N N 191 
HIS   N   H    sing N N 192 
HIS   N   H2   sing N N 193 
HIS   CA  C    sing N N 194 
HIS   CA  CB   sing N N 195 
HIS   CA  HA   sing N N 196 
HIS   C   O    doub N N 197 
HIS   C   OXT  sing N N 198 
HIS   CB  CG   sing N N 199 
HIS   CB  HB2  sing N N 200 
HIS   CB  HB3  sing N N 201 
HIS   CG  ND1  sing Y N 202 
HIS   CG  CD2  doub Y N 203 
HIS   ND1 CE1  doub Y N 204 
HIS   ND1 HD1  sing N N 205 
HIS   CD2 NE2  sing Y N 206 
HIS   CD2 HD2  sing N N 207 
HIS   CE1 NE2  sing Y N 208 
HIS   CE1 HE1  sing N N 209 
HIS   NE2 HE2  sing N N 210 
HIS   OXT HXT  sing N N 211 
HOH   O   H1   sing N N 212 
HOH   O   H2   sing N N 213 
ILE   N   CA   sing N N 214 
ILE   N   H    sing N N 215 
ILE   N   H2   sing N N 216 
ILE   CA  C    sing N N 217 
ILE   CA  CB   sing N N 218 
ILE   CA  HA   sing N N 219 
ILE   C   O    doub N N 220 
ILE   C   OXT  sing N N 221 
ILE   CB  CG1  sing N N 222 
ILE   CB  CG2  sing N N 223 
ILE   CB  HB   sing N N 224 
ILE   CG1 CD1  sing N N 225 
ILE   CG1 HG12 sing N N 226 
ILE   CG1 HG13 sing N N 227 
ILE   CG2 HG21 sing N N 228 
ILE   CG2 HG22 sing N N 229 
ILE   CG2 HG23 sing N N 230 
ILE   CD1 HD11 sing N N 231 
ILE   CD1 HD12 sing N N 232 
ILE   CD1 HD13 sing N N 233 
ILE   OXT HXT  sing N N 234 
LEU   N   CA   sing N N 235 
LEU   N   H    sing N N 236 
LEU   N   H2   sing N N 237 
LEU   CA  C    sing N N 238 
LEU   CA  CB   sing N N 239 
LEU   CA  HA   sing N N 240 
LEU   C   O    doub N N 241 
LEU   C   OXT  sing N N 242 
LEU   CB  CG   sing N N 243 
LEU   CB  HB2  sing N N 244 
LEU   CB  HB3  sing N N 245 
LEU   CG  CD1  sing N N 246 
LEU   CG  CD2  sing N N 247 
LEU   CG  HG   sing N N 248 
LEU   CD1 HD11 sing N N 249 
LEU   CD1 HD12 sing N N 250 
LEU   CD1 HD13 sing N N 251 
LEU   CD2 HD21 sing N N 252 
LEU   CD2 HD22 sing N N 253 
LEU   CD2 HD23 sing N N 254 
LEU   OXT HXT  sing N N 255 
LYS   N   CA   sing N N 256 
LYS   N   H    sing N N 257 
LYS   N   H2   sing N N 258 
LYS   CA  C    sing N N 259 
LYS   CA  CB   sing N N 260 
LYS   CA  HA   sing N N 261 
LYS   C   O    doub N N 262 
LYS   C   OXT  sing N N 263 
LYS   CB  CG   sing N N 264 
LYS   CB  HB2  sing N N 265 
LYS   CB  HB3  sing N N 266 
LYS   CG  CD   sing N N 267 
LYS   CG  HG2  sing N N 268 
LYS   CG  HG3  sing N N 269 
LYS   CD  CE   sing N N 270 
LYS   CD  HD2  sing N N 271 
LYS   CD  HD3  sing N N 272 
LYS   CE  NZ   sing N N 273 
LYS   CE  HE2  sing N N 274 
LYS   CE  HE3  sing N N 275 
LYS   NZ  HZ1  sing N N 276 
LYS   NZ  HZ2  sing N N 277 
LYS   NZ  HZ3  sing N N 278 
LYS   OXT HXT  sing N N 279 
MET   N   CA   sing N N 280 
MET   N   H    sing N N 281 
MET   N   H2   sing N N 282 
MET   CA  C    sing N N 283 
MET   CA  CB   sing N N 284 
MET   CA  HA   sing N N 285 
MET   C   O    doub N N 286 
MET   C   OXT  sing N N 287 
MET   CB  CG   sing N N 288 
MET   CB  HB2  sing N N 289 
MET   CB  HB3  sing N N 290 
MET   CG  SD   sing N N 291 
MET   CG  HG2  sing N N 292 
MET   CG  HG3  sing N N 293 
MET   SD  CE   sing N N 294 
MET   CE  HE1  sing N N 295 
MET   CE  HE2  sing N N 296 
MET   CE  HE3  sing N N 297 
MET   OXT HXT  sing N N 298 
PHE   N   CA   sing N N 299 
PHE   N   H    sing N N 300 
PHE   N   H2   sing N N 301 
PHE   CA  C    sing N N 302 
PHE   CA  CB   sing N N 303 
PHE   CA  HA   sing N N 304 
PHE   C   O    doub N N 305 
PHE   C   OXT  sing N N 306 
PHE   CB  CG   sing N N 307 
PHE   CB  HB2  sing N N 308 
PHE   CB  HB3  sing N N 309 
PHE   CG  CD1  doub Y N 310 
PHE   CG  CD2  sing Y N 311 
PHE   CD1 CE1  sing Y N 312 
PHE   CD1 HD1  sing N N 313 
PHE   CD2 CE2  doub Y N 314 
PHE   CD2 HD2  sing N N 315 
PHE   CE1 CZ   doub Y N 316 
PHE   CE1 HE1  sing N N 317 
PHE   CE2 CZ   sing Y N 318 
PHE   CE2 HE2  sing N N 319 
PHE   CZ  HZ   sing N N 320 
PHE   OXT HXT  sing N N 321 
PRO   N   CA   sing N N 322 
PRO   N   CD   sing N N 323 
PRO   N   H    sing N N 324 
PRO   CA  C    sing N N 325 
PRO   CA  CB   sing N N 326 
PRO   CA  HA   sing N N 327 
PRO   C   O    doub N N 328 
PRO   C   OXT  sing N N 329 
PRO   CB  CG   sing N N 330 
PRO   CB  HB2  sing N N 331 
PRO   CB  HB3  sing N N 332 
PRO   CG  CD   sing N N 333 
PRO   CG  HG2  sing N N 334 
PRO   CG  HG3  sing N N 335 
PRO   CD  HD2  sing N N 336 
PRO   CD  HD3  sing N N 337 
PRO   OXT HXT  sing N N 338 
SER   N   CA   sing N N 339 
SER   N   H    sing N N 340 
SER   N   H2   sing N N 341 
SER   CA  C    sing N N 342 
SER   CA  CB   sing N N 343 
SER   CA  HA   sing N N 344 
SER   C   O    doub N N 345 
SER   C   OXT  sing N N 346 
SER   CB  OG   sing N N 347 
SER   CB  HB2  sing N N 348 
SER   CB  HB3  sing N N 349 
SER   OG  HG   sing N N 350 
SER   OXT HXT  sing N N 351 
THR   N   CA   sing N N 352 
THR   N   H    sing N N 353 
THR   N   H2   sing N N 354 
THR   CA  C    sing N N 355 
THR   CA  CB   sing N N 356 
THR   CA  HA   sing N N 357 
THR   C   O    doub N N 358 
THR   C   OXT  sing N N 359 
THR   CB  OG1  sing N N 360 
THR   CB  CG2  sing N N 361 
THR   CB  HB   sing N N 362 
THR   OG1 HG1  sing N N 363 
THR   CG2 HG21 sing N N 364 
THR   CG2 HG22 sing N N 365 
THR   CG2 HG23 sing N N 366 
THR   OXT HXT  sing N N 367 
TRP   N   CA   sing N N 368 
TRP   N   H    sing N N 369 
TRP   N   H2   sing N N 370 
TRP   CA  C    sing N N 371 
TRP   CA  CB   sing N N 372 
TRP   CA  HA   sing N N 373 
TRP   C   O    doub N N 374 
TRP   C   OXT  sing N N 375 
TRP   CB  CG   sing N N 376 
TRP   CB  HB2  sing N N 377 
TRP   CB  HB3  sing N N 378 
TRP   CG  CD1  doub Y N 379 
TRP   CG  CD2  sing Y N 380 
TRP   CD1 NE1  sing Y N 381 
TRP   CD1 HD1  sing N N 382 
TRP   CD2 CE2  doub Y N 383 
TRP   CD2 CE3  sing Y N 384 
TRP   NE1 CE2  sing Y N 385 
TRP   NE1 HE1  sing N N 386 
TRP   CE2 CZ2  sing Y N 387 
TRP   CE3 CZ3  doub Y N 388 
TRP   CE3 HE3  sing N N 389 
TRP   CZ2 CH2  doub Y N 390 
TRP   CZ2 HZ2  sing N N 391 
TRP   CZ3 CH2  sing Y N 392 
TRP   CZ3 HZ3  sing N N 393 
TRP   CH2 HH2  sing N N 394 
TRP   OXT HXT  sing N N 395 
TYR   N   CA   sing N N 396 
TYR   N   H    sing N N 397 
TYR   N   H2   sing N N 398 
TYR   CA  C    sing N N 399 
TYR   CA  CB   sing N N 400 
TYR   CA  HA   sing N N 401 
TYR   C   O    doub N N 402 
TYR   C   OXT  sing N N 403 
TYR   CB  CG   sing N N 404 
TYR   CB  HB2  sing N N 405 
TYR   CB  HB3  sing N N 406 
TYR   CG  CD1  doub Y N 407 
TYR   CG  CD2  sing Y N 408 
TYR   CD1 CE1  sing Y N 409 
TYR   CD1 HD1  sing N N 410 
TYR   CD2 CE2  doub Y N 411 
TYR   CD2 HD2  sing N N 412 
TYR   CE1 CZ   doub Y N 413 
TYR   CE1 HE1  sing N N 414 
TYR   CE2 CZ   sing Y N 415 
TYR   CE2 HE2  sing N N 416 
TYR   CZ  OH   sing N N 417 
TYR   OH  HH   sing N N 418 
TYR   OXT HXT  sing N N 419 
VAL   N   CA   sing N N 420 
VAL   N   H    sing N N 421 
VAL   N   H2   sing N N 422 
VAL   CA  C    sing N N 423 
VAL   CA  CB   sing N N 424 
VAL   CA  HA   sing N N 425 
VAL   C   O    doub N N 426 
VAL   C   OXT  sing N N 427 
VAL   CB  CG1  sing N N 428 
VAL   CB  CG2  sing N N 429 
VAL   CB  HB   sing N N 430 
VAL   CG1 HG11 sing N N 431 
VAL   CG1 HG12 sing N N 432 
VAL   CG1 HG13 sing N N 433 
VAL   CG2 HG21 sing N N 434 
VAL   CG2 HG22 sing N N 435 
VAL   CG2 HG23 sing N N 436 
VAL   OXT HXT  sing N N 437 
# 
_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 model' 
# 
_atom_sites.entry_id                    9GL7 
_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]   0.025161 
_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]   0.009453 
_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]   0.005732 
_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 
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    . ALA   A 1 9   ? 10.931  -2.987  -6.922  1   57.16  ? 702  ALA   A N    1 1 
ATOM   2    C  CA   . ALA   A 1 9   ? 9.993   -1.922  -6.592  1   57.82  ? 702  ALA   A CA   1 1 
ATOM   3    C  C    . ALA   A 1 9   ? 9.887   -1.765  -5.071  1   58.34  ? 702  ALA   A C    1 1 
ATOM   4    O  O    . ALA   A 1 9   ? 9.411   -2.675  -4.397  1   58.48  ? 702  ALA   A O    1 1 
ATOM   5    C  CB   . ALA   A 1 9   ? 8.629   -2.23   -7.187  1   58.09  ? 702  ALA   A CB   1 1 
ATOM   6    H  HA   . ALA   A 1 9   ? 10.349  -0.99   -7.03   0   66.58  ? 702  ALA   A HA   1 1 
ATOM   7    H  HB1  . ALA   A 1 9   ? 7.935   -1.436  -6.915  0   66.27  ? 702  ALA   A HB1  1 1 
ATOM   8    H  HB2  . ALA   A 1 9   ? 8.724   -2.288  -8.27   0   67.06  ? 702  ALA   A HB2  1 1 
ATOM   9    H  HB3  . ALA   A 1 9   ? 8.281   -3.184  -6.795  0   68.06  ? 702  ALA   A HB3  1 1 
ATOM   10   N  N    . LEU   A 1 10  ? 10.344  -0.616  -4.537  1   58.5   ? 703  LEU   A N    1 1 
ATOM   11   C  CA   . LEU   A 1 10  ? 10.349  -0.32   -3.105  1   59.2   ? 703  LEU   A CA   1 1 
ATOM   12   C  C    . LEU   A 1 10  ? 9.543   0.931   -2.817  1   59.82  ? 703  LEU   A C    1 1 
ATOM   13   O  O    . LEU   A 1 10  ? 9.877   1.991   -3.343  1   60.13  ? 703  LEU   A O    1 1 
ATOM   14   C  CB   . LEU   A 1 10  ? 11.792  -0.068  -2.64   1   59.6   ? 703  LEU   A CB   1 1 
ATOM   15   C  CG   . LEU   A 1 10  ? 12.691  -1.304  -2.438  1   61.32  ? 703  LEU   A CG   1 1 
ATOM   16   C  CD1  . LEU   A 1 10  ? 14.165  -0.951  -2.614  1   61.93  ? 703  LEU   A CD1  1 1 
ATOM   17   C  CD2  . LEU   A 1 10  ? 12.486  -1.917  -1.059  1   62.09  ? 703  LEU   A CD2  1 1 
ATOM   18   H  H    . LEU   A 1 10  ? 10.724  0.144   -5.093  0   66.99  ? 703  LEU   A H    1 1 
ATOM   19   H  HA   . LEU   A 1 10  ? 9.939   -1.15   -2.533  0   69.05  ? 703  LEU   A HA   1 1 
ATOM   20   H  HB2  . LEU   A 1 10  ? 12.26   0.576   -3.384  0   69.07  ? 703  LEU   A HB2  1 1 
ATOM   21   H  HB3  . LEU   A 1 10  ? 11.744  0.473   -1.696  0   69.31  ? 703  LEU   A HB3  1 1 
ATOM   22   H  HG   . LEU   A 1 10  ? 12.447  -2.063  -3.179  0   73.05  ? 703  LEU   A HG   1 1 
ATOM   23   H  HD11 . LEU   A 1 10  ? 14.764  -1.847  -2.46   0   75.26  ? 703  LEU   A HD11 1 1 
ATOM   24   H  HD12 . LEU   A 1 10  ? 14.32   -0.57   -3.622  0   73.57  ? 703  LEU   A HD12 1 1 
ATOM   25   H  HD13 . LEU   A 1 10  ? 14.439  -0.192  -1.883  0   73.84  ? 703  LEU   A HD13 1 1 
ATOM   26   H  HD21 . LEU   A 1 10  ? 13.138  -2.783  -0.959  0   75.58  ? 703  LEU   A HD21 1 1 
ATOM   27   H  HD22 . LEU   A 1 10  ? 12.736  -1.177  -0.299  0   74.12  ? 703  LEU   A HD22 1 1 
ATOM   28   H  HD23 . LEU   A 1 10  ? 11.447  -2.224  -0.953  0   74.09  ? 703  LEU   A HD23 1 1 
ATOM   29   N  N    . LEU   A 1 11  ? 8.515   0.831   -1.957  1   59.88  ? 704  LEU   A N    1 1 
ATOM   30   C  CA   . LEU   A 1 11  ? 7.698   1.976   -1.57   1   60.42  ? 704  LEU   A CA   1 1 
ATOM   31   C  C    . LEU   A 1 11  ? 8.1     2.461   -0.191  1   60.7   ? 704  LEU   A C    1 1 
ATOM   32   O  O    . LEU   A 1 11  ? 7.976   1.712   0.775   1   60.82  ? 704  LEU   A O    1 1 
ATOM   33   C  CB   . LEU   A 1 11  ? 6.195   1.614   -1.522  1   60.8   ? 704  LEU   A CB   1 1 
ATOM   34   C  CG   . LEU   A 1 11  ? 5.419   1.286   -2.806  1   62.38  ? 704  LEU   A CG   1 1 
ATOM   35   C  CD1  . LEU   A 1 11  ? 3.919   1.185   -2.504  1   62.92  ? 704  LEU   A CD1  1 1 
ATOM   36   C  CD2  . LEU   A 1 11  ? 5.557   2.353   -3.839  1   63.09  ? 704  LEU   A CD2  1 1 
ATOM   37   H  H    . LEU   A 1 11  ? 8.227   -0.035  -1.512  0   68.43  ? 704  LEU   A H    1 1 
ATOM   38   H  HA   . LEU   A 1 11  ? 7.852   2.807   -2.255  0   66.55  ? 704  LEU   A HA   1 1 
ATOM   39   H  HB2  . LEU   A 1 11  ? 6.089   0.742   -0.881  0   68.29  ? 704  LEU   A HB2  1 1 
ATOM   40   H  HB3  . LEU   A 1 11  ? 5.681   2.454   -1.058  0   66.91  ? 704  LEU   A HB3  1 1 
ATOM   41   H  HG   . LEU   A 1 11  ? 5.784   0.355   -3.236  0   69.41  ? 704  LEU   A HG   1 1 
ATOM   42   H  HD11 . LEU   A 1 11  ? 3.386   0.891   -3.407  0   69.07  ? 704  LEU   A HD11 1 1 
ATOM   43   H  HD12 . LEU   A 1 11  ? 3.737   0.47    -1.704  0   70.05  ? 704  LEU   A HD12 1 1 
ATOM   44   H  HD13 . LEU   A 1 11  ? 3.572   2.164   -2.178  0   68.62  ? 704  LEU   A HD13 1 1 
ATOM   45   H  HD21 . LEU   A 1 11  ? 4.954   2.089   -4.706  0   68.22  ? 704  LEU   A HD21 1 1 
ATOM   46   H  HD22 . LEU   A 1 11  ? 5.208   3.288   -3.406  0   67.8   ? 704  LEU   A HD22 1 1 
ATOM   47   H  HD23 . LEU   A 1 11  ? 6.599   2.441   -4.135  0   68.52  ? 704  LEU   A HD23 1 1 
ATOM   48   N  N    . ARG   A 1 12  ? 8.545   3.715   -0.086  1   60.65  ? 705  ARG   A N    1 1 
ATOM   49   C  CA   . ARG   A 1 12  ? 8.863   4.305   1.21    1   61.22  ? 705  ARG   A CA   1 1 
ATOM   50   C  C    . ARG   A 1 12  ? 7.551   4.686   1.889   1   61.39  ? 705  ARG   A C    1 1 
ATOM   51   O  O    . ARG   A 1 12  ? 6.639   5.142   1.208   1   61.56  ? 705  ARG   A O    1 1 
ATOM   52   C  CB   . ARG   A 1 12  ? 9.705   5.58    1.045   1   62.94  ? 705  ARG   A CB   1 1 
ATOM   53   C  CG   . ARG   A 1 12  ? 11.162  5.33    0.671   1   66.7   ? 705  ARG   A CG   1 1 
ATOM   54   C  CD   . ARG   A 1 12  ? 11.995  6.606   0.646   1   70.27  ? 705  ARG   A CD   1 1 
ATOM   55   N  NE   . ARG   A 1 12  ? 11.96   7.34    1.918   1   73.06  ? 705  ARG   A NE   1 1 
ATOM   56   C  CZ   . ARG   A 1 12  ? 12.657  7.038   3.015   1   75.21  ? 705  ARG   A CZ   1 1 
ATOM   57   N  NH1  . ARG   A 1 12  ? 12.538  7.782   4.109   1   74.7   ? 705  ARG   A NH1  1 1 
ATOM   58   N  NH2  . ARG   A 1 12  ? 13.477  5.988   3.03    1   75.21  ? 705  ARG   A NH2  1 1 
ATOM   59   H  H    . ARG   A 1 12  ? 8.69    4.338   -0.874  0   66.59  ? 705  ARG   A H    1 1 
ATOM   60   H  HA   . ARG   A 1 12  ? 9.411   3.6     1.834   0   68.81  ? 705  ARG   A HA   1 1 
ATOM   61   H  HB2  . ARG   A 1 12  ? 9.261   6.213   0.278   0   68.58  ? 705  ARG   A HB2  1 1 
ATOM   62   H  HB3  . ARG   A 1 12  ? 9.68    6.105   1.998   0   69.4   ? 705  ARG   A HB3  1 1 
ATOM   63   H  HG2  . ARG   A 1 12  ? 11.603  4.653   1.401   0   74.68  ? 705  ARG   A HG2  1 1 
ATOM   64   H  HG3  . ARG   A 1 12  ? 11.202  4.885   -0.322  0   73.77  ? 705  ARG   A HG3  1 1 
ATOM   65   H  HD2  . ARG   A 1 12  ? 13.027  6.362   0.4     0   78.01  ? 705  ARG   A HD2  1 1 
ATOM   66   H  HD3  . ARG   A 1 12  ? 11.587  7.266   -0.118  0   76.58  ? 705  ARG   A HD3  1 1 
ATOM   67   H  HE   . ARG   A 1 12  ? 11.354  8.152   1.956   0   79.63  ? 705  ARG   A HE   1 1 
ATOM   68   H  HH11 . ARG   A 1 12  ? 11.92   8.587   4.112   0   82.28  ? 705  ARG   A HH11 1 1 
ATOM   69   H  HH12 . ARG   A 1 12  ? 13.065  7.553   4.945   0   83.68  ? 705  ARG   A HH12 1 1 
ATOM   70   H  HH21 . ARG   A 1 12  ? 13.606  5.378   2.23    0   84.36  ? 705  ARG   A HH21 1 1 
ATOM   71   H  HH22 . ARG   A 1 12  ? 13.99   5.777   3.88    0   85.12  ? 705  ARG   A HH22 1 1 
ATOM   72   N  N    . ILE   A 1 13  ? 7.441   4.503   3.209   1   61.2   ? 706  ILE   A N    1 1 
ATOM   73   C  CA   . ILE   A 1 13  ? 6.249   4.928   3.942   1   61.53  ? 706  ILE   A CA   1 1 
ATOM   74   C  C    . ILE   A 1 13  ? 6.691   6.137   4.734   1   61.64  ? 706  ILE   A C    1 1 
ATOM   75   O  O    . ILE   A 1 13  ? 7.454   6.007   5.692   1   61.78  ? 706  ILE   A O    1 1 
ATOM   76   C  CB   . ILE   A 1 13  ? 5.627   3.839   4.852   1   62.21  ? 706  ILE   A CB   1 1 
ATOM   77   C  CG1  . ILE   A 1 13  ? 5.483   2.475   4.123   1   63.21  ? 706  ILE   A CG1  1 1 
ATOM   78   C  CG2  . ILE   A 1 13  ? 4.28    4.327   5.437   1   62.74  ? 706  ILE   A CG2  1 1 
ATOM   79   C  CD1  . ILE   A 1 13  ? 4.65    2.458   2.839   1   64.48  ? 706  ILE   A CD1  1 1 
ATOM   80   H  H    . ILE   A 1 13  ? 8.152   4.068   3.789   0   68.7   ? 706  ILE   A H    1 1 
ATOM   81   H  HA   . ILE   A 1 13  ? 5.48    5.251   3.241   0   67.45  ? 706  ILE   A HA   1 1 
ATOM   82   H  HB   . ILE   A 1 13  ? 6.299   3.677   5.693   0   70.1   ? 706  ILE   A HB   1 1 
ATOM   83   H  HG12 . ILE   A 1 13  ? 6.474   2.098   3.876   0   71.44  ? 706  ILE   A HG12 1 1 
ATOM   84   H  HG13 . ILE   A 1 13  ? 5.003   1.783   4.814   0   71.72  ? 706  ILE   A HG13 1 1 
ATOM   85   H  HG21 . ILE   A 1 13  ? 3.853   3.524   6.036   0   70.4   ? 706  ILE   A HG21 1 1 
ATOM   86   H  HG22 . ILE   A 1 13  ? 4.448   5.198   6.068   0   69.51  ? 706  ILE   A HG22 1 1 
ATOM   87   H  HG23 . ILE   A 1 13  ? 3.597   4.589   4.63    0   69.21  ? 706  ILE   A HG23 1 1 
ATOM   88   H  HD11 . ILE   A 1 13  ? 4.659   1.452   2.428   0   72.27  ? 706  ILE   A HD11 1 1 
ATOM   89   H  HD12 . ILE   A 1 13  ? 3.622   2.745   3.058   0   71.43  ? 706  ILE   A HD12 1 1 
ATOM   90   H  HD13 . ILE   A 1 13  ? 5.076   3.136   2.102   0   71.07  ? 706  ILE   A HD13 1 1 
ATOM   91   N  N    . LEU   A 1 14  ? 6.242   7.319   4.312   1   61.4   ? 707  LEU   A N    1 1 
ATOM   92   C  CA   . LEU   A 1 14  ? 6.629   8.561   4.955   1   61.64  ? 707  LEU   A CA   1 1 
ATOM   93   C  C    . LEU   A 1 14  ? 5.586   8.844   6.026   1   61.87  ? 707  LEU   A C    1 1 
ATOM   94   O  O    . LEU   A 1 14  ? 4.394   8.872   5.724   1   62.13  ? 707  LEU   A O    1 1 
ATOM   95   C  CB   . LEU   A 1 14  ? 6.731   9.706   3.923   1   61.8   ? 707  LEU   A CB   1 1 
ATOM   96   C  CG   . LEU   A 1 14  ? 7.437   9.404   2.568   1   63.27  ? 707  LEU   A CG   1 1 
ATOM   97   C  CD1  . LEU   A 1 14  ? 7.539   10.649  1.737   1   63.78  ? 707  LEU   A CD1  1 1 
ATOM   98   C  CD2  . LEU   A 1 14  ? 8.839   8.812   2.741   1   63.96  ? 707  LEU   A CD2  1 1 
ATOM   99   H  H    . LEU   A 1 14  ? 5.575   7.442   3.557   0   66.42  ? 707  LEU   A H    1 1 
ATOM   100  H  HA   . LEU   A 1 14  ? 7.601   8.455   5.434   0   67.64  ? 707  LEU   A HA   1 1 
ATOM   101  H  HB2  . LEU   A 1 14  ? 5.719   10.028  3.682   0   66.08  ? 707  LEU   A HB2  1 1 
ATOM   102  H  HB3  . LEU   A 1 14  ? 7.268   10.531  4.389   0   66.72  ? 707  LEU   A HB3  1 1 
ATOM   103  H  HG   . LEU   A 1 14  ? 6.841   8.687   2.006   0   67.65  ? 707  LEU   A HG   1 1 
ATOM   104  H  HD11 . LEU   A 1 14  ? 8.018   10.408  0.789   0   67.67  ? 707  LEU   A HD11 1 1 
ATOM   105  H  HD12 . LEU   A 1 14  ? 6.531   11.018  1.565   0   67.26  ? 707  LEU   A HD12 1 1 
ATOM   106  H  HD13 . LEU   A 1 14  ? 8.122   11.395  2.274   0   68.06  ? 707  LEU   A HD13 1 1 
ATOM   107  H  HD21 . LEU   A 1 14  ? 9.271   8.66    1.753   0   69.21  ? 707  LEU   A HD21 1 1 
ATOM   108  H  HD22 . LEU   A 1 14  ? 9.45    9.515   3.304   0   69.62  ? 707  LEU   A HD22 1 1 
ATOM   109  H  HD23 . LEU   A 1 14  ? 8.792   7.856   3.259   0   69.8   ? 707  LEU   A HD23 1 1 
ATOM   110  N  N    . LYS   A 1 15  ? 6.027   8.969   7.288   1   61.71  ? 708  LYS   A N    1 1 
ATOM   111  C  CA   . LYS   A 1 15  ? 5.14    9.185   8.431   1   62.04  ? 708  LYS   A CA   1 1 
ATOM   112  C  C    . LYS   A 1 15  ? 4.245   10.393  8.26    1   62.35  ? 708  LYS   A C    1 1 
ATOM   113  O  O    . LYS   A 1 15  ? 4.664   11.398  7.692   1   62.77  ? 708  LYS   A O    1 1 
ATOM   114  C  CB   . LYS   A 1 15  ? 5.943   9.363   9.737   1   63.77  ? 708  LYS   A CB   1 1 
ATOM   115  C  CG   . LYS   A 1 15  ? 6.259   8.069   10.489  1   67.55  ? 708  LYS   A CG   1 1 
ATOM   116  C  CD   . LYS   A 1 15  ? 6.83    8.336   11.887  1   71.69  ? 708  LYS   A CD   1 1 
ATOM   117  C  CE   . LYS   A 1 15  ? 8.339   8.463   11.884  1   75.7   ? 708  LYS   A CE   1 1 
ATOM   118  N  NZ   . LYS   A 1 15  ? 8.878   9.112   13.114  1   78.1   ? 708  LYS   A NZ   1 1 
ATOM   119  H  H    . LYS   A 1 15  ? 7.008   8.914   7.543   0   68.26  ? 708  LYS   A H    1 1 
ATOM   120  H  HA   . LYS   A 1 15  ? 4.494   8.313   8.517   0   68.56  ? 708  LYS   A HA   1 1 
ATOM   121  H  HB2  . LYS   A 1 15  ? 6.887   9.863   9.526   0   70.91  ? 708  LYS   A HB2  1 1 
ATOM   122  H  HB3  . LYS   A 1 15  ? 5.349   9.992   10.399  0   70.86  ? 708  LYS   A HB3  1 1 
ATOM   123  H  HG2  . LYS   A 1 15  ? 5.337   7.502   10.611  0   75.49  ? 708  LYS   A HG2  1 1 
ATOM   124  H  HG3  . LYS   A 1 15  ? 6.979   7.484   9.918   0   75.61  ? 708  LYS   A HG3  1 1 
ATOM   125  H  HD2  . LYS   A 1 15  ? 6.402   9.255   12.287  0   80.15  ? 708  LYS   A HD2  1 1 
ATOM   126  H  HD3  . LYS   A 1 15  ? 6.57    7.499   12.532  0   80.85  ? 708  LYS   A HD3  1 1 
ATOM   127  H  HE2  . LYS   A 1 15  ? 8.769   7.464   11.834  0   85.31  ? 708  LYS   A HE2  1 1 
ATOM   128  H  HE3  . LYS   A 1 15  ? 8.662   9.051   11.026  0   84.41  ? 708  LYS   A HE3  1 1 
ATOM   129  H  HZ1  . LYS   A 1 15  ? 9.736   9.604   12.887  0   88.04  ? 708  LYS   A HZ1  1 1 
ATOM   130  H  HZ2  . LYS   A 1 15  ? 8.219   9.775   13.51   0   87.63  ? 708  LYS   A HZ2  1 1 
ATOM   131  H  HZ3  . LYS   A 1 15  ? 9.091   8.406   13.812  0   88.54  ? 708  LYS   A HZ3  1 1 
ATOM   132  N  N    . GLU   A 1 16  ? 3.019   10.298  8.784   1   62.01  ? 709  GLU   A N    1 1 
ATOM   133  C  CA   . GLU   A 1 16  ? 2.037   11.383  8.738   1   62.07  ? 709  GLU   A CA   1 1 
ATOM   134  C  C    . GLU   A 1 16  ? 2.564   12.605  9.495   1   61.78  ? 709  GLU   A C    1 1 
ATOM   135  O  O    . GLU   A 1 16  ? 2.52    13.712  8.967   1   61.88  ? 709  GLU   A O    1 1 
ATOM   136  C  CB   . GLU   A 1 16  ? 0.704   10.898  9.337   1   64.51  ? 709  GLU   A CB   1 1 
ATOM   137  C  CG   . GLU   A 1 16  ? -0.387  11.949  9.391   1   70.12  ? 709  GLU   A CG   1 1 
ATOM   138  C  CD   . GLU   A 1 16  ? -1.677  11.437  9.995   1   76.81  ? 709  GLU   A CD   1 1 
ATOM   139  O  OE1  . GLU   A 1 16  ? -2.076  10.293  9.679   1   78.27  ? 709  GLU   A OE1  1 1 
ATOM   140  O  OE2  . GLU   A 1 16  ? -2.28   12.177  10.804  1   78.79  ? 709  GLU   A OE2  1 1 
ATOM   141  H  H    . GLU   A 1 16  ? 2.681   9.466   9.258   0   68.28  ? 709  GLU   A H    1 1 
ATOM   142  H  HA   . GLU   A 1 16  ? 1.866   11.667  7.701   0   67.09  ? 709  GLU   A HA   1 1 
ATOM   143  H  HB2  . GLU   A 1 16  ? 0.347   10.064  8.735   0   70.37  ? 709  GLU   A HB2  1 1 
ATOM   144  H  HB3  . GLU   A 1 16  ? 0.884   10.563  10.357  0   70.97  ? 709  GLU   A HB3  1 1 
ATOM   145  H  HG2  . GLU   A 1 16  ? -0.061  12.772  10.024  0   76.04  ? 709  GLU   A HG2  1 1 
ATOM   146  H  HG3  . GLU   A 1 16  ? -0.587  12.32   8.387   0   75.41  ? 709  GLU   A HG3  1 1 
ATOM   147  N  N    . THR   A 1 17  ? 3.117   12.389  10.701  1   61.39  ? 710  THR   A N    1 1 
ATOM   148  C  CA   . THR   A 1 17  ? 3.677   13.451  11.548  1   61.54  ? 710  THR   A CA   1 1 
ATOM   149  C  C    . THR   A 1 17  ? 4.829   14.233  10.887  1   61.48  ? 710  THR   A C    1 1 
ATOM   150  O  O    . THR   A 1 17  ? 5.156   15.32   11.36   1   61.9   ? 710  THR   A O    1 1 
ATOM   151  C  CB   . THR   A 1 17  ? 4.149   12.859  12.899  1   62.92  ? 710  THR   A CB   1 1 
ATOM   152  O  OG1  . THR   A 1 17  ? 4.972   11.717  12.642  1   64.05  ? 710  THR   A OG1  1 1 
ATOM   153  C  CG2  . THR   A 1 17  ? 2.983   12.472  13.822  1   63.25  ? 710  THR   A CG2  1 1 
ATOM   154  H  H    . THR   A 1 17  ? 3.2     11.463  11.107  0   68.15  ? 710  THR   A H    1 1 
ATOM   155  H  HA   . THR   A 1 17  ? 2.889   14.174  11.757  0   68.31  ? 710  THR   A HA   1 1 
ATOM   156  H  HB   . THR   A 1 17  ? 4.745   13.596  13.437  0   70.88  ? 710  THR   A HB   1 1 
ATOM   157  H  HG1  . THR   A 1 17  ? 5.212   11.266  13.493  0   72.37  ? 710  THR   A HG1  1 1 
ATOM   158  H  HG21 . THR   A 1 17  ? 3.362   12.064  14.758  0   71.8   ? 710  THR   A HG21 1 1 
ATOM   159  H  HG22 . THR   A 1 17  ? 2.383   13.355  14.039  0   71.21  ? 710  THR   A HG22 1 1 
ATOM   160  H  HG23 . THR   A 1 17  ? 2.36    11.719  13.342  0   71     ? 710  THR   A HG23 1 1 
ATOM   161  N  N    . GLU   A 1 18  ? 5.436   13.701  9.811   1   60.75  ? 711  GLU   A N    1 1 
ATOM   162  C  CA   . GLU   A 1 18  ? 6.541   14.37   9.121   1   60.52  ? 711  GLU   A CA   1 1 
ATOM   163  C  C    . GLU   A 1 18  ? 6.108   15.506  8.177   1   59.94  ? 711  GLU   A C    1 1 
ATOM   164  O  O    . GLU   A 1 18  ? 6.949   16.339  7.851   1   60.13  ? 711  GLU   A O    1 1 
ATOM   165  C  CB   . GLU   A 1 18  ? 7.376   13.341  8.333   1   62.84  ? 711  GLU   A CB   1 1 
ATOM   166  C  CG   . GLU   A 1 18  ? 8.201   12.418  9.217   1   67.32  ? 711  GLU   A CG   1 1 
ATOM   167  C  CD   . GLU   A 1 18  ? 8.828   11.234  8.506   1   73.15  ? 711  GLU   A CD   1 1 
ATOM   168  O  OE1  . GLU   A 1 18  ? 8.818   11.212  7.254   1   74.48  ? 711  GLU   A OE1  1 1 
ATOM   169  O  OE2  . GLU   A 1 18  ? 9.331   10.325  9.204   1   74.84  ? 711  GLU   A OE2  1 1 
ATOM   170  H  H    . GLU   A 1 18  ? 5.18    12.813  9.391   0   66.88  ? 711  GLU   A H    1 1 
ATOM   171  H  HA   . GLU   A 1 18  ? 7.195   14.821  9.866   0   67.48  ? 711  GLU   A HA   1 1 
ATOM   172  H  HB2  . GLU   A 1 18  ? 6.712   12.733  7.721   0   68.67  ? 711  GLU   A HB2  1 1 
ATOM   173  H  HB3  . GLU   A 1 18  ? 8.067   13.881  7.689   0   69.1   ? 711  GLU   A HB3  1 1 
ATOM   174  H  HG2  . GLU   A 1 18  ? 9.01    13.002  9.653   0   74.96  ? 711  GLU   A HG2  1 1 
ATOM   175  H  HG3  . GLU   A 1 18  ? 7.57    12.031  10.016  0   74.57  ? 711  GLU   A HG3  1 1 
ATOM   176  N  N    . PHE   A 1 19  ? 4.828   15.551  7.736   1   59.01  ? 712  PHE   A N    1 1 
ATOM   177  C  CA   . PHE   A 1 19  ? 4.347   16.581  6.806   1   58.65  ? 712  PHE   A CA   1 1 
ATOM   178  C  C    . PHE   A 1 19  ? 3.717   17.793  7.513   1   57.75  ? 712  PHE   A C    1 1 
ATOM   179  O  O    . PHE   A 1 19  ? 3.007   17.626  8.505   1   57.93  ? 712  PHE   A O    1 1 
ATOM   180  C  CB   . PHE   A 1 19  ? 3.312   15.981  5.849   1   58.8   ? 712  PHE   A CB   1 1 
ATOM   181  C  CG   . PHE   A 1 19  ? 3.806   14.821  5.021   1   59.66  ? 712  PHE   A CG   1 1 
ATOM   182  C  CD1  . PHE   A 1 19  ? 4.562   15.034  3.883   1   60.58  ? 712  PHE   A CD1  1 1 
ATOM   183  C  CD2  . PHE   A 1 19  ? 3.445   13.523  5.335   1   60.53  ? 712  PHE   A CD2  1 1 
ATOM   184  C  CE1  . PHE   A 1 19  ? 4.986   13.966  3.105   1   61.39  ? 712  PHE   A CE1  1 1 
ATOM   185  C  CE2  . PHE   A 1 19  ? 3.869   12.46   4.553   1   61.28  ? 712  PHE   A CE2  1 1 
ATOM   186  C  CZ   . PHE   A 1 19  ? 4.649   12.687  3.453   1   61.16  ? 712  PHE   A CZ   1 1 
ATOM   187  H  H    . PHE   A 1 19  ? 4.104   14.89   7.997   0   64.22  ? 712  PHE   A H    1 1 
ATOM   188  H  HA   . PHE   A 1 19  ? 5.174   16.933  6.191   0   63.51  ? 712  PHE   A HA   1 1 
ATOM   189  H  HB2  . PHE   A 1 19  ? 2.471   15.628  6.443   0   63.06  ? 712  PHE   A HB2  1 1 
ATOM   190  H  HB3  . PHE   A 1 19  ? 2.99    16.761  5.161   0   62.67  ? 712  PHE   A HB3  1 1 
ATOM   191  H  HD1  . PHE   A 1 19  ? 4.852   16.036  3.616   0   64.1   ? 712  PHE   A HD1  1 1 
ATOM   192  H  HD2  . PHE   A 1 19  ? 2.837   13.331  6.203   0   64.76  ? 712  PHE   A HD2  1 1 
ATOM   193  H  HE1  . PHE   A 1 19  ? 5.599   14.141  2.237   0   64.52  ? 712  PHE   A HE1  1 1 
ATOM   194  H  HE2  . PHE   A 1 19  ? 3.592   11.454  4.819   0   65.26  ? 712  PHE   A HE2  1 1 
ATOM   195  H  HZ   . PHE   A 1 19  ? 4.976   11.862  2.848   0   64.58  ? 712  PHE   A HZ   1 1 
ATOM   196  N  N    . LYS   A 1 20  ? 3.956   19.011  6.974   1   56.56  ? 713  LYS   A N    1 1 
ATOM   197  C  CA   . LYS   A 1 20  ? 3.43    20.273  7.515   1   55.94  ? 713  LYS   A CA   1 1 
ATOM   198  C  C    . LYS   A 1 20  ? 2.956   21.216  6.386   1   54.98  ? 713  LYS   A C    1 1 
ATOM   199  O  O    . LYS   A 1 20  ? 3.304   21.015  5.223   1   55.08  ? 713  LYS   A O    1 1 
ATOM   200  C  CB   . LYS   A 1 20  ? 4.495   20.986  8.388   1   57.62  ? 713  LYS   A CB   1 1 
ATOM   201  C  CG   . LYS   A 1 20  ? 5.042   20.181  9.574   1   61.67  ? 713  LYS   A CG   1 1 
ATOM   202  C  CD   . LYS   A 1 20  ? 4.04    20.029  10.741  1   66.1   ? 713  LYS   A CD   1 1 
ATOM   203  C  CE   . LYS   A 1 20  ? 4.245   18.746  11.519  1   69.89  ? 713  LYS   A CE   1 1 
ATOM   204  N  NZ   . LYS   A 1 20  ? 3.113   18.443  12.444  1   72.04  ? 713  LYS   A NZ   1 1 
ATOM   205  H  H    . LYS   A 1 20  ? 4.524   19.151  6.144   0   61.62  ? 713  LYS   A H    1 1 
ATOM   206  H  HA   . LYS   A 1 20  ? 2.55    20.076  8.125   0   61.78  ? 713  LYS   A HA   1 1 
ATOM   207  H  HB2  . LYS   A 1 20  ? 5.342   21.245  7.755   0   64.33  ? 713  LYS   A HB2  1 1 
ATOM   208  H  HB3  . LYS   A 1 20  ? 4.055   21.898  8.789   0   64.72  ? 713  LYS   A HB3  1 1 
ATOM   209  H  HG2  . LYS   A 1 20  ? 5.348   19.193  9.233   0   68.41  ? 713  LYS   A HG2  1 1 
ATOM   210  H  HG3  . LYS   A 1 20  ? 5.911   20.708  9.965   0   69.42  ? 713  LYS   A HG3  1 1 
ATOM   211  H  HD2  . LYS   A 1 20  ? 4.188   20.857  11.432  0   74.14  ? 713  LYS   A HD2  1 1 
ATOM   212  H  HD3  . LYS   A 1 20  ? 3.014   20.043  10.376  0   73.09  ? 713  LYS   A HD3  1 1 
ATOM   213  H  HE2  . LYS   A 1 20  ? 4.341   17.907  10.831  0   76.84  ? 713  LYS   A HE2  1 1 
ATOM   214  H  HE3  . LYS   A 1 20  ? 5.146   18.841  12.123  0   77.9   ? 713  LYS   A HE3  1 1 
ATOM   215  H  HZ1  . LYS   A 1 20  ? 3.075   17.443  12.614  0   79.54  ? 713  LYS   A HZ1  1 1 
ATOM   216  H  HZ2  . LYS   A 1 20  ? 3.256   18.911  13.333  0   80.3   ? 713  LYS   A HZ2  1 1 
ATOM   217  H  HZ3  . LYS   A 1 20  ? 2.224   18.741  12.056  0   79.43  ? 713  LYS   A HZ3  1 1 
ATOM   218  N  N    . LYS   A 1 21  ? 2.15    22.235  6.741   1   53.91  ? 714  LYS   A N    1 1 
ATOM   219  C  CA   . LYS   A 1 21  ? 1.596   23.22   5.8     1   53.58  ? 714  LYS   A CA   1 1 
ATOM   220  C  C    . LYS   A 1 21  ? 0.862   22.563  4.609   1   52.71  ? 714  LYS   A C    1 1 
ATOM   221  O  O    . LYS   A 1 21  ? 0.991   23.038  3.48    1   52.86  ? 714  LYS   A O    1 1 
ATOM   222  C  CB   . LYS   A 1 21  ? 2.686   24.196  5.299   1   55.46  ? 714  LYS   A CB   1 1 
ATOM   223  C  CG   . LYS   A 1 21  ? 3.302   25.075  6.376   1   59.4   ? 714  LYS   A CG   1 1 
ATOM   224  C  CD   . LYS   A 1 21  ? 4.13    26.189  5.737   1   63.9   ? 714  LYS   A CD   1 1 
ATOM   225  C  CE   . LYS   A 1 21  ? 5.051   26.878  6.719   1   67.83  ? 714  LYS   A CE   1 1 
ATOM   226  N  NZ   . LYS   A 1 21  ? 5.995   27.838  6.065   1   69.97  ? 714  LYS   A NZ   1 1 
ATOM   227  H  H    . LYS   A 1 21  ? 1.854   22.399  7.698   0   60.32  ? 714  LYS   A H    1 1 
ATOM   228  H  HA   . LYS   A 1 21  ? 0.857   23.815  6.336   0   59.89  ? 714  LYS   A HA   1 1 
ATOM   229  H  HB2  . LYS   A 1 21  ? 3.489   23.627  4.834   0   61.37  ? 714  LYS   A HB2  1 1 
ATOM   230  H  HB3  . LYS   A 1 21  ? 2.246   24.869  4.564   0   61.64  ? 714  LYS   A HB3  1 1 
ATOM   231  H  HG2  . LYS   A 1 21  ? 2.509   25.53   6.967   0   67.16  ? 714  LYS   A HG2  1 1 
ATOM   232  H  HG3  . LYS   A 1 21  ? 3.951   24.475  7.013   0   66.88  ? 714  LYS   A HG3  1 1 
ATOM   233  H  HD2  . LYS   A 1 21  ? 4.734   25.764  4.937   0   71.4   ? 714  LYS   A HD2  1 1 
ATOM   234  H  HD3  . LYS   A 1 21  ? 3.455   26.94   5.328   0   71.96  ? 714  LYS   A HD3  1 1 
ATOM   235  H  HE2  . LYS   A 1 21  ? 4.449   27.444  7.427   0   77.53  ? 714  LYS   A HE2  1 1 
ATOM   236  H  HE3  . LYS   A 1 21  ? 5.644   26.13   7.244   0   76.95  ? 714  LYS   A HE3  1 1 
ATOM   237  H  HZ1  . LYS   A 1 21  ? 6.89    27.811  6.542   0   80.43  ? 714  LYS   A HZ1  1 1 
ATOM   238  H  HZ2  . LYS   A 1 21  ? 6.142   27.618  5.085   0   79.25  ? 714  LYS   A HZ2  1 1 
ATOM   239  H  HZ3  . LYS   A 1 21  ? 5.626   28.781  6.134   0   80.51  ? 714  LYS   A HZ3  1 1 
ATOM   240  N  N    . ILE   A 1 22  ? 0.077   21.496  4.858   1   51.66  ? 715  ILE   A N    1 1 
ATOM   241  C  CA   . ILE   A 1 22  ? -0.647  20.826  3.775   1   51.25  ? 715  ILE   A CA   1 1 
ATOM   242  C  C    . ILE   A 1 22  ? -1.832  21.713  3.41    1   50.77  ? 715  ILE   A C    1 1 
ATOM   243  O  O    . ILE   A 1 22  ? -2.645  22.023  4.275   1   50.73  ? 715  ILE   A O    1 1 
ATOM   244  C  CB   . ILE   A 1 22  ? -1.095  19.382  4.126   1   51.63  ? 715  ILE   A CB   1 1 
ATOM   245  C  CG1  . ILE   A 1 22  ? 0.127   18.483  4.474   1   52.36  ? 715  ILE   A CG1  1 1 
ATOM   246  C  CG2  . ILE   A 1 22  ? -1.88   18.772  2.941   1   52.08  ? 715  ILE   A CG2  1 1 
ATOM   247  C  CD1  . ILE   A 1 22  ? -0.199  17.302  5.321   1   53.5   ? 715  ILE   A CD1  1 1 
ATOM   248  H  H    . ILE   A 1 22  ? -0.103  21.113  5.781   0   56.57  ? 715  ILE   A H    1 1 
ATOM   249  H  HA   . ILE   A 1 22  ? 0.007   20.747  2.907   0   54.78  ? 715  ILE   A HA   1 1 
ATOM   250  H  HB   . ILE   A 1 22  ? -1.76   19.436  4.987   0   55.81  ? 715  ILE   A HB   1 1 
ATOM   251  H  HG12 . ILE   A 1 22  ? 0.566   18.11   3.549   0   55.55  ? 715  ILE   A HG12 1 1 
ATOM   252  H  HG13 . ILE   A 1 22  ? 0.868   19.064  5.02    0   56.36  ? 715  ILE   A HG13 1 1 
ATOM   253  H  HG21 . ILE   A 1 22  ? -2.174  17.752  3.183   0   55.24  ? 715  ILE   A HG21 1 1 
ATOM   254  H  HG22 . ILE   A 1 22  ? -2.78   19.351  2.739   0   55.42  ? 715  ILE   A HG22 1 1 
ATOM   255  H  HG23 . ILE   A 1 22  ? -1.238  18.767  2.062   0   54.82  ? 715  ILE   A HG23 1 1 
ATOM   256  H  HD11 . ILE   A 1 22  ? 0.715   16.744  5.51    0   57.34  ? 715  ILE   A HD11 1 1 
ATOM   257  H  HD12 . ILE   A 1 22  ? -0.621  17.649  6.263   0   57.81  ? 715  ILE   A HD12 1 1 
ATOM   258  H  HD13 . ILE   A 1 22  ? -0.913  16.658  4.809   0   57.08  ? 715  ILE   A HD13 1 1 
ATOM   259  N  N    . LYS   A 1 23  ? -1.911  22.129  2.136   1   50.29  ? 716  LYS   A N    1 1 
ATOM   260  C  CA   . LYS   A 1 23  ? -2.954  23.009  1.613   1   50.29  ? 716  LYS   A CA   1 1 
ATOM   261  C  C    . LYS   A 1 23  ? -3.371  22.508  0.217   1   49.9   ? 716  LYS   A C    1 1 
ATOM   262  O  O    . LYS   A 1 23  ? -2.516  22.101  -0.563  1   50.1   ? 716  LYS   A O    1 1 
ATOM   263  C  CB   . LYS   A 1 23  ? -2.414  24.455  1.563   1   52.17  ? 716  LYS   A CB   1 1 
ATOM   264  C  CG   . LYS   A 1 23  ? -3.241  25.447  0.749   1   56.83  ? 716  LYS   A CG   1 1 
ATOM   265  C  CD   . LYS   A 1 23  ? -2.712  26.865  0.909   1   61.28  ? 716  LYS   A CD   1 1 
ATOM   266  C  CE   . LYS   A 1 23  ? -3.319  27.813  -0.105  1   64.8   ? 716  LYS   A CE   1 1 
ATOM   267  N  NZ   . LYS   A 1 23  ? -2.703  29.173  -0.075  1   66.87  ? 716  LYS   A NZ   1 1 
ATOM   268  H  H    . LYS   A 1 23  ? -1.248  21.859  1.417   0   53.62  ? 716  LYS   A H    1 1 
ATOM   269  H  HA   . LYS   A 1 23  ? -3.828  22.987  2.262   0   54.76  ? 716  LYS   A HA   1 1 
ATOM   270  H  HB2  . LYS   A 1 23  ? -2.364  24.835  2.582   0   57.39  ? 716  LYS   A HB2  1 1 
ATOM   271  H  HB3  . LYS   A 1 23  ? -1.412  24.436  1.136   0   56.52  ? 716  LYS   A HB3  1 1 
ATOM   272  H  HG2  . LYS   A 1 23  ? -3.186  25.197  -0.31   0   61.14  ? 716  LYS   A HG2  1 1 
ATOM   273  H  HG3  . LYS   A 1 23  ? -4.276  25.424  1.087   0   62.02  ? 716  LYS   A HG3  1 1 
ATOM   274  H  HD2  . LYS   A 1 23  ? -2.955  27.23   1.906   0   67.67  ? 716  LYS   A HD2  1 1 
ATOM   275  H  HD3  . LYS   A 1 23  ? -1.632  26.855  0.767   0   66.85  ? 716  LYS   A HD3  1 1 
ATOM   276  H  HE2  . LYS   A 1 23  ? -3.183  27.41   -1.108  0   70.1   ? 716  LYS   A HE2  1 1 
ATOM   277  H  HE3  . LYS   A 1 23  ? -4.38   27.93   0.11    0   71.12  ? 716  LYS   A HE3  1 1 
ATOM   278  H  HZ1  . LYS   A 1 23  ? -2.696  29.563  -1.012  0   73.65  ? 716  LYS   A HZ1  1 1 
ATOM   279  H  HZ2  . LYS   A 1 23  ? -3.249  29.786  0.521   0   74.55  ? 716  LYS   A HZ2  1 1 
ATOM   280  H  HZ3  . LYS   A 1 23  ? -1.749  29.145  0.271   0   73.79  ? 716  LYS   A HZ3  1 1 
ATOM   281  N  N    . VAL   A 1 24  ? -4.677  22.558  -0.095  1   49.19  ? 717  VAL   A N    1 1 
ATOM   282  C  CA   . VAL   A 1 24  ? -5.231  22.102  -1.379  1   49.16  ? 717  VAL   A CA   1 1 
ATOM   283  C  C    . VAL   A 1 24  ? -4.605  22.878  -2.55   1   48.63  ? 717  VAL   A C    1 1 
ATOM   284  O  O    . VAL   A 1 24  ? -4.341  24.073  -2.422  1   48.59  ? 717  VAL   A O    1 1 
ATOM   285  C  CB   . VAL   A 1 24  ? -6.791  22.238  -1.394  1   50.22  ? 717  VAL   A CB   1 1 
ATOM   286  C  CG1  . VAL   A 1 24  ? -7.379  21.996  -2.785  1   50.8   ? 717  VAL   A CG1  1 1 
ATOM   287  C  CG2  . VAL   A 1 24  ? -7.443  21.293  -0.392  1   50.79  ? 717  VAL   A CG2  1 1 
ATOM   288  H  H    . VAL   A 1 24  ? -5.367  22.958  0.532   0   53.31  ? 717  VAL   A H    1 1 
ATOM   289  H  HA   . VAL   A 1 24  ? -4.991  21.048  -1.512  0   51.74  ? 717  VAL   A HA   1 1 
ATOM   290  H  HB   . VAL   A 1 24  ? -7.051  23.255  -1.104  0   54.38  ? 717  VAL   A HB   1 1 
ATOM   291  H  HG11 . VAL   A 1 24  ? -8.464  22.061  -2.712  0   54.56  ? 717  VAL   A HG11 1 1 
ATOM   292  H  HG12 . VAL   A 1 24  ? -7.029  22.748  -3.49   0   53.86  ? 717  VAL   A HG12 1 1 
ATOM   293  H  HG13 . VAL   A 1 24  ? -7.093  21.001  -3.122  0   53.51  ? 717  VAL   A HG13 1 1 
ATOM   294  H  HG21 . VAL   A 1 24  ? -8.523  21.422  -0.441  0   55.26  ? 717  VAL   A HG21 1 1 
ATOM   295  H  HG22 . VAL   A 1 24  ? -7.18   20.272  -0.661  0   54.27  ? 717  VAL   A HG22 1 1 
ATOM   296  H  HG23 . VAL   A 1 24  ? -7.087  21.525  0.611   0   55.06  ? 717  VAL   A HG23 1 1 
ATOM   297  N  N    . LEU   A 1 25  ? -4.361  22.185  -3.68   1   48.12  ? 718  LEU   A N    1 1 
ATOM   298  C  CA   . LEU   A 1 25  ? -3.857  22.783  -4.92   1   48.13  ? 718  LEU   A CA   1 1 
ATOM   299  C  C    . LEU   A 1 25  ? -4.961  22.731  -5.991  1   48.26  ? 718  LEU   A C    1 1 
ATOM   300  O  O    . LEU   A 1 25  ? -5.187  23.717  -6.688  1   48.84  ? 718  LEU   A O    1 1 
ATOM   301  C  CB   . LEU   A 1 25  ? -2.606  22.045  -5.446  1   48.16  ? 718  LEU   A CB   1 1 
ATOM   302  C  CG   . LEU   A 1 25  ? -1.213  22.586  -5.109  1   49.43  ? 718  LEU   A CG   1 1 
ATOM   303  C  CD1  . LEU   A 1 25  ? -0.163  21.618  -5.601  1   50.06  ? 718  LEU   A CD1  1 1 
ATOM   304  C  CD2  . LEU   A 1 25  ? -0.931  23.935  -5.78   1   50.14  ? 718  LEU   A CD2  1 1 
ATOM   305  H  H    . LEU   A 1 25  ? -4.505  21.183  -3.75   0   49.79  ? 718  LEU   A H    1 1 
ATOM   306  H  HA   . LEU   A 1 25  ? -3.632  23.835  -4.754  0   50.22  ? 718  LEU   A HA   1 1 
ATOM   307  H  HB2  . LEU   A 1 25  ? -2.643  21.021  -5.077  0   48.97  ? 718  LEU   A HB2  1 1 
ATOM   308  H  HB3  . LEU   A 1 25  ? -2.675  22.031  -6.533  0   48.81  ? 718  LEU   A HB3  1 1 
ATOM   309  H  HG   . LEU   A 1 25  ? -1.111  22.701  -4.031  0   51.03  ? 718  LEU   A HG   1 1 
ATOM   310  H  HD11 . LEU   A 1 25  ? 0.827   22.049  -5.471  0   50.97  ? 718  LEU   A HD11 1 1 
ATOM   311  H  HD12 . LEU   A 1 25  ? -0.251  20.686  -5.045  0   50.58  ? 718  LEU   A HD12 1 1 
ATOM   312  H  HD13 . LEU   A 1 25  ? -0.334  21.434  -6.66   0   50.33  ? 718  LEU   A HD13 1 1 
ATOM   313  H  HD21 . LEU   A 1 25  ? 0.087   24.238  -5.543  0   51.93  ? 718  LEU   A HD21 1 1 
ATOM   314  H  HD22 . LEU   A 1 25  ? -1.038  23.819  -6.858  0   51.28  ? 718  LEU   A HD22 1 1 
ATOM   315  H  HD23 . LEU   A 1 25  ? -1.617  24.7    -5.421  0   52.16  ? 718  LEU   A HD23 1 1 
ATOM   316  N  N    . GLY   A 1 26  ? -5.633  21.589  -6.116  1   47.68  ? 719  GLY   A N    1 1 
ATOM   317  C  CA   . GLY   A 1 26  ? -6.702  21.425  -7.089  1   47.66  ? 719  GLY   A CA   1 1 
ATOM   318  C  C    . GLY   A 1 26  ? -7.369  20.066  -7.016  1   47.58  ? 719  GLY   A C    1 1 
ATOM   319  O  O    . GLY   A 1 26  ? -6.904  19.172  -6.299  1   47.87  ? 719  GLY   A O    1 1 
ATOM   320  H  H    . GLY   A 1 26  ? -5.453  20.749  -5.575  0   48.89  ? 719  GLY   A H    1 1 
ATOM   321  H  HA2  . GLY   A 1 26  ? -7.461  22.19   -6.929  0   49.56  ? 719  GLY   A HA2  1 1 
ATOM   322  H  HA3  . GLY   A 1 26  ? -6.298  21.555  -8.092  0   48.57  ? 719  GLY   A HA3  1 1 
ATOM   323  N  N    . SER   A 1 27  ? -8.464  19.906  -7.774  1   46.98  ? 720  SER   A N    1 1 
ATOM   324  C  CA   . SER   A 1 27  ? -9.244  18.674  -7.839  1   47.06  ? 720  SER   A CA   1 1 
ATOM   325  C  C    . SER   A 1 27  ? -9.786  18.438  -9.254  1   46.61  ? 720  SER   A C    1 1 
ATOM   326  O  O    . SER   A 1 27  ? -9.92   19.374  -10.041 1   46.78  ? 720  SER   A O    1 1 
ATOM   327  C  CB   . SER   A 1 27  ? -10.404 18.733  -6.843  1   48.91  ? 720  SER   A CB   1 1 
ATOM   328  O  OG   . SER   A 1 27  ? -10.009 18.483  -5.501  1   51.75  ? 720  SER   A OG   1 1 
ATOM   329  H  H    . SER   A 1 27  ? -8.837  20.64   -8.368  0   48.67  ? 720  SER   A H    1 1 
ATOM   330  H  HA   . SER   A 1 27  ? -8.617  17.821  -7.587  0   48.47  ? 720  SER   A HA   1 1 
ATOM   331  H  HB2  . SER   A 1 27  ? -10.851 19.725  -6.895  0   52.04  ? 720  SER   A HB2  1 1 
ATOM   332  H  HB3  . SER   A 1 27  ? -11.143 17.985  -7.126  0   51.97  ? 720  SER   A HB3  1 1 
ATOM   333  H  HG   . SER   A 1 27  ? -9.075  18.77   -5.322  0   54.17  ? 720  SER   A HG   1 1 
ATOM   334  N  N    . GLY   A 1 28  ? -10.095 17.184  -9.557  1   45.95  ? 721  GLY   A N    1 1 
ATOM   335  C  CA   . GLY   A 1 28  ? -10.619 16.792  -10.858 1   45.67  ? 721  GLY   A CA   1 1 
ATOM   336  C  C    . GLY   A 1 28  ? -10.674 15.287  -11.001 1   45.12  ? 721  GLY   A C    1 1 
ATOM   337  O  O    . GLY   A 1 28  ? -10.769 14.573  -10     1   45.27  ? 721  GLY   A O    1 1 
ATOM   338  H  H    . GLY   A 1 28  ? -9.997  16.407  -8.912  0   47.73  ? 721  GLY   A H    1 1 
ATOM   339  H  HA2  . GLY   A 1 28  ? -11.624 17.191  -10.984 0   47.91  ? 721  GLY   A HA2  1 1 
ATOM   340  H  HA3  . GLY   A 1 28  ? -9.983  17.195  -11.645 0   46.7   ? 721  GLY   A HA3  1 1 
ATOM   341  N  N    . ALA   A 1 29  ? -10.594 14.786  -12.239 1   44.4   ? 722  ALA   A N    1 1 
ATOM   342  C  CA   . ALA   A 1 29  ? -10.638 13.345  -12.511 1   44.11  ? 722  ALA   A CA   1 1 
ATOM   343  C  C    . ALA   A 1 29  ? -9.475  12.574  -11.865 1   43.3   ? 722  ALA   A C    1 1 
ATOM   344  O  O    . ALA   A 1 29  ? -9.612  11.382  -11.593 1   43.61  ? 722  ALA   A O    1 1 
ATOM   345  C  CB   . ALA   A 1 29  ? -10.652 13.107  -14.006 1   44.51  ? 722  ALA   A CB   1 1 
ATOM   346  H  H    . ALA   A 1 29  ? -10.499 15.355  -13.074 0   45.49  ? 722  ALA   A H    1 1 
ATOM   347  H  HA   . ALA   A 1 29  ? -11.567 12.944  -12.11  0   46.55  ? 722  ALA   A HA   1 1 
ATOM   348  H  HB1  . ALA   A 1 29  ? -10.683 12.034  -14.19  0   46.11  ? 722  ALA   A HB1  1 1 
ATOM   349  H  HB2  . ALA   A 1 29  ? -11.533 13.584  -14.433 0   46.25  ? 722  ALA   A HB2  1 1 
ATOM   350  H  HB3  . ALA   A 1 29  ? -9.749  13.534  -14.442 0   45.11  ? 722  ALA   A HB3  1 1 
ATOM   351  N  N    . PHE   A 1 30  ? -8.338  13.256  -11.632 1   41.9   ? 723  PHE   A N    1 1 
ATOM   352  C  CA   . PHE   A 1 30  ? -7.168  12.711  -10.937 1   41.09  ? 723  PHE   A CA   1 1 
ATOM   353  C  C    . PHE   A 1 30  ? -7.371  12.541  -9.418  1   41.03  ? 723  PHE   A C    1 1 
ATOM   354  O  O    . PHE   A 1 30  ? -6.534  11.907  -8.778  1   41.36  ? 723  PHE   A O    1 1 
ATOM   355  C  CB   . PHE   A 1 30  ? -5.936  13.618  -11.168 1   40.52  ? 723  PHE   A CB   1 1 
ATOM   356  C  CG   . PHE   A 1 30  ? -6.116  15.079  -10.802 1   40.23  ? 723  PHE   A CG   1 1 
ATOM   357  C  CD1  . PHE   A 1 30  ? -5.872  15.525  -9.517  1   40.61  ? 723  PHE   A CD1  1 1 
ATOM   358  C  CD2  . PHE   A 1 30  ? -6.499  16.005  -11.753 1   40.65  ? 723  PHE   A CD2  1 1 
ATOM   359  C  CE1  . PHE   A 1 30  ? -6.06   16.856  -9.181  1   41.2   ? 723  PHE   A CE1  1 1 
ATOM   360  C  CE2  . PHE   A 1 30  ? -6.655  17.342  -11.421 1   41.32  ? 723  PHE   A CE2  1 1 
ATOM   361  C  CZ   . PHE   A 1 30  ? -6.428  17.761  -10.138 1   41.05  ? 723  PHE   A CZ   1 1 
ATOM   362  H  H    . PHE   A 1 30  ? -8.195  14.202  -11.969 0   42.09  ? 723  PHE   A H    1 1 
ATOM   363  H  HA   . PHE   A 1 30  ? -6.936  11.733  -11.354 0   41.38  ? 723  PHE   A HA   1 1 
ATOM   364  H  HB2  . PHE   A 1 30  ? -5.103  13.234  -10.581 0   39.9   ? 723  PHE   A HB2  1 1 
ATOM   365  H  HB3  . PHE   A 1 30  ? -5.678  13.578  -12.225 0   39.65  ? 723  PHE   A HB3  1 1 
ATOM   366  H  HD1  . PHE   A 1 30  ? -5.588  14.818  -8.756  0   40.41  ? 723  PHE   A HD1  1 1 
ATOM   367  H  HD2  . PHE   A 1 30  ? -6.675  15.684  -12.766 0   39.81  ? 723  PHE   A HD2  1 1 
ATOM   368  H  HE1  . PHE   A 1 30  ? -5.87   17.186  -8.174  0   41.25  ? 723  PHE   A HE1  1 1 
ATOM   369  H  HE2  . PHE   A 1 30  ? -6.957  18.049  -12.174 0   40.74  ? 723  PHE   A HE2  1 1 
ATOM   370  H  HZ   . PHE   A 1 30  ? -6.556  18.799  -9.88   0   40.97  ? 723  PHE   A HZ   1 1 
ATOM   371  N  N    . GLY   A 1 31  ? -8.417  13.148  -8.852  1   40.61  ? 724  GLY   A N    1 1 
ATOM   372  C  CA   . GLY   A 1 31  ? -8.698  13.111  -7.423  1   40.85  ? 724  GLY   A CA   1 1 
ATOM   373  C  C    . GLY   A 1 31  ? -8.375  14.46   -6.818  1   40.93  ? 724  GLY   A C    1 1 
ATOM   374  O  O    . GLY   A 1 31  ? -8.714  15.484  -7.409  1   41.1   ? 724  GLY   A O    1 1 
ATOM   375  H  H    . GLY   A 1 31  ? -9.109  13.694  -9.354  0   42.01  ? 724  GLY   A H    1 1 
ATOM   376  H  HA2  . GLY   A 1 31  ? -9.755  12.906  -7.263  0   43.39  ? 724  GLY   A HA2  1 1 
ATOM   377  H  HA3  . GLY   A 1 31  ? -8.12   12.336  -6.921  0   42.68  ? 724  GLY   A HA3  1 1 
ATOM   378  N  N    . THR   A 1 32  ? -7.687  14.48   -5.666  1   40.72  ? 725  THR   A N    1 1 
ATOM   379  C  CA   . THR   A 1 32  ? -7.287  15.721  -5.004  1   40.95  ? 725  THR   A CA   1 1 
ATOM   380  C  C    . THR   A 1 32  ? -5.769  15.753  -4.852  1   40.59  ? 725  THR   A C    1 1 
ATOM   381  O  O    . THR   A 1 32  ? -5.177  14.753  -4.451  1   40.64  ? 725  THR   A O    1 1 
ATOM   382  C  CB   . THR   A 1 32  ? -7.977  15.839  -3.637  1   42.69  ? 725  THR   A CB   1 1 
ATOM   383  O  OG1  . THR   A 1 32  ? -9.388  15.639  -3.803  1   44.15  ? 725  THR   A OG1  1 1 
ATOM   384  C  CG2  . THR   A 1 32  ? -7.734  17.191  -2.969  1   43.04  ? 725  THR   A CG2  1 1 
ATOM   385  H  H    . THR   A 1 32  ? -7.398  13.647  -5.162  0   42.48  ? 725  THR   A H    1 1 
ATOM   386  H  HA   . THR   A 1 32  ? -7.587  16.585  -5.596  0   42.44  ? 725  THR   A HA   1 1 
ATOM   387  H  HB   . THR   A 1 32  ? -7.587  15.064  -2.979  0   45.09  ? 725  THR   A HB   1 1 
ATOM   388  H  HG1  . THR   A 1 32  ? -9.781  16.393  -4.316  0   47.21  ? 725  THR   A HG1  1 1 
ATOM   389  H  HG21 . THR   A 1 32  ? -8.258  17.226  -2.015  0   46.09  ? 725  THR   A HG21 1 1 
ATOM   390  H  HG22 . THR   A 1 32  ? -6.673  17.35   -2.78   0   45.09  ? 725  THR   A HG22 1 1 
ATOM   391  H  HG23 . THR   A 1 32  ? -8.102  18      -3.597  0   45.51  ? 725  THR   A HG23 1 1 
ATOM   392  N  N    . VAL   A 1 33  ? -5.147  16.902  -5.178  1   40.12  ? 726  VAL   A N    1 1 
ATOM   393  C  CA   . VAL   A 1 33  ? -3.71   17.13   -5.042  1   40.2   ? 726  VAL   A CA   1 1 
ATOM   394  C  C    . VAL   A 1 33  ? -3.523  18.31   -4.071  1   40.53  ? 726  VAL   A C    1 1 
ATOM   395  O  O    . VAL   A 1 33  ? -4.186  19.338  -4.213  1   40.34  ? 726  VAL   A O    1 1 
ATOM   396  C  CB   . VAL   A 1 33  ? -3.037  17.399  -6.418  1   40.74  ? 726  VAL   A CB   1 1 
ATOM   397  C  CG1  . VAL   A 1 33  ? -1.597  17.9    -6.266  1   41.14  ? 726  VAL   A CG1  1 1 
ATOM   398  C  CG2  . VAL   A 1 33  ? -3.065  16.152  -7.293  1   41.18  ? 726  VAL   A CG2  1 1 
ATOM   399  H  H    . VAL   A 1 33  ? -5.629  17.715  -5.547  0   40.9   ? 726  VAL   A H    1 1 
ATOM   400  H  HA   . VAL   A 1 33  ? -3.232  16.252  -4.611  0   40.53  ? 726  VAL   A HA   1 1 
ATOM   401  H  HB   . VAL   A 1 33  ? -3.601  18.173  -6.936  0   40.57  ? 726  VAL   A HB   1 1 
ATOM   402  H  HG11 . VAL   A 1 33  ? -1.176  18.031  -7.262  0   40.51  ? 726  VAL   A HG11 1 1 
ATOM   403  H  HG12 . VAL   A 1 33  ? -1.572  18.856  -5.744  0   41.13  ? 726  VAL   A HG12 1 1 
ATOM   404  H  HG13 . VAL   A 1 33  ? -1.02   17.156  -5.719  0   40.86  ? 726  VAL   A HG13 1 1 
ATOM   405  H  HG21 . VAL   A 1 33  ? -2.579  16.381  -8.24   0   40.31  ? 726  VAL   A HG21 1 1 
ATOM   406  H  HG22 . VAL   A 1 33  ? -2.531  15.349  -6.786  0   40.72  ? 726  VAL   A HG22 1 1 
ATOM   407  H  HG23 . VAL   A 1 33  ? -4.099  15.859  -7.468  0   40.85  ? 726  VAL   A HG23 1 1 
ATOM   408  N  N    . TYR   A 1 34  ? -2.631  18.143  -3.082  1   40.81  ? 727  TYR   A N    1 1 
ATOM   409  C  CA   . TYR   A 1 34  ? -2.272  19.162  -2.099  1   41.86  ? 727  TYR   A CA   1 1 
ATOM   410  C  C    . TYR   A 1 34  ? -0.764  19.468  -2.213  1   42.79  ? 727  TYR   A C    1 1 
ATOM   411  O  O    . TYR   A 1 34  ? -0.026  18.741  -2.877  1   42.98  ? 727  TYR   A O    1 1 
ATOM   412  C  CB   . TYR   A 1 34  ? -2.564  18.676  -0.659  1   41.85  ? 727  TYR   A CB   1 1 
ATOM   413  C  CG   . TYR   A 1 34  ? -3.885  17.971  -0.446  1   42.11  ? 727  TYR   A CG   1 1 
ATOM   414  C  CD1  . TYR   A 1 34  ? -3.984  16.591  -0.555  1   42.87  ? 727  TYR   A CD1  1 1 
ATOM   415  C  CD2  . TYR   A 1 34  ? -4.986  18.658  0.037   1   42.75  ? 727  TYR   A CD2  1 1 
ATOM   416  C  CE1  . TYR   A 1 34  ? -5.183  15.932  -0.309  1   43.6   ? 727  TYR   A CE1  1 1 
ATOM   417  C  CE2  . TYR   A 1 34  ? -6.192  18.016  0.272   1   43.48  ? 727  TYR   A CE2  1 1 
ATOM   418  C  CZ   . TYR   A 1 34  ? -6.281  16.65   0.126   1   44.28  ? 727  TYR   A CZ   1 1 
ATOM   419  O  OH   . TYR   A 1 34  ? -7.48   16.042  0.388   1   45.47  ? 727  TYR   A OH   1 1 
ATOM   420  H  H    . TYR   A 1 34  ? -2.123  17.278  -2.931  0   41.57  ? 727  TYR   A H    1 1 
ATOM   421  H  HA   . TYR   A 1 34  ? -2.824  20.086  -2.265  0   43.41  ? 727  TYR   A HA   1 1 
ATOM   422  H  HB2  . TYR   A 1 34  ? -1.763  18.015  -0.336  0   43.58  ? 727  TYR   A HB2  1 1 
ATOM   423  H  HB3  . TYR   A 1 34  ? -2.567  19.551  -0.012  0   44.09  ? 727  TYR   A HB3  1 1 
ATOM   424  H  HD1  . TYR   A 1 34  ? -3.135  16.028  -0.902  0   44.48  ? 727  TYR   A HD1  1 1 
ATOM   425  H  HD2  . TYR   A 1 34  ? -4.925  19.724  0.176   0   45.65  ? 727  TYR   A HD2  1 1 
ATOM   426  H  HE1  . TYR   A 1 34  ? -5.246  14.866  -0.445  0   45.97  ? 727  TYR   A HE1  1 1 
ATOM   427  H  HE2  . TYR   A 1 34  ? -7.04   18.574  0.627   0   47.08  ? 727  TYR   A HE2  1 1 
ATOM   428  H  HH   . TYR   A 1 34  ? -7.501  15.126  0.006   0   48.9   ? 727  TYR   A HH   1 1 
ATOM   429  N  N    . LYS   A 1 35  ? -0.315  20.544  -1.557  1   43.38  ? 728  LYS   A N    1 1 
ATOM   430  C  CA   . LYS   A 1 35  ? 1.101   20.909  -1.461  1   44.43  ? 728  LYS   A CA   1 1 
ATOM   431  C  C    . LYS   A 1 35  ? 1.451   20.994  0.019   1   45.52  ? 728  LYS   A C    1 1 
ATOM   432  O  O    . LYS   A 1 35  ? 0.63    21.417  0.833   1   45.83  ? 728  LYS   A O    1 1 
ATOM   433  C  CB   . LYS   A 1 35  ? 1.446   22.229  -2.186  1   45.96  ? 728  LYS   A CB   1 1 
ATOM   434  C  CG   . LYS   A 1 35  ? 0.706   23.472  -1.704  1   49.92  ? 728  LYS   A CG   1 1 
ATOM   435  C  CD   . LYS   A 1 35  ? 1.199   24.724  -2.415  1   54.37  ? 728  LYS   A CD   1 1 
ATOM   436  C  CE   . LYS   A 1 35  ? 0.357   25.937  -2.096  1   58.31  ? 728  LYS   A CE   1 1 
ATOM   437  N  NZ   . LYS   A 1 35  ? 0.587   26.443  -0.714  1   60.85  ? 728  LYS   A NZ   1 1 
ATOM   438  H  H    . LYS   A 1 35  ? -0.929  21.182  -1.063  0   45.49  ? 728  LYS   A H    1 1 
ATOM   439  H  HA   . LYS   A 1 35  ? 1.718   20.126  -1.9    0   45.98  ? 728  LYS   A HA   1 1 
ATOM   440  H  HB2  . LYS   A 1 35  ? 2.513   22.417  -2.071  0   48.33  ? 728  LYS   A HB2  1 1 
ATOM   441  H  HB3  . LYS   A 1 35  ? 1.216   22.105  -3.242  0   47.63  ? 728  LYS   A HB3  1 1 
ATOM   442  H  HG2  . LYS   A 1 35  ? -0.357  23.357  -1.914  0   52.53  ? 728  LYS   A HG2  1 1 
ATOM   443  H  HG3  . LYS   A 1 35  ? 0.865   23.622  -0.637  0   53.15  ? 728  LYS   A HG3  1 1 
ATOM   444  H  HD2  . LYS   A 1 35  ? 2.224   24.929  -2.108  0   57.87  ? 728  LYS   A HD2  1 1 
ATOM   445  H  HD3  . LYS   A 1 35  ? 1.159   24.563  -3.491  0   57.05  ? 728  LYS   A HD3  1 1 
ATOM   446  H  HE2  . LYS   A 1 35  ? 0.613   26.737  -2.789  0   62.42  ? 728  LYS   A HE2  1 1 
ATOM   447  H  HE3  . LYS   A 1 35  ? -0.698  25.683  -2.191  0   61.97  ? 728  LYS   A HE3  1 1 
ATOM   448  H  HZ1  . LYS   A 1 35  ? 0.102   27.326  -0.592  0   66.18  ? 728  LYS   A HZ1  1 1 
ATOM   449  H  HZ2  . LYS   A 1 35  ? 0.236   25.791  -0.021  0   65.41  ? 728  LYS   A HZ2  1 1 
ATOM   450  H  HZ3  . LYS   A 1 35  ? 1.578   26.592  -0.553  0   65.84  ? 728  LYS   A HZ3  1 1 
ATOM   451  N  N    . GLY   A 1 36  ? 2.65    20.568  0.36    1   45.94  ? 729  GLY   A N    1 1 
ATOM   452  C  CA   . GLY   A 1 36  ? 3.107   20.591  1.738   1   47.02  ? 729  GLY   A CA   1 1 
ATOM   453  C  C    . GLY   A 1 36  ? 4.613   20.531  1.836   1   48.11  ? 729  GLY   A C    1 1 
ATOM   454  O  O    . GLY   A 1 36  ? 5.316   20.652  0.833   1   48.1   ? 729  GLY   A O    1 1 
ATOM   455  H  H    . GLY   A 1 36  ? 3.34    20.205  -0.289  0   48.37  ? 729  GLY   A H    1 1 
ATOM   456  H  HA2  . GLY   A 1 36  ? 2.777   21.509  2.223   0   50.76  ? 729  GLY   A HA2  1 1 
ATOM   457  H  HA3  . GLY   A 1 36  ? 2.686   19.743  2.276   0   50.22  ? 729  GLY   A HA3  1 1 
ATOM   458  N  N    . LEU   A 1 37  ? 5.113   20.388  3.052   1   48.93  ? 730  LEU   A N    1 1 
ATOM   459  C  CA   . LEU   A 1 37  ? 6.538   20.301  3.303   1   50.35  ? 730  LEU   A CA   1 1 
ATOM   460  C  C    . LEU   A 1 37  ? 6.776   19.013  4.047   1   51.81  ? 730  LEU   A C    1 1 
ATOM   461  O  O    . LEU   A 1 37  ? 6.145   18.775  5.074   1   51.91  ? 730  LEU   A O    1 1 
ATOM   462  C  CB   . LEU   A 1 37  ? 7.03    21.5    4.133   1   50.48  ? 730  LEU   A CB   1 1 
ATOM   463  C  CG   . LEU   A 1 37  ? 7.117   22.852  3.399   1   51.97  ? 730  LEU   A CG   1 1 
ATOM   464  C  CD1  . LEU   A 1 37  ? 7.135   24.004  4.383   1   52.57  ? 730  LEU   A CD1  1 1 
ATOM   465  C  CD2  . LEU   A 1 37  ? 8.371   22.945  2.529   1   52.64  ? 730  LEU   A CD2  1 1 
ATOM   466  H  H    . LEU   A 1 37  ? 4.545   20.333  3.892   0   53.36  ? 730  LEU   A H    1 1 
ATOM   467  H  HA   . LEU   A 1 37  ? 7.097   20.268  2.37    0   55.01  ? 730  LEU   A HA   1 1 
ATOM   468  H  HB2  . LEU   A 1 37  ? 6.352   21.616  4.977   0   56.43  ? 730  LEU   A HB2  1 1 
ATOM   469  H  HB3  . LEU   A 1 37  ? 8.029   21.267  4.5     0   56.79  ? 730  LEU   A HB3  1 1 
ATOM   470  H  HG   . LEU   A 1 37  ? 6.247   22.972  2.754   0   57.49  ? 730  LEU   A HG   1 1 
ATOM   471  H  HD11 . LEU   A 1 37  ? 7.191   24.942  3.833   0   60.02  ? 730  LEU   A HD11 1 1 
ATOM   472  H  HD12 . LEU   A 1 37  ? 6.224   23.972  4.979   0   59.57  ? 730  LEU   A HD12 1 1 
ATOM   473  H  HD13 . LEU   A 1 37  ? 8.006   23.903  5.03    0   60.34  ? 730  LEU   A HD13 1 1 
ATOM   474  H  HD21 . LEU   A 1 37  ? 8.388   23.914  2.033   0   59.33  ? 730  LEU   A HD21 1 1 
ATOM   475  H  HD22 . LEU   A 1 37  ? 9.253   22.843  3.159   0   59.71  ? 730  LEU   A HD22 1 1 
ATOM   476  H  HD23 . LEU   A 1 37  ? 8.361   22.15   1.786   0   58.35  ? 730  LEU   A HD23 1 1 
ATOM   477  N  N    . TRP   A 1 38  ? 7.643   18.161  3.505   1   52.76  ? 731  TRP   A N    1 1 
ATOM   478  C  CA   . TRP   A 1 38  ? 7.98    16.896  4.135   1   54.12  ? 731  TRP   A CA   1 1 
ATOM   479  C  C    . TRP   A 1 38  ? 9.282   17.108  4.884   1   56.22  ? 731  TRP   A C    1 1 
ATOM   480  O  O    . TRP   A 1 38  ? 10.284  17.445  4.259   1   56.41  ? 731  TRP   A O    1 1 
ATOM   481  C  CB   . TRP   A 1 38  ? 8.123   15.787  3.082   1   53.6   ? 731  TRP   A CB   1 1 
ATOM   482  C  CG   . TRP   A 1 38  ? 8.64    14.493  3.637   1   53.43  ? 731  TRP   A CG   1 1 
ATOM   483  C  CD1  . TRP   A 1 38  ? 8.204   13.845  4.756   1   54.08  ? 731  TRP   A CD1  1 1 
ATOM   484  C  CD2  . TRP   A 1 38  ? 9.673   13.678  3.078   1   53.31  ? 731  TRP   A CD2  1 1 
ATOM   485  N  NE1  . TRP   A 1 38  ? 8.923   12.69   4.941   1   54.23  ? 731  TRP   A NE1  1 1 
ATOM   486  C  CE2  . TRP   A 1 38  ? 9.836   12.566  3.926   1   53.99  ? 731  TRP   A CE2  1 1 
ATOM   487  C  CE3  . TRP   A 1 38  ? 10.489  13.785  1.947   1   53.77  ? 731  TRP   A CE3  1 1 
ATOM   488  C  CZ2  . TRP   A 1 38  ? 10.802  11.591  3.695   1   54.51  ? 731  TRP   A CZ2  1 1 
ATOM   489  C  CZ3  . TRP   A 1 38  ? 11.421  12.8    1.703   1   54.47  ? 731  TRP   A CZ3  1 1 
ATOM   490  C  CH2  . TRP   A 1 38  ? 11.567  11.717  2.568   1   54.56  ? 731  TRP   A CH2  1 1 
ATOM   491  H  H    . TRP   A 1 38  ? 8.135   18.318  2.631   0   57.43  ? 731  TRP   A H    1 1 
ATOM   492  H  HA   . TRP   A 1 38  ? 7.206   16.588  4.836   0   58.96  ? 731  TRP   A HA   1 1 
ATOM   493  H  HB2  . TRP   A 1 38  ? 7.147   15.597  2.639   0   57.44  ? 731  TRP   A HB2  1 1 
ATOM   494  H  HB3  . TRP   A 1 38  ? 8.816   16.122  2.311   0   58.09  ? 731  TRP   A HB3  1 1 
ATOM   495  H  HD1  . TRP   A 1 38  ? 7.425   14.191  5.414   0   59.11  ? 731  TRP   A HD1  1 1 
ATOM   496  H  HE1  . TRP   A 1 38  ? 8.808   12.028  5.737   0   60.09  ? 731  TRP   A HE1  1 1 
ATOM   497  H  HE3  . TRP   A 1 38  ? 10.399  14.63   1.285   0   58.62  ? 731  TRP   A HE3  1 1 
ATOM   498  H  HZ2  . TRP   A 1 38  ? 10.895  10.734  4.34    0   61.12  ? 731  TRP   A HZ2  1 1 
ATOM   499  H  HZ3  . TRP   A 1 38  ? 12.07   12.886  0.848   0   60.19  ? 731  TRP   A HZ3  1 1 
ATOM   500  H  HH2  . TRP   A 1 38  ? 12.31   10.968  2.351   0   61.21  ? 731  TRP   A HH2  1 1 
ATOM   501  N  N    . ILE   A 1 39  ? 9.252   16.969  6.217   1   57.71  ? 732  ILE   A N    1 1 
ATOM   502  C  CA   . ILE   A 1 39  ? 10.425  17.116  7.081   1   59.69  ? 732  ILE   A CA   1 1 
ATOM   503  C  C    . ILE   A 1 39  ? 10.854  15.677  7.423   1   61.67  ? 732  ILE   A C    1 1 
ATOM   504  O  O    . ILE   A 1 39  ? 10.245  15.085  8.32    1   61.84  ? 732  ILE   A O    1 1 
ATOM   505  C  CB   . ILE   A 1 39  ? 10.094  17.968  8.354   1   60.22  ? 732  ILE   A CB   1 1 
ATOM   506  C  CG1  . ILE   A 1 39  ? 9.827   19.461  7.979   1   61.2   ? 732  ILE   A CG1  1 1 
ATOM   507  C  CG2  . ILE   A 1 39  ? 11.234  17.888  9.4     1   60.69  ? 732  ILE   A CG2  1 1 
ATOM   508  C  CD1  . ILE   A 1 39  ? 8.408   19.817  7.586   1   62.52  ? 732  ILE   A CD1  1 1 
ATOM   509  H  H    . ILE   A 1 39  ? 8.41    16.751  6.74    0   63.94  ? 732  ILE   A H    1 1 
ATOM   510  H  HA   . ILE   A 1 39  ? 11.226  17.633  6.556   0   67.58  ? 732  ILE   A HA   1 1 
ATOM   511  H  HB   . ILE   A 1 39  ? 9.192   17.565  8.811   0   67.91  ? 732  ILE   A HB   1 1 
ATOM   512  H  HG12 . ILE   A 1 39  ? 10.077  20.101  8.824   0   70.12  ? 732  ILE   A HG12 1 1 
ATOM   513  H  HG13 . ILE   A 1 39  ? 10.459  19.724  7.133   0   69.46  ? 732  ILE   A HG13 1 1 
ATOM   514  H  HG21 . ILE   A 1 39  ? 10.971  18.51   10.255  0   70.31  ? 732  ILE   A HG21 1 1 
ATOM   515  H  HG22 . ILE   A 1 39  ? 11.364  16.862  9.741   0   69.91  ? 732  ILE   A HG22 1 1 
ATOM   516  H  HG23 . ILE   A 1 39  ? 12.156  18.253  8.95    0   70.4   ? 732  ILE   A HG23 1 1 
ATOM   517  H  HD11 . ILE   A 1 39  ? 8.369   20.882  7.362   0   70.12  ? 732  ILE   A HD11 1 1 
ATOM   518  H  HD12 . ILE   A 1 39  ? 8.128   19.243  6.704   0   69.16  ? 732  ILE   A HD12 1 1 
ATOM   519  H  HD13 . ILE   A 1 39  ? 7.737   19.586  8.412   0   69.86  ? 732  ILE   A HD13 1 1 
ATOM   520  N  N    . PRO   A 1 40  ? 11.817  15.052  6.698   1   62.95  ? 733  PRO   A N    1 1 
ATOM   521  C  CA   . PRO   A 1 40  ? 12.178  13.665  7.035   1   64.27  ? 733  PRO   A CA   1 1 
ATOM   522  C  C    . PRO   A 1 40  ? 12.742  13.532  8.451   1   66.25  ? 733  PRO   A C    1 1 
ATOM   523  O  O    . PRO   A 1 40  ? 13.398  14.448  8.943   1   66.59  ? 733  PRO   A O    1 1 
ATOM   524  C  CB   . PRO   A 1 40  ? 13.194  13.273  5.948   1   64.71  ? 733  PRO   A CB   1 1 
ATOM   525  C  CG   . PRO   A 1 40  ? 13.085  14.314  4.895   1   64.78  ? 733  PRO   A CG   1 1 
ATOM   526  C  CD   . PRO   A 1 40  ? 12.632  15.555  5.573   1   62.76  ? 733  PRO   A CD   1 1 
ATOM   527  H  HA   . PRO   A 1 40  ? 11.304  13.024  6.934   0   71.97  ? 733  PRO   A HA   1 1 
ATOM   528  H  HB2  . PRO   A 1 40  ? 14.201  13.247  6.361   0   74.12  ? 733  PRO   A HB2  1 1 
ATOM   529  H  HB3  . PRO   A 1 40  ? 12.918  12.303  5.537   0   72.89  ? 733  PRO   A HB3  1 1 
ATOM   530  H  HG2  . PRO   A 1 40  ? 14.06   14.468  4.435   0   73.3   ? 733  PRO   A HG2  1 1 
ATOM   531  H  HG3  . PRO   A 1 40  ? 12.353  14.002  4.151   0   71.94  ? 733  PRO   A HG3  1 1 
ATOM   532  H  HD2  . PRO   A 1 40  ? 13.49   16.113  5.943   0   71.65  ? 733  PRO   A HD2  1 1 
ATOM   533  H  HD3  . PRO   A 1 40  ? 12.043  16.147  4.874   0   70.2   ? 733  PRO   A HD3  1 1 
ATOM   534  N  N    . GLU   A 1 41  ? 12.441  12.404  9.115   1   67.36  ? 734  GLU   A N    1 1 
ATOM   535  C  CA   . GLU   A 1 41  ? 12.86   12.106  10.495  1   68.74  ? 734  GLU   A CA   1 1 
ATOM   536  C  C    . GLU   A 1 41  ? 14.394  12.081  10.639  1   69.56  ? 734  GLU   A C    1 1 
ATOM   537  O  O    . GLU   A 1 41  ? 15.086  11.57   9.762   1   69.82  ? 734  GLU   A O    1 1 
ATOM   538  C  CB   . GLU   A 1 41  ? 12.246  10.745  10.928  1   71.36  ? 734  GLU   A CB   1 1 
ATOM   539  C  CG   . GLU   A 1 41  ? 12.568  10.243  12.33   1   76.7   ? 734  GLU   A CG   1 1 
ATOM   540  C  CD   . GLU   A 1 41  ? 11.992  11.055  13.475  1   82.71  ? 734  GLU   A CD   1 1 
ATOM   541  O  OE1  . GLU   A 1 41  ? 10.753  11.041  13.654  1   83.84  ? 734  GLU   A OE1  1 1 
ATOM   542  O  OE2  . GLU   A 1 41  ? 12.784  11.693  14.206  1   84.59  ? 734  GLU   A OE2  1 1 
ATOM   543  H  H    . GLU   A 1 41  ? 11.891  11.662  8.693   0   76.22  ? 734  GLU   A H    1 1 
ATOM   544  H  HA   . GLU   A 1 41  ? 12.463  12.877  11.153  0   79.08  ? 734  GLU   A HA   1 1 
ATOM   545  H  HB2  . GLU   A 1 41  ? 11.163  10.844  10.871  0   80.87  ? 734  GLU   A HB2  1 1 
ATOM   546  H  HB3  . GLU   A 1 41  ? 12.57   9.981   10.223  0   81.59  ? 734  GLU   A HB3  1 1 
ATOM   547  H  HG2  . GLU   A 1 41  ? 12.146  9.243   12.417  0   87.87  ? 734  GLU   A HG2  1 1 
ATOM   548  H  HG3  . GLU   A 1 41  ? 13.646  10.181  12.468  0   88.69  ? 734  GLU   A HG3  1 1 
ATOM   549  N  N    . GLY   A 1 42  ? 14.899  12.632  11.743  1   69.79  ? 735  GLY   A N    1 1 
ATOM   550  C  CA   . GLY   A 1 42  ? 16.326  12.648  12.054  1   70.5   ? 735  GLY   A CA   1 1 
ATOM   551  C  C    . GLY   A 1 42  ? 17.193  13.588  11.236  1   70.94  ? 735  GLY   A C    1 1 
ATOM   552  O  O    . GLY   A 1 42  ? 18.421  13.487  11.296  1   71.05  ? 735  GLY   A O    1 1 
ATOM   553  H  H    . GLY   A 1 42  ? 14.334  13.072  12.463  0   82.1   ? 735  GLY   A H    1 1 
ATOM   554  H  HA2  . GLY   A 1 42  ? 16.444  12.922  13.101  0   84.92  ? 735  GLY   A HA2  1 1 
ATOM   555  H  HA3  . GLY   A 1 42  ? 16.722  11.64   11.933  0   84.64  ? 735  GLY   A HA3  1 1 
ATOM   556  N  N    . GLU   A 1 43  ? 16.582  14.518  10.487  1   71.02  ? 736  GLU   A N    1 1 
ATOM   557  C  CA   . GLU   A 1 43  ? 17.319  15.469  9.651   1   71.54  ? 736  GLU   A CA   1 1 
ATOM   558  C  C    . GLU   A 1 43  ? 16.465  16.712  9.37    1   71.53  ? 736  GLU   A C    1 1 
ATOM   559  O  O    . GLU   A 1 43  ? 15.238  16.611  9.272   1   71.64  ? 736  GLU   A O    1 1 
ATOM   560  C  CB   . GLU   A 1 43  ? 17.787  14.807  8.335   1   73.98  ? 736  GLU   A CB   1 1 
ATOM   561  C  CG   . GLU   A 1 43  ? 16.722  13.986  7.622   1   79.11  ? 736  GLU   A CG   1 1 
ATOM   562  C  CD   . GLU   A 1 43  ? 17.171  13.367  6.312   1   85.47  ? 736  GLU   A CD   1 1 
ATOM   563  O  OE1  . GLU   A 1 43  ? 17.007  12.136  6.15    1   86.67  ? 736  GLU   A OE1  1 1 
ATOM   564  O  OE2  . GLU   A 1 43  ? 17.689  14.11   5.447   1   87.54  ? 736  GLU   A OE2  1 1 
ATOM   565  H  H    . GLU   A 1 43  ? 15.577  14.649  10.441  0   83.46  ? 736  GLU   A H    1 1 
ATOM   566  H  HA   . GLU   A 1 43  ? 18.206  15.803  10.188  0   86.52  ? 736  GLU   A HA   1 1 
ATOM   567  H  HB2  . GLU   A 1 43  ? 18.118  15.589  7.654   0   87.73  ? 736  GLU   A HB2  1 1 
ATOM   568  H  HB3  . GLU   A 1 43  ? 18.62   14.142  8.559   0   88.47  ? 736  GLU   A HB3  1 1 
ATOM   569  H  HG2  . GLU   A 1 43  ? 16.412  13.164  8.266   0   91.23  ? 736  GLU   A HG2  1 1 
ATOM   570  H  HG3  . GLU   A 1 43  ? 15.866  14.626  7.413   0   90.44  ? 736  GLU   A HG3  1 1 
ATOM   571  N  N    . LYS   A 1 44  ? 17.115  17.881  9.237   1   71.17  ? 737  LYS   A N    1 1 
ATOM   572  C  CA   . LYS   A 1 44  ? 16.424  19.152  9.005   1   71.15  ? 737  LYS   A CA   1 1 
ATOM   573  C  C    . LYS   A 1 44  ? 16.546  19.558  7.535   1   70.44  ? 737  LYS   A C    1 1 
ATOM   574  O  O    . LYS   A 1 44  ? 17.556  20.134  7.131   1   70.75  ? 737  LYS   A O    1 1 
ATOM   575  C  CB   . LYS   A 1 44  ? 16.996  20.26   9.913   1   73.35  ? 737  LYS   A CB   1 1 
ATOM   576  C  CG   . LYS   A 1 44  ? 17.108  19.882  11.403  1   77.73  ? 737  LYS   A CG   1 1 
ATOM   577  C  CD   . LYS   A 1 44  ? 18.459  20.259  12.032  1   81.96  ? 737  LYS   A CD   1 1 
ATOM   578  C  CE   . LYS   A 1 44  ? 19.598  19.325  11.662  1   85.58  ? 737  LYS   A CE   1 1 
ATOM   579  N  NZ   . LYS   A 1 44  ? 20.884  19.713  12.311  1   87.59  ? 737  LYS   A NZ   1 1 
ATOM   580  H  H    . LYS   A 1 44  ? 18.126  17.971  9.272   0   86.15  ? 737  LYS   A H    1 1 
ATOM   581  H  HA   . LYS   A 1 44  ? 15.366  19.062  9.245   0   83.76  ? 737  LYS   A HA   1 1 
ATOM   582  H  HB2  . LYS   A 1 44  ? 17.976  20.559  9.543   0   89.2   ? 737  LYS   A HB2  1 1 
ATOM   583  H  HB3  . LYS   A 1 44  ? 16.318  21.111  9.858   0   87.97  ? 737  LYS   A HB3  1 1 
ATOM   584  H  HG2  . LYS   A 1 44  ? 16.342  20.43   11.948  0   93.06  ? 737  LYS   A HG2  1 1 
ATOM   585  H  HG3  . LYS   A 1 44  ? 16.955  18.813  11.551  0   92.83  ? 737  LYS   A HG3  1 1 
ATOM   586  H  HD2  . LYS   A 1 44  ? 18.728  21.263  11.709  0   100.02 ? 737  LYS   A HD2  1 1 
ATOM   587  H  HD3  . LYS   A 1 44  ? 18.351  20.234  13.115  0   99.88  ? 737  LYS   A HD3  1 1 
ATOM   588  H  HE2  . LYS   A 1 44  ? 19.355  18.308  11.966  0   103.25 ? 737  LYS   A HE2  1 1 
ATOM   589  H  HE3  . LYS   A 1 44  ? 19.766  19.365  10.587  0   103.4  ? 737  LYS   A HE3  1 1 
ATOM   590  H  HZ1  . LYS   A 1 44  ? 21.47   18.892  12.428  0   108.22 ? 737  LYS   A HZ1  1 1 
ATOM   591  H  HZ2  . LYS   A 1 44  ? 21.378  20.376  11.723  0   108.38 ? 737  LYS   A HZ2  1 1 
ATOM   592  H  HZ3  . LYS   A 1 44  ? 20.728  20.136  13.22   0   108.14 ? 737  LYS   A HZ3  1 1 
ATOM   593  N  N    . VAL   A 1 45  ? 15.527  19.223  6.732   1   69.25  ? 738  VAL   A N    1 1 
ATOM   594  C  CA   . VAL   A 1 45  ? 15.485  19.555  5.304   1   68.36  ? 738  VAL   A CA   1 1 
ATOM   595  C  C    . VAL   A 1 45  ? 14.003  19.641  4.882   1   67.01  ? 738  VAL   A C    1 1 
ATOM   596  O  O    . VAL   A 1 45  ? 13.379  18.631  4.566   1   67.25  ? 738  VAL   A O    1 1 
ATOM   597  C  CB   . VAL   A 1 45  ? 16.352  18.573  4.455   1   69.18  ? 738  VAL   A CB   1 1 
ATOM   598  C  CG1  . VAL   A 1 45  ? 15.937  17.111  4.631   1   69.74  ? 738  VAL   A CG1  1 1 
ATOM   599  C  CG2  . VAL   A 1 45  ? 16.393  18.972  2.983   1   69.68  ? 738  VAL   A CG2  1 1 
ATOM   600  H  H    . VAL   A 1 45  ? 14.716  18.705  7.055   0   80.19  ? 738  VAL   A H    1 1 
ATOM   601  H  HA   . VAL   A 1 45  ? 15.911  20.547  5.167   0   80.2   ? 738  VAL   A HA   1 1 
ATOM   602  H  HB   . VAL   A 1 45  ? 17.376  18.646  4.818   0   81.64  ? 738  VAL   A HB   1 1 
ATOM   603  H  HG11 . VAL   A 1 45  ? 16.589  16.491  4.018   0   80.56  ? 738  VAL   A HG11 1 1 
ATOM   604  H  HG12 . VAL   A 1 45  ? 16.038  16.824  5.677   0   80.8   ? 738  VAL   A HG12 1 1 
ATOM   605  H  HG13 . VAL   A 1 45  ? 14.905  16.986  4.307   0   79.27  ? 738  VAL   A HG13 1 1 
ATOM   606  H  HG21 . VAL   A 1 45  ? 17.027  18.261  2.455   0   80.74  ? 738  VAL   A HG21 1 1 
ATOM   607  H  HG22 . VAL   A 1 45  ? 15.392  18.957  2.556   0   79.46  ? 738  VAL   A HG22 1 1 
ATOM   608  H  HG23 . VAL   A 1 45  ? 16.822  19.97   2.901   0   81.29  ? 738  VAL   A HG23 1 1 
ATOM   609  N  N    . LYS   A 1 46  ? 13.427  20.85   4.929   1   65.5   ? 739  LYS   A N    1 1 
ATOM   610  C  CA   . LYS   A 1 46  ? 12.006  21.041  4.617   1   64.38  ? 739  LYS   A CA   1 1 
ATOM   611  C  C    . LYS   A 1 46  ? 11.813  20.946  3.094   1   62.78  ? 739  LYS   A C    1 1 
ATOM   612  O  O    . LYS   A 1 46  ? 12.141  21.884  2.369   1   62.92  ? 739  LYS   A O    1 1 
ATOM   613  C  CB   . LYS   A 1 46  ? 11.485  22.372  5.206   1   66.13  ? 739  LYS   A CB   1 1 
ATOM   614  C  CG   . LYS   A 1 46  ? 11.843  22.554  6.69    1   69.96  ? 739  LYS   A CG   1 1 
ATOM   615  C  CD   . LYS   A 1 46  ? 10.934  23.52   7.468   1   74.26  ? 739  LYS   A CD   1 1 
ATOM   616  C  CE   . LYS   A 1 46  ? 11.391  24.962  7.457   1   77.87  ? 739  LYS   A CE   1 1 
ATOM   617  N  NZ   . LYS   A 1 46  ? 12.651  25.182  8.226   1   80.03  ? 739  LYS   A NZ   1 1 
ATOM   618  H  H    . LYS   A 1 46  ? 13.936  21.707  5.117   0   76.1   ? 739  LYS   A H    1 1 
ATOM   619  H  HA   . LYS   A 1 46  ? 11.428  20.246  5.086   0   72.49  ? 739  LYS   A HA   1 1 
ATOM   620  H  HB2  . LYS   A 1 46  ? 11.913  23.209  4.657   0   75.67  ? 739  LYS   A HB2  1 1 
ATOM   621  H  HB3  . LYS   A 1 46  ? 10.399  22.383  5.118   0   74.48  ? 739  LYS   A HB3  1 1 
ATOM   622  H  HG2  . LYS   A 1 46  ? 11.807  21.59   7.192   0   79.82  ? 739  LYS   A HG2  1 1 
ATOM   623  H  HG3  . LYS   A 1 46  ? 12.86   22.942  6.741   0   81.03  ? 739  LYS   A HG3  1 1 
ATOM   624  H  HD2  . LYS   A 1 46  ? 9.93    23.494  7.048   0   83.75  ? 739  LYS   A HD2  1 1 
ATOM   625  H  HD3  . LYS   A 1 46  ? 10.9    23.194  8.507   0   84.85  ? 739  LYS   A HD3  1 1 
ATOM   626  H  HE2  . LYS   A 1 46  ? 11.557  25.285  6.43    0   89.2   ? 739  LYS   A HE2  1 1 
ATOM   627  H  HE3  . LYS   A 1 46  ? 10.618  25.572  7.923   0   89.46  ? 739  LYS   A HE3  1 1 
ATOM   628  H  HZ1  . LYS   A 1 46  ? 12.811  26.178  8.338   0   93.85  ? 739  LYS   A HZ1  1 1 
ATOM   629  H  HZ2  . LYS   A 1 46  ? 12.587  24.755  9.144   0   93.1   ? 739  LYS   A HZ2  1 1 
ATOM   630  H  HZ3  . LYS   A 1 46  ? 13.448  24.789  7.735   0   93.08  ? 739  LYS   A HZ3  1 1 
ATOM   631  N  N    . ILE   A 1 47  ? 11.298  19.794  2.614   1   61.06  ? 740  ILE   A N    1 1 
ATOM   632  C  CA   . ILE   A 1 47  ? 11.144  19.516  1.181   1   59.88  ? 740  ILE   A CA   1 1 
ATOM   633  C  C    . ILE   A 1 47  ? 9.748   19.882  0.63    1   58.58  ? 740  ILE   A C    1 1 
ATOM   634  O  O    . ILE   A 1 47  ? 8.774   19.257  1.059   1   58.58  ? 740  ILE   A O    1 1 
ATOM   635  C  CB   . ILE   A 1 47  ? 11.464  18.016  0.898   1   60.26  ? 740  ILE   A CB   1 1 
ATOM   636  C  CG1  . ILE   A 1 47  ? 12.93   17.682  1.307   1   61.1   ? 740  ILE   A CG1  1 1 
ATOM   637  C  CG2  . ILE   A 1 47  ? 11.245  17.679  -0.596  1   60.68  ? 740  ILE   A CG2  1 1 
ATOM   638  C  CD1  . ILE   A 1 47  ? 13.215  16.222  1.578   1   62.31  ? 740  ILE   A CD1  1 1 
ATOM   639  H  H    . ILE   A 1 47  ? 10.965  19.037  3.202   0   67.71  ? 740  ILE   A H    1 1 
ATOM   640  H  HA   . ILE   A 1 47  ? 11.917  20.063  0.647   0   66.46  ? 740  ILE   A HA   1 1 
ATOM   641  H  HB   . ILE   A 1 47  ? 10.79   17.399  1.49    0   65.72  ? 740  ILE   A HB   1 1 
ATOM   642  H  HG12 . ILE   A 1 47  ? 13.592  18.002  0.503   0   68.32  ? 740  ILE   A HG12 1 1 
ATOM   643  H  HG13 . ILE   A 1 47  ? 13.191  18.216  2.219   0   68.67  ? 740  ILE   A HG13 1 1 
ATOM   644  H  HG21 . ILE   A 1 47  ? 11.501  16.637  -0.778  0   65.63  ? 740  ILE   A HG21 1 1 
ATOM   645  H  HG22 . ILE   A 1 47  ? 10.208  17.839  -0.884  0   65.03  ? 740  ILE   A HG22 1 1 
ATOM   646  H  HG23 . ILE   A 1 47  ? 11.893  18.322  -1.191  0   66.09  ? 740  ILE   A HG23 1 1 
ATOM   647  H  HD11 . ILE   A 1 47  ? 14.258  16.123  1.876   0   70.2   ? 740  ILE   A HD11 1 1 
ATOM   648  H  HD12 . ILE   A 1 47  ? 12.566  15.879  2.382   0   69.08  ? 740  ILE   A HD12 1 1 
ATOM   649  H  HD13 . ILE   A 1 47  ? 13.036  15.637  0.677   0   68.74  ? 740  ILE   A HD13 1 1 
ATOM   650  N  N    . PRO   A 1 48  ? 9.605   20.791  -0.372  1   57.25  ? 741  PRO   A N    1 1 
ATOM   651  C  CA   . PRO   A 1 48  ? 8.27    21.025  -0.955  1   56.27  ? 741  PRO   A CA   1 1 
ATOM   652  C  C    . PRO   A 1 48  ? 7.78    19.751  -1.649  1   55.17  ? 741  PRO   A C    1 1 
ATOM   653  O  O    . PRO   A 1 48  ? 8.51    19.197  -2.466  1   55.25  ? 741  PRO   A O    1 1 
ATOM   654  C  CB   . PRO   A 1 48  ? 8.509   22.165  -1.958  1   57.13  ? 741  PRO   A CB   1 1 
ATOM   655  C  CG   . PRO   A 1 48  ? 9.808   22.759  -1.585  1   57.86  ? 741  PRO   A CG   1 1 
ATOM   656  C  CD   . PRO   A 1 48  ? 10.619  21.636  -1.037  1   56.57  ? 741  PRO   A CD   1 1 
ATOM   657  H  HA   . PRO   A 1 48  ? 7.546   21.349  -0.209  0   60.43  ? 741  PRO   A HA   1 1 
ATOM   658  H  HB2  . PRO   A 1 48  ? 8.579   21.772  -2.97   0   61     ? 741  PRO   A HB2  1 1 
ATOM   659  H  HB3  . PRO   A 1 48  ? 7.713   22.904  -1.883  0   61.45  ? 741  PRO   A HB3  1 1 
ATOM   660  H  HG2  . PRO   A 1 48  ? 10.283  23.173  -2.474  0   63.57  ? 741  PRO   A HG2  1 1 
ATOM   661  H  HG3  . PRO   A 1 48  ? 9.653   23.528  -0.829  0   63.94  ? 741  PRO   A HG3  1 1 
ATOM   662  H  HD2  . PRO   A 1 48  ? 11.106  21.091  -1.845  0   62.12  ? 741  PRO   A HD2  1 1 
ATOM   663  H  HD3  . PRO   A 1 48  ? 11.339  22.046  -0.33   0   63.18  ? 741  PRO   A HD3  1 1 
ATOM   664  N  N    . VAL   A 1 49  ? 6.58    19.258  -1.289  1   54.01  ? 742  VAL   A N    1 1 
ATOM   665  C  CA   . VAL   A 1 49  ? 6.01    18.02   -1.837  1   53.25  ? 742  VAL   A CA   1 1 
ATOM   666  C  C    . VAL   A 1 49  ? 4.56    18.214  -2.294  1   52.29  ? 742  VAL   A C    1 1 
ATOM   667  O  O    . VAL   A 1 49  ? 3.859   19.097  -1.808  1   52.13  ? 742  VAL   A O    1 1 
ATOM   668  C  CB   . VAL   A 1 49  ? 6.102   16.812  -0.845  1   53.91  ? 742  VAL   A CB   1 1 
ATOM   669  C  CG1  . VAL   A 1 49  ? 7.548   16.399  -0.588  1   54.63  ? 742  VAL   A CG1  1 1 
ATOM   670  C  CG2  . VAL   A 1 49  ? 5.374   17.084  0.472   1   54.28  ? 742  VAL   A CG2  1 1 
ATOM   671  H  H    . VAL   A 1 49  ? 5.963   19.73   -0.636  0   56.91  ? 742  VAL   A H    1 1 
ATOM   672  H  HA   . VAL   A 1 49  ? 6.57    17.729  -2.724  0   55.21  ? 742  VAL   A HA   1 1 
ATOM   673  H  HB   . VAL   A 1 49  ? 5.607   15.959  -1.307  0   55.78  ? 742  VAL   A HB   1 1 
ATOM   674  H  HG11 . VAL   A 1 49  ? 7.554   15.558  0.103   0   57.69  ? 742  VAL   A HG11 1 1 
ATOM   675  H  HG12 . VAL   A 1 49  ? 8.008   16.11   -1.532  0   57.34  ? 742  VAL   A HG12 1 1 
ATOM   676  H  HG13 . VAL   A 1 49  ? 8.084   17.239  -0.15   0   58.01  ? 742  VAL   A HG13 1 1 
ATOM   677  H  HG21 . VAL   A 1 49  ? 5.485   16.212  1.114   0   57.03  ? 742  VAL   A HG21 1 1 
ATOM   678  H  HG22 . VAL   A 1 49  ? 5.821   17.951  0.957   0   57.31  ? 742  VAL   A HG22 1 1 
ATOM   679  H  HG23 . VAL   A 1 49  ? 4.317   17.266  0.286   0   56.52  ? 742  VAL   A HG23 1 1 
ATOM   680  N  N    . ALA   A 1 50  ? 4.118   17.36   -3.22   1   51.48  ? 743  ALA   A N    1 1 
ATOM   681  C  CA   . ALA   A 1 50  ? 2.746   17.304  -3.698  1   51.16  ? 743  ALA   A CA   1 1 
ATOM   682  C  C    . ALA   A 1 50  ? 2.168   15.974  -3.213  1   50.78  ? 743  ALA   A C    1 1 
ATOM   683  O  O    . ALA   A 1 50  ? 2.856   14.951  -3.263  1   51.04  ? 743  ALA   A O    1 1 
ATOM   684  C  CB   . ALA   A 1 50  ? 2.709   17.378  -5.204  1   51.23  ? 743  ALA   A CB   1 1 
ATOM   685  H  H    . ALA   A 1 50  ? 4.708   16.667  -3.669  0   52.36  ? 743  ALA   A H    1 1 
ATOM   686  H  HA   . ALA   A 1 50  ? 2.153   18.124  -3.296  0   51.86  ? 743  ALA   A HA   1 1 
ATOM   687  H  HB1  . ALA   A 1 50  ? 1.673   17.324  -5.537  0   51.06  ? 743  ALA   A HB1  1 1 
ATOM   688  H  HB2  . ALA   A 1 50  ? 3.154   18.32   -5.522  0   51.4   ? 743  ALA   A HB2  1 1 
ATOM   689  H  HB3  . ALA   A 1 50  ? 3.278   16.547  -5.615  0   51.17  ? 743  ALA   A HB3  1 1 
ATOM   690  N  N    . ILE   A 1 51  ? 0.925   16.001  -2.7    1   50.11  ? 744  ILE   A N    1 1 
ATOM   691  C  CA   . ILE   A 1 51  ? 0.248   14.842  -2.113  1   49.92  ? 744  ILE   A CA   1 1 
ATOM   692  C  C    . ILE   A 1 51  ? -1.023  14.554  -2.91   1   49.8   ? 744  ILE   A C    1 1 
ATOM   693  O  O    . ILE   A 1 51  ? -1.836  15.452  -3.04   1   49.89  ? 744  ILE   A O    1 1 
ATOM   694  C  CB   . ILE   A 1 51  ? -0.095  15.171  -0.631  1   50.16  ? 744  ILE   A CB   1 1 
ATOM   695  C  CG1  . ILE   A 1 51  ? 1.176   15.573  0.19    1   50.97  ? 744  ILE   A CG1  1 1 
ATOM   696  C  CG2  . ILE   A 1 51  ? -0.833  14.014  0.04    1   50.43  ? 744  ILE   A CG2  1 1 
ATOM   697  C  CD1  . ILE   A 1 51  ? 0.94    16.579  1.311   1   52.26  ? 744  ILE   A CD1  1 1 
ATOM   698  H  H    . ILE   A 1 51  ? 0.349   16.836  -2.68   0   50.76  ? 744  ILE   A H    1 1 
ATOM   699  H  HA   . ILE   A 1 51  ? 0.887   13.96   -2.133  0   50.75  ? 744  ILE   A HA   1 1 
ATOM   700  H  HB   . ILE   A 1 51  ? -0.777  16.018  -0.65   0   51.52  ? 744  ILE   A HB   1 1 
ATOM   701  H  HG12 . ILE   A 1 51  ? 1.581   14.682  0.664   0   52.78  ? 744  ILE   A HG12 1 1 
ATOM   702  H  HG13 . ILE   A 1 51  ? 1.935   16.003  -0.462  0   52.41  ? 744  ILE   A HG13 1 1 
ATOM   703  H  HG21 . ILE   A 1 51  ? -1.042  14.282  1.074   0   52.49  ? 744  ILE   A HG21 1 1 
ATOM   704  H  HG22 . ILE   A 1 51  ? -1.77   13.802  -0.472  0   52.03  ? 744  ILE   A HG22 1 1 
ATOM   705  H  HG23 . ILE   A 1 51  ? -0.183  13.142  0.015   0   52.14  ? 744  ILE   A HG23 1 1 
ATOM   706  H  HD11 . ILE   A 1 51  ? 1.889   16.78   1.807   0   54.63  ? 744  ILE   A HD11 1 1 
ATOM   707  H  HD12 . ILE   A 1 51  ? 0.539   17.499  0.888   0   54.28  ? 744  ILE   A HD12 1 1 
ATOM   708  H  HD13 . ILE   A 1 51  ? 0.231   16.157  2.022   0   54.6   ? 744  ILE   A HD13 1 1 
ATOM   709  N  N    . LYS   A 1 52  ? -1.23   13.317  -3.402  1   49.4   ? 745  LYS   A N    1 1 
ATOM   710  C  CA   . LYS   A 1 52  ? -2.438  12.996  -4.168  1   49.6   ? 745  LYS   A CA   1 1 
ATOM   711  C  C    . LYS   A 1 52  ? -3.243  11.872  -3.516  1   50.02  ? 745  LYS   A C    1 1 
ATOM   712  O  O    . LYS   A 1 52  ? -2.662  10.952  -2.946  1   50.06  ? 745  LYS   A O    1 1 
ATOM   713  C  CB   . LYS   A 1 52  ? -2.078  12.606  -5.612  1   50.81  ? 745  LYS   A CB   1 1 
ATOM   714  C  CG   . LYS   A 1 52  ? -3.287  12.519  -6.547  1   53.58  ? 745  LYS   A CG   1 1 
ATOM   715  C  CD   . LYS   A 1 52  ? -2.919  12.4    -8.015  1   56.8   ? 745  LYS   A CD   1 1 
ATOM   716  C  CE   . LYS   A 1 52  ? -2.394  11.03   -8.399  1   59.65  ? 745  LYS   A CE   1 1 
ATOM   717  N  NZ   . LYS   A 1 52  ? -2.472  10.753  -9.866  1   61.66  ? 745  LYS   A NZ   1 1 
ATOM   718  H  H    . LYS   A 1 52  ? -0.594  12.534  -3.29   0   50.08  ? 745  LYS   A H    1 1 
ATOM   719  H  HA   . LYS   A 1 52  ? -3.086  13.869  -4.218  0   50.16  ? 745  LYS   A HA   1 1 
ATOM   720  H  HB2  . LYS   A 1 52  ? -1.394  13.354  -6.012  0   50.59  ? 745  LYS   A HB2  1 1 
ATOM   721  H  HB3  . LYS   A 1 52  ? -1.59   11.633  -5.588  0   51.04  ? 745  LYS   A HB3  1 1 
ATOM   722  H  HG2  . LYS   A 1 52  ? -3.892  11.654  -6.279  0   54.1   ? 745  LYS   A HG2  1 1 
ATOM   723  H  HG3  . LYS   A 1 52  ? -3.875  13.428  -6.435  0   53.7   ? 745  LYS   A HG3  1 1 
ATOM   724  H  HD2  . LYS   A 1 52  ? -3.815  12.604  -8.601  0   56.42  ? 745  LYS   A HD2  1 1 
ATOM   725  H  HD3  . LYS   A 1 52  ? -2.149  13.133  -8.252  0   56.08  ? 745  LYS   A HD3  1 1 
ATOM   726  H  HE2  . LYS   A 1 52  ? -1.345  10.959  -8.114  0   59.34  ? 745  LYS   A HE2  1 1 
ATOM   727  H  HE3  . LYS   A 1 52  ? -2.972  10.261  -7.889  0   59.88  ? 745  LYS   A HE3  1 1 
ATOM   728  H  HZ1  . LYS   A 1 52  ? -2.953  9.872   -10.02  0   61.49  ? 745  LYS   A HZ1  1 1 
ATOM   729  H  HZ2  . LYS   A 1 52  ? -2.964  11.48   -10.376 0   60.91  ? 745  LYS   A HZ2  1 1 
ATOM   730  H  HZ3  . LYS   A 1 52  ? -1.536  10.672  -10.249 0   60.89  ? 745  LYS   A HZ3  1 1 
ATOM   731  N  N    . GLU   A 1 53  ? -4.583  11.947  -3.619  1   50.2   ? 746  GLU   A N    1 1 
ATOM   732  C  CA   . GLU   A 1 53  ? -5.509  10.938  -3.099  1   50.86  ? 746  GLU   A CA   1 1 
ATOM   733  C  C    . GLU   A 1 53  ? -6.821  10.936  -3.916  1   51.89  ? 746  GLU   A C    1 1 
ATOM   734  O  O    . GLU   A 1 53  ? -7.093  11.888  -4.642  1   51.98  ? 746  GLU   A O    1 1 
ATOM   735  C  CB   . GLU   A 1 53  ? -5.782  11.183  -1.605  1   52.27  ? 746  GLU   A CB   1 1 
ATOM   736  C  CG   . GLU   A 1 53  ? -6.684  12.37   -1.304  1   55.4   ? 746  GLU   A CG   1 1 
ATOM   737  C  CD   . GLU   A 1 53  ? -6.739  12.763  0.158   1   59.74  ? 746  GLU   A CD   1 1 
ATOM   738  O  OE1  . GLU   A 1 53  ? -5.813  12.399  0.916   1   60.96  ? 746  GLU   A OE1  1 1 
ATOM   739  O  OE2  . GLU   A 1 53  ? -7.712  13.449  0.545   1   60.84  ? 746  GLU   A OE2  1 1 
ATOM   740  H  H    . GLU   A 1 53  ? -5.067  12.717  -4.068  0   51.52  ? 746  GLU   A H    1 1 
ATOM   741  H  HA   . GLU   A 1 53  ? -5.062  9.95    -3.198  0   53.19  ? 746  GLU   A HA   1 1 
ATOM   742  H  HB2  . GLU   A 1 53  ? -6.247  10.293  -1.183  0   55.63  ? 746  GLU   A HB2  1 1 
ATOM   743  H  HB3  . GLU   A 1 53  ? -4.82   11.358  -1.127  0   54.82  ? 746  GLU   A HB3  1 1 
ATOM   744  H  HG2  . GLU   A 1 53  ? -6.344  13.233  -1.874  0   57.86  ? 746  GLU   A HG2  1 1 
ATOM   745  H  HG3  . GLU   A 1 53  ? -7.705  12.123  -1.593  0   58.78  ? 746  GLU   A HG3  1 1 
ATOM   746  N  N    . LEU   A 1 54  ? -7.63   9.871   -3.795  1   52.6   ? 747  LEU   A N    1 1 
ATOM   747  C  CA   . LEU   A 1 54  ? -8.904  9.759   -4.514  1   53.81  ? 747  LEU   A CA   1 1 
ATOM   748  C  C    . LEU   A 1 54  ? -10.092 9.935   -3.564  1   54.69  ? 747  LEU   A C    1 1 
ATOM   749  O  O    . LEU   A 1 54  ? -9.936  9.931   -2.342  1   55.11  ? 747  LEU   A O    1 1 
ATOM   750  C  CB   . LEU   A 1 54  ? -9.008  8.399   -5.233  1   54.37  ? 747  LEU   A CB   1 1 
ATOM   751  C  CG   . LEU   A 1 54  ? -7.826  8.001   -6.133  1   56.54  ? 747  LEU   A CG   1 1 
ATOM   752  C  CD1  . LEU   A 1 54  ? -7.869  6.531   -6.483  1   57.28  ? 747  LEU   A CD1  1 1 
ATOM   753  C  CD2  . LEU   A 1 54  ? -7.781  8.824   -7.424  1   57.47  ? 747  LEU   A CD2  1 1 
ATOM   754  H  H    . LEU   A 1 54  ? -7.426  9.071   -3.206  0   56.27  ? 747  LEU   A H    1 1 
ATOM   755  H  HA   . LEU   A 1 54  ? -8.984  10.537  -5.271  0   57.1   ? 747  LEU   A HA   1 1 
ATOM   756  H  HB2  . LEU   A 1 54  ? -9.124  7.625   -4.476  0   59.24  ? 747  LEU   A HB2  1 1 
ATOM   757  H  HB3  . LEU   A 1 54  ? -9.897  8.42    -5.863  0   58.94  ? 747  LEU   A HB3  1 1 
ATOM   758  H  HG   . LEU   A 1 54  ? -6.903  8.171   -5.584  0   59.61  ? 747  LEU   A HG   1 1 
ATOM   759  H  HD11 . LEU   A 1 54  ? -7.016  6.293   -7.116  0   60.93  ? 747  LEU   A HD11 1 1 
ATOM   760  H  HD12 . LEU   A 1 54  ? -7.823  5.949   -5.564  0   61.98  ? 747  LEU   A HD12 1 1 
ATOM   761  H  HD13 . LEU   A 1 54  ? -8.796  6.317   -7.013  0   61.91  ? 747  LEU   A HD13 1 1 
ATOM   762  H  HD21 . LEU   A 1 54  ? -6.937  8.488   -8.024  0   59.72  ? 747  LEU   A HD21 1 1 
ATOM   763  H  HD22 . LEU   A 1 54  ? -8.707  8.668   -7.976  0   60.58  ? 747  LEU   A HD22 1 1 
ATOM   764  H  HD23 . LEU   A 1 54  ? -7.661  9.881   -7.191  0   59.75  ? 747  LEU   A HD23 1 1 
ATOM   765  N  N    . ALA   A 1 62  ? -11.571 2.331   -3.793  1   64.5   ? 755  ALA   A N    1 1 
ATOM   766  C  CA   . ALA   A 1 62  ? -10.652 2.862   -4.798  1   65.04  ? 755  ALA   A CA   1 1 
ATOM   767  C  C    . ALA   A 1 62  ? -9.202  2.995   -4.302  1   65.07  ? 755  ALA   A C    1 1 
ATOM   768  O  O    . ALA   A 1 62  ? -8.343  3.377   -5.096  1   65.27  ? 755  ALA   A O    1 1 
ATOM   769  C  CB   . ALA   A 1 62  ? -11.157 4.202   -5.311  1   65.46  ? 755  ALA   A CB   1 1 
ATOM   770  H  HA   . ALA   A 1 62  ? -10.644 2.178   -5.645  0   74.18  ? 755  ALA   A HA   1 1 
ATOM   771  H  HB1  . ALA   A 1 62  ? -10.47  4.581   -6.066  0   72.53  ? 755  ALA   A HB1  1 1 
ATOM   772  H  HB2  . ALA   A 1 62  ? -12.142 4.057   -5.752  0   74.25  ? 755  ALA   A HB2  1 1 
ATOM   773  H  HB3  . ALA   A 1 62  ? -11.221 4.903   -4.48   0   73.34  ? 755  ALA   A HB3  1 1 
ATOM   774  N  N    . ASN   A 1 63  ? -8.902  2.661   -3.021  1   64.7   ? 756  ASN   A N    1 1 
ATOM   775  C  CA   . ASN   A 1 63  ? -7.513  2.711   -2.529  1   64.76  ? 756  ASN   A CA   1 1 
ATOM   776  C  C    . ASN   A 1 63  ? -6.593  1.711   -3.266  1   64.31  ? 756  ASN   A C    1 1 
ATOM   777  O  O    . ASN   A 1 63  ? -5.374  1.856   -3.205  1   64.53  ? 756  ASN   A O    1 1 
ATOM   778  C  CB   . ASN   A 1 63  ? -7.43   2.457   -1.011  1   65.99  ? 756  ASN   A CB   1 1 
ATOM   779  C  CG   . ASN   A 1 63  ? -7.655  3.673   -0.14   1   68.91  ? 756  ASN   A CG   1 1 
ATOM   780  O  OD1  . ASN   A 1 63  ? -7.85   4.799   -0.617  1   70.12  ? 756  ASN   A OD1  1 1 
ATOM   781  N  ND2  . ASN   A 1 63  ? -7.624  3.476   1.171   1   69.27  ? 756  ASN   A ND2  1 1 
ATOM   782  H  H    . ASN   A 1 63  ? -9.576  2.372   -2.32   0   73.91  ? 756  ASN   A H    1 1 
ATOM   783  H  HA   . ASN   A 1 63  ? -7.121  3.705   -2.734  0   71.38  ? 756  ASN   A HA   1 1 
ATOM   784  H  HB2  . ASN   A 1 63  ? -8.164  1.704   -0.727  0   75.35  ? 756  ASN   A HB2  1 1 
ATOM   785  H  HB3  . ASN   A 1 63  ? -6.435  2.083   -0.779  0   74.12  ? 756  ASN   A HB3  1 1 
ATOM   786  H  HD21 . ASN   A 1 63  ? -7.77   4.259   1.8     0   77.41  ? 756  ASN   A HD21 1 1 
ATOM   787  H  HD22 . ASN   A 1 63  ? -7.459  2.549   1.551   0   78.35  ? 756  ASN   A HD22 1 1 
ATOM   788  N  N    . LYS   A 1 64  ? -7.164  0.698   -3.94   1   63.55  ? 757  LYS   A N    1 1 
ATOM   789  C  CA   . LYS   A 1 64  ? -6.39   -0.256  -4.724  1   63.22  ? 757  LYS   A CA   1 1 
ATOM   790  C  C    . LYS   A 1 64  ? -5.875  0.43    -6.004  1   62.47  ? 757  LYS   A C    1 1 
ATOM   791  O  O    . LYS   A 1 64  ? -4.727  0.214   -6.388  1   62.68  ? 757  LYS   A O    1 1 
ATOM   792  C  CB   . LYS   A 1 64  ? -7.263  -1.481  -5.064  1   65.08  ? 757  LYS   A CB   1 1 
ATOM   793  C  CG   . LYS   A 1 64  ? -6.596  -2.559  -5.916  1   68.82  ? 757  LYS   A CG   1 1 
ATOM   794  C  CD   . LYS   A 1 64  ? -5.333  -3.148  -5.288  1   72.59  ? 757  LYS   A CD   1 1 
ATOM   795  C  CE   . LYS   A 1 64  ? -4.903  -4.417  -5.967  1   76.35  ? 757  LYS   A CE   1 1 
ATOM   796  N  NZ   . LYS   A 1 64  ? -4.406  -4.221  -7.368  1   78.56  ? 757  LYS   A NZ   1 1 
ATOM   797  H  H    . LYS   A 1 64  ? -8.159  0.502   -3.949  0   72.9   ? 757  LYS   A H    1 1 
ATOM   798  H  HA   . LYS   A 1 64  ? -5.533  -0.576  -4.133  0   72.15  ? 757  LYS   A HA   1 1 
ATOM   799  H  HB2  . LYS   A 1 64  ? -7.581  -1.948  -4.133  0   76.38  ? 757  LYS   A HB2  1 1 
ATOM   800  H  HB3  . LYS   A 1 64  ? -8.137  -1.141  -5.619  0   75.51  ? 757  LYS   A HB3  1 1 
ATOM   801  H  HG2  . LYS   A 1 64  ? -7.311  -3.369  -6.05   0   80.93  ? 757  LYS   A HG2  1 1 
ATOM   802  H  HG3  . LYS   A 1 64  ? -6.323  -2.154  -6.89   0   78.91  ? 757  LYS   A HG3  1 1 
ATOM   803  H  HD2  . LYS   A 1 64  ? -4.509  -2.44   -5.367  0   82.55  ? 757  LYS   A HD2  1 1 
ATOM   804  H  HD3  . LYS   A 1 64  ? -5.534  -3.382  -4.243  0   84.26  ? 757  LYS   A HD3  1 1 
ATOM   805  H  HE2  . LYS   A 1 64  ? -4.096  -4.861  -5.386  0   88.85  ? 757  LYS   A HE2  1 1 
ATOM   806  H  HE3  . LYS   A 1 64  ? -5.746  -5.105  -6.013  0   89.65  ? 757  LYS   A HE3  1 1 
ATOM   807  H  HZ1  . LYS   A 1 64  ? -4.671  -5.019  -7.936  0   90.77  ? 757  LYS   A HZ1  1 1 
ATOM   808  H  HZ2  . LYS   A 1 64  ? -4.77   -3.378  -7.801  0   88.97  ? 757  LYS   A HZ2  1 1 
ATOM   809  H  HZ3  . LYS   A 1 64  ? -3.394  -4.161  -7.381  0   89.42  ? 757  LYS   A HZ3  1 1 
ATOM   810  N  N    . GLU   A 1 65  ? -6.707  1.279   -6.636  1   61.39  ? 758  GLU   A N    1 1 
ATOM   811  C  CA   . GLU   A 1 65  ? -6.349  2.018   -7.853  1   60.78  ? 758  GLU   A CA   1 1 
ATOM   812  C  C    . GLU   A 1 65  ? -5.144  2.955   -7.614  1   59.54  ? 758  GLU   A C    1 1 
ATOM   813  O  O    . GLU   A 1 65  ? -4.267  3.038   -8.477  1   59.5   ? 758  GLU   A O    1 1 
ATOM   814  C  CB   . GLU   A 1 65  ? -7.569  2.822   -8.357  1   63.24  ? 758  GLU   A CB   1 1 
ATOM   815  C  CG   . GLU   A 1 65  ? -7.486  3.286   -9.802  1   68.1   ? 758  GLU   A CG   1 1 
ATOM   816  C  CD   . GLU   A 1 65  ? -8.579  4.27    -10.178 1   73.95  ? 758  GLU   A CD   1 1 
ATOM   817  O  OE1  . GLU   A 1 65  ? -8.305  5.492   -10.184 1   74.78  ? 758  GLU   A OE1  1 1 
ATOM   818  O  OE2  . GLU   A 1 65  ? -9.714  3.821   -10.453 1   76.13  ? 758  GLU   A OE2  1 1 
ATOM   819  H  H    . GLU   A 1 65  ? -7.654  1.466   -6.323  0   68.98  ? 758  GLU   A H    1 1 
ATOM   820  H  HA   . GLU   A 1 65  ? -6.07   1.302   -8.625  0   67.1   ? 758  GLU   A HA   1 1 
ATOM   821  H  HB2  . GLU   A 1 65  ? -8.46   2.2     -8.281  0   70.19  ? 758  GLU   A HB2  1 1 
ATOM   822  H  HB3  . GLU   A 1 65  ? -7.687  3.706   -7.731  0   68.75  ? 758  GLU   A HB3  1 1 
ATOM   823  H  HG2  . GLU   A 1 65  ? -6.525  3.767   -9.977  0   72.43  ? 758  GLU   A HG2  1 1 
ATOM   824  H  HG3  . GLU   A 1 65  ? -7.583  2.417   -10.45  0   73.85  ? 758  GLU   A HG3  1 1 
ATOM   825  N  N    . ILE   A 1 66  ? -5.094  3.649   -6.456  1   58.32  ? 759  ILE   A N    1 1 
ATOM   826  C  CA   . ILE   A 1 66  ? -3.969  4.543   -6.133  1   57.65  ? 759  ILE   A CA   1 1 
ATOM   827  C  C    . ILE   A 1 66  ? -2.701  3.722   -5.789  1   56.35  ? 759  ILE   A C    1 1 
ATOM   828  O  O    . ILE   A 1 66  ? -1.598  4.189   -6.063  1   56.18  ? 759  ILE   A O    1 1 
ATOM   829  C  CB   . ILE   A 1 66  ? -4.334  5.622   -5.043  1   58.43  ? 759  ILE   A CB   1 1 
ATOM   830  C  CG1  . ILE   A 1 66  ? -3.394  6.866   -5.105  1   59.59  ? 759  ILE   A CG1  1 1 
ATOM   831  C  CG2  . ILE   A 1 66  ? -4.347  5.037   -3.622  1   58.98  ? 759  ILE   A CG2  1 1 
ATOM   832  C  CD1  . ILE   A 1 66  ? -3.711  7.909   -6.179  1   60.92  ? 759  ILE   A CD1  1 1 
ATOM   833  H  H    . ILE   A 1 66  ? -5.82   3.626   -5.748  0   63.5   ? 759  ILE   A H    1 1 
ATOM   834  H  HA   . ILE   A 1 66  ? -3.731  5.089   -7.045  0   60.7   ? 759  ILE   A HA   1 1 
ATOM   835  H  HB   . ILE   A 1 66  ? -5.344  5.974   -5.252  0   62.04  ? 759  ILE   A HB   1 1 
ATOM   836  H  HG12 . ILE   A 1 66  ? -3.428  7.39    -4.151  0   62.17  ? 759  ILE   A HG12 1 1 
ATOM   837  H  HG13 . ILE   A 1 66  ? -2.38   6.52    -5.294  0   62     ? 759  ILE   A HG13 1 1 
ATOM   838  H  HG21 . ILE   A 1 66  ? -4.667  5.806   -2.922  0   63.1   ? 759  ILE   A HG21 1 1 
ATOM   839  H  HG22 . ILE   A 1 66  ? -5.047  4.203   -3.605  0   64.05  ? 759  ILE   A HG22 1 1 
ATOM   840  H  HG23 . ILE   A 1 66  ? -3.352  4.69    -3.345  0   63.25  ? 759  ILE   A HG23 1 1 
ATOM   841  H  HD11 . ILE   A 1 66  ? -2.971  8.705   -6.113  0   62.19  ? 759  ILE   A HD11 1 1 
ATOM   842  H  HD12 . ILE   A 1 66  ? -3.66   7.441   -7.162  0   62.64  ? 759  ILE   A HD12 1 1 
ATOM   843  H  HD13 . ILE   A 1 66  ? -4.702  8.323   -6.011  0   62.9   ? 759  ILE   A HD13 1 1 
ATOM   844  N  N    . LEU   A 1 67  ? -2.853  2.501   -5.226  1   55.18  ? 760  LEU   A N    1 1 
ATOM   845  C  CA   . LEU   A 1 67  ? -1.715  1.633   -4.914  1   54.48  ? 760  LEU   A CA   1 1 
ATOM   846  C  C    . LEU   A 1 67  ? -1.122  1.023   -6.188  1   52.87  ? 760  LEU   A C    1 1 
ATOM   847  O  O    . LEU   A 1 67  ? 0.087   0.817   -6.246  1   52.89  ? 760  LEU   A O    1 1 
ATOM   848  C  CB   . LEU   A 1 67  ? -2.125  0.531   -3.932  1   55.17  ? 760  LEU   A CB   1 1 
ATOM   849  C  CG   . LEU   A 1 67  ? -2.071  0.935   -2.465  1   56.98  ? 760  LEU   A CG   1 1 
ATOM   850  C  CD1  . LEU   A 1 67  ? -2.736  -0.104  -1.594  1   57.64  ? 760  LEU   A CD1  1 1 
ATOM   851  C  CD2  . LEU   A 1 67  ? -0.64   1.17    -2.02   1   57.68  ? 760  LEU   A CD2  1 1 
ATOM   852  H  H    . LEU   A 1 67  ? -3.743  2.094   -4.957  0   60.88  ? 760  LEU   A H    1 1 
ATOM   853  H  HA   . LEU   A 1 67  ? -0.936  2.223   -4.434  0   59.52  ? 760  LEU   A HA   1 1 
ATOM   854  H  HB2  . LEU   A 1 67  ? -3.146  0.227   -4.155  0   62.46  ? 760  LEU   A HB2  1 1 
ATOM   855  H  HB3  . LEU   A 1 67  ? -1.453  -0.316  -4.065  0   62.52  ? 760  LEU   A HB3  1 1 
ATOM   856  H  HG   . LEU   A 1 67  ? -2.614  1.871   -2.339  0   63.28  ? 760  LEU   A HG   1 1 
ATOM   857  H  HD11 . LEU   A 1 67  ? -2.681  0.219   -0.556  0   65.89  ? 760  LEU   A HD11 1 1 
ATOM   858  H  HD12 . LEU   A 1 67  ? -3.776  -0.207  -1.899  0   66.18  ? 760  LEU   A HD12 1 1 
ATOM   859  H  HD13 . LEU   A 1 67  ? -2.218  -1.054  -1.717  0   66.52  ? 760  LEU   A HD13 1 1 
ATOM   860  H  HD21 . LEU   A 1 67  ? -0.64   1.459   -0.97   0   64.32  ? 760  LEU   A HD21 1 1 
ATOM   861  H  HD22 . LEU   A 1 67  ? -0.071  0.251   -2.153  0   64.84  ? 760  LEU   A HD22 1 1 
ATOM   862  H  HD23 . LEU   A 1 67  ? -0.208  1.965   -2.626  0   63.36  ? 760  LEU   A HD23 1 1 
ATOM   863  N  N    . ASP   A 1 68  ? -1.953  0.747   -7.209  1   51.45  ? 761  ASP   A N    1 1 
ATOM   864  C  CA   . ASP   A 1 68  ? -1.448  0.263   -8.5    1   50.82  ? 761  ASP   A CA   1 1 
ATOM   865  C  C    . ASP   A 1 68  ? -0.613  1.365   -9.19   1   50.1   ? 761  ASP   A C    1 1 
ATOM   866  O  O    . ASP   A 1 68  ? 0.36    1.061   -9.877  1   50.08  ? 761  ASP   A O    1 1 
ATOM   867  C  CB   . ASP   A 1 68  ? -2.605  -0.165  -9.415  1   52.09  ? 761  ASP   A CB   1 1 
ATOM   868  C  CG   . ASP   A 1 68  ? -3.342  -1.404  -8.953  1   55.87  ? 761  ASP   A CG   1 1 
ATOM   869  O  OD1  . ASP   A 1 68  ? -2.719  -2.249  -8.265  1   56.06  ? 761  ASP   A OD1  1 1 
ATOM   870  O  OD2  . ASP   A 1 68  ? -4.539  -1.531  -9.273  1   58.13  ? 761  ASP   A OD2  1 1 
ATOM   871  H  H    . ASP   A 1 68  ? -2.964  0.83    -7.172  0   57.33  ? 761  ASP   A H    1 1 
ATOM   872  H  HA   . ASP   A 1 68  ? -0.79   -0.59   -8.341  0   57.21  ? 761  ASP   A HA   1 1 
ATOM   873  H  HB2  . ASP   A 1 68  ? -3.327  0.648   -9.476  0   57.69  ? 761  ASP   A HB2  1 1 
ATOM   874  H  HB3  . ASP   A 1 68  ? -2.205  -0.369  -10.407 0   58.06  ? 761  ASP   A HB3  1 1 
ATOM   875  N  N    . GLU   A 1 69  ? -1.01   2.636   -9.012  1   49.4   ? 762  GLU   A N    1 1 
ATOM   876  C  CA   . GLU   A 1 69  ? -0.293  3.798   -9.532  1   49.17  ? 762  GLU   A CA   1 1 
ATOM   877  C  C    . GLU   A 1 69  ? 1.086   3.884   -8.867  1   48.53  ? 762  GLU   A C    1 1 
ATOM   878  O  O    . GLU   A 1 69  ? 2.081   4.122   -9.547  1   48.51  ? 762  GLU   A O    1 1 
ATOM   879  C  CB   . GLU   A 1 69  ? -1.106  5.077   -9.263  1   51.34  ? 762  GLU   A CB   1 1 
ATOM   880  C  CG   . GLU   A 1 69  ? -0.447  6.349   -9.753  1   55.84  ? 762  GLU   A CG   1 1 
ATOM   881  C  CD   . GLU   A 1 69  ? -1.361  7.553   -9.851  1   60.67  ? 762  GLU   A CD   1 1 
ATOM   882  O  OE1  . GLU   A 1 69  ? -2.544  7.456   -9.452  1   61.48  ? 762  GLU   A OE1  1 1 
ATOM   883  O  OE2  . GLU   A 1 69  ? -0.891  8.597   -10.354 1   62.6   ? 762  GLU   A OE2  1 1 
ATOM   884  H  H    . GLU   A 1 69  ? -1.861  2.88    -8.514  0   53.09  ? 762  GLU   A H    1 1 
ATOM   885  H  HA   . GLU   A 1 69  ? -0.154  3.691   -10.607 0   51.54  ? 762  GLU   A HA   1 1 
ATOM   886  H  HB2  . GLU   A 1 69  ? -2.065  4.971   -9.768  0   53.38  ? 762  GLU   A HB2  1 1 
ATOM   887  H  HB3  . GLU   A 1 69  ? -1.265  5.174   -8.19   0   53.49  ? 762  GLU   A HB3  1 1 
ATOM   888  H  HG2  . GLU   A 1 69  ? 0.363   6.616   -9.076  0   56.81  ? 762  GLU   A HG2  1 1 
ATOM   889  H  HG3  . GLU   A 1 69  ? -0.046  6.164   -10.748 0   56.68  ? 762  GLU   A HG3  1 1 
ATOM   890  N  N    . ALA   A 1 70  ? 1.141   3.666   -7.545  1   47.85  ? 763  ALA   A N    1 1 
ATOM   891  C  CA   . ALA   A 1 70  ? 2.391   3.678   -6.797  1   47.72  ? 763  ALA   A CA   1 1 
ATOM   892  C  C    . ALA   A 1 70  ? 3.329   2.565   -7.262  1   47.61  ? 763  ALA   A C    1 1 
ATOM   893  O  O    . ALA   A 1 70  ? 4.524   2.807   -7.392  1   47.88  ? 763  ALA   A O    1 1 
ATOM   894  C  CB   . ALA   A 1 70  ? 2.114   3.531   -5.309  1   47.81  ? 763  ALA   A CB   1 1 
ATOM   895  H  H    . ALA   A 1 70  ? 0.328   3.494   -6.962  0   51.19  ? 763  ALA   A H    1 1 
ATOM   896  H  HA   . ALA   A 1 70  ? 2.878   4.637   -6.963  0   50.32  ? 763  ALA   A HA   1 1 
ATOM   897  H  HB1  . ALA   A 1 70  ? 3.06    3.545   -4.771  0   51.7   ? 763  ALA   A HB1  1 1 
ATOM   898  H  HB2  . ALA   A 1 70  ? 1.486   4.358   -4.981  0   51.07  ? 763  ALA   A HB2  1 1 
ATOM   899  H  HB3  . ALA   A 1 70  ? 1.605   2.583   -5.138  0   52.19  ? 763  ALA   A HB3  1 1 
ATOM   900  N  N    . TYR   A 1 71  ? 2.8     1.35    -7.499  1   47.14  ? 764  TYR   A N    1 1 
ATOM   901  C  CA   . TYR   A 1 71  ? 3.597   0.212   -7.969  1   47.21  ? 764  TYR   A CA   1 1 
ATOM   902  C  C    . TYR   A 1 71  ? 4.251   0.512   -9.321  1   46.98  ? 764  TYR   A C    1 1 
ATOM   903  O  O    . TYR   A 1 71  ? 5.431   0.22    -9.498  1   47.1   ? 764  TYR   A O    1 1 
ATOM   904  C  CB   . TYR   A 1 71  ? 2.734   -1.067  -8.038  1   47.35  ? 764  TYR   A CB   1 1 
ATOM   905  C  CG   . TYR   A 1 71  ? 3.264   -2.159  -8.947  1   48.28  ? 764  TYR   A CG   1 1 
ATOM   906  C  CD1  . TYR   A 1 71  ? 4.4     -2.88   -8.61   1   49.28  ? 764  TYR   A CD1  1 1 
ATOM   907  C  CD2  . TYR   A 1 71  ? 2.605   -2.496  -10.12  1   49.23  ? 764  TYR   A CD2  1 1 
ATOM   908  C  CE1  . TYR   A 1 71  ? 4.866   -3.91   -9.415  1   50.25  ? 764  TYR   A CE1  1 1 
ATOM   909  C  CE2  . TYR   A 1 71  ? 3.075   -3.507  -10.946 1   50.25  ? 764  TYR   A CE2  1 1 
ATOM   910  C  CZ   . TYR   A 1 71  ? 4.215   -4.204  -10.596 1   51.31  ? 764  TYR   A CZ   1 1 
ATOM   911  O  OH   . TYR   A 1 71  ? 4.679   -5.213  -11.404 1   53.19  ? 764  TYR   A OH   1 1 
ATOM   912  H  H    . TYR   A 1 71  ? 1.823   1.124   -7.348  0   52.05  ? 764  TYR   A H    1 1 
ATOM   913  H  HA   . TYR   A 1 71  ? 4.395   0.028   -7.251  0   53.2   ? 764  TYR   A HA   1 1 
ATOM   914  H  HB2  . TYR   A 1 71  ? 2.679   -1.481  -7.033  0   54.6   ? 764  TYR   A HB2  1 1 
ATOM   915  H  HB3  . TYR   A 1 71  ? 1.732   -0.814  -8.383  0   53.66  ? 764  TYR   A HB3  1 1 
ATOM   916  H  HD1  . TYR   A 1 71  ? 4.924   -2.644  -7.7    0   57.68  ? 764  TYR   A HD1  1 1 
ATOM   917  H  HD2  . TYR   A 1 71  ? 1.72    -1.955  -10.408 0   56.21  ? 764  TYR   A HD2  1 1 
ATOM   918  H  HE1  . TYR   A 1 71  ? 5.763   -4.441  -9.146  0   60.4   ? 764  TYR   A HE1  1 1 
ATOM   919  H  HE2  . TYR   A 1 71  ? 2.553   -3.746  -11.857 0   58.76  ? 764  TYR   A HE2  1 1 
ATOM   920  H  HH   . TYR   A 1 71  ? 4.722   -4.898  -12.345 0   63.02  ? 764  TYR   A HH   1 1 
ATOM   921  N  N    . VAL   A 1 72  ? 3.488   1.05    -10.279 1   46.41  ? 765  VAL   A N    1 1 
ATOM   922  C  CA   . VAL   A 1 72  ? 4.023   1.385   -11.607 1   46.5   ? 765  VAL   A CA   1 1 
ATOM   923  C  C    . VAL   A 1 72  ? 5.16    2.417   -11.467 1   46.09  ? 765  VAL   A C    1 1 
ATOM   924  O  O    . VAL   A 1 72  ? 6.228   2.244   -12.055 1   46.14  ? 765  VAL   A O    1 1 
ATOM   925  C  CB   . VAL   A 1 72  ? 2.887   1.884   -12.57  1   47.38  ? 765  VAL   A CB   1 1 
ATOM   926  C  CG1  . VAL   A 1 72  ? 3.439   2.746   -13.706 1   48.05  ? 765  VAL   A CG1  1 1 
ATOM   927  C  CG2  . VAL   A 1 72  ? 2.087   0.713   -13.14  1   47.89  ? 765  VAL   A CG2  1 1 
ATOM   928  H  H    . VAL   A 1 72  ? 2.5     1.253   -10.166 0   50.58  ? 765  VAL   A H    1 1 
ATOM   929  H  HA   . VAL   A 1 72  ? 4.478   0.485   -12.021 0   51.1   ? 765  VAL   A HA   1 1 
ATOM   930  H  HB   . VAL   A 1 72  ? 2.188   2.516   -12.023 0   50.26  ? 765  VAL   A HB   1 1 
ATOM   931  H  HG11 . VAL   A 1 72  ? 2.637   2.952   -14.41  0   50.08  ? 765  VAL   A HG11 1 1 
ATOM   932  H  HG12 . VAL   A 1 72  ? 3.805   3.693   -13.314 0   50.01  ? 765  VAL   A HG12 1 1 
ATOM   933  H  HG13 . VAL   A 1 72  ? 4.248   2.205   -14.195 0   50.87  ? 765  VAL   A HG13 1 1 
ATOM   934  H  HG21 . VAL   A 1 72  ? 1.31    1.103   -13.795 0   51.52  ? 765  VAL   A HG21 1 1 
ATOM   935  H  HG22 . VAL   A 1 72  ? 2.76    0.07    -13.707 0   52.41  ? 765  VAL   A HG22 1 1 
ATOM   936  H  HG23 . VAL   A 1 72  ? 1.642   0.153   -12.318 0   52.56  ? 765  VAL   A HG23 1 1 
ATOM   937  N  N    . MET   A 1 73  ? 4.919   3.47    -10.681 1   45.61  ? 766  MET   A N    1 1 
ATOM   938  C  CA   . MET   A 1 73  ? 5.89    4.532   -10.466 1   45.64  ? 766  MET   A CA   1 1 
ATOM   939  C  C    . MET   A 1 73  ? 7.158   4.018   -9.796  1   45.91  ? 766  MET   A C    1 1 
ATOM   940  O  O    . MET   A 1 73  ? 8.246   4.441   -10.177 1   45.96  ? 766  MET   A O    1 1 
ATOM   941  C  CB   . MET   A 1 73  ? 5.278   5.662   -9.63   1   46     ? 766  MET   A CB   1 1 
ATOM   942  C  CG   . MET   A 1 73  ? 4.247   6.481   -10.387 1   47.2   ? 766  MET   A CG   1 1 
ATOM   943  S  SD   . MET   A 1 73  ? 3.625   7.881   -9.449  1   47.61  ? 766  MET   A SD   1 1 
ATOM   944  C  CE   . MET   A 1 73  ? 4.928   9.07    -9.738  1   45.11  ? 766  MET   A CE   1 1 
ATOM   945  H  H    . MET   A 1 73  ? 4.049   3.597   -10.174 0   48.24  ? 766  MET   A H    1 1 
ATOM   946  H  HA   . MET   A 1 73  ? 6.168   4.936   -11.439 0   47.65  ? 766  MET   A HA   1 1 
ATOM   947  H  HB2  . MET   A 1 73  ? 4.796   5.242   -8.749  0   48.1   ? 766  MET   A HB2  1 1 
ATOM   948  H  HB3  . MET   A 1 73  ? 6.083   6.326   -9.318  0   47.71  ? 766  MET   A HB3  1 1 
ATOM   949  H  HG2  . MET   A 1 73  ? 4.702   6.864   -11.299 0   47.88  ? 766  MET   A HG2  1 1 
ATOM   950  H  HG3  . MET   A 1 73  ? 3.401   5.842   -10.635 0   48.32  ? 766  MET   A HG3  1 1 
ATOM   951  H  HE1  . MET   A 1 73  ? 4.682   9.996   -9.221  0   45.06  ? 766  MET   A HE1  1 1 
ATOM   952  H  HE2  . MET   A 1 73  ? 5.865   8.669   -9.355  0   45.75  ? 766  MET   A HE2  1 1 
ATOM   953  H  HE3  . MET   A 1 73  ? 5.011   9.251   -10.808 0   45     ? 766  MET   A HE3  1 1 
ATOM   954  N  N    . ALA   A 1 74  ? 7.034   3.124   -8.807  1   45.9   ? 767  ALA   A N    1 1 
ATOM   955  C  CA   . ALA   A 1 74  ? 8.193   2.558   -8.125  1   46.46  ? 767  ALA   A CA   1 1 
ATOM   956  C  C    . ALA   A 1 74  ? 8.957   1.581   -9.018  1   47.01  ? 767  ALA   A C    1 1 
ATOM   957  O  O    . ALA   A 1 74  ? 10.18   1.511   -8.922  1   47.26  ? 767  ALA   A O    1 1 
ATOM   958  C  CB   . ALA   A 1 74  ? 7.753   1.864   -6.858  1   46.55  ? 767  ALA   A CB   1 1 
ATOM   959  H  H    . ALA   A 1 74  ? 6.148   2.781   -8.447  0   49.88  ? 767  ALA   A H    1 1 
ATOM   960  H  HA   . ALA   A 1 74  ? 8.871   3.359   -7.837  0   51.12  ? 767  ALA   A HA   1 1 
ATOM   961  H  HB1  . ALA   A 1 74  ? 8.626   1.466   -6.342  0   52.78  ? 767  ALA   A HB1  1 1 
ATOM   962  H  HB2  . ALA   A 1 74  ? 7.257   2.618   -6.251  0   51.52  ? 767  ALA   A HB2  1 1 
ATOM   963  H  HB3  . ALA   A 1 74  ? 7.06    1.061   -7.105  0   52.33  ? 767  ALA   A HB3  1 1 
ATOM   964  N  N    . SER   A 1 75  ? 8.244   0.824   -9.874  1   47.12  ? 768  SER   A N    1 1 
ATOM   965  C  CA   . SER   A 1 75  ? 8.859   -0.127  -10.804 1   47.69  ? 768  SER   A CA   1 1 
ATOM   966  C  C    . SER   A 1 75  ? 9.8     0.57    -11.786 1   47.99  ? 768  SER   A C    1 1 
ATOM   967  O  O    . SER   A 1 75  ? 10.827  -0.005  -12.149 1   48.32  ? 768  SER   A O    1 1 
ATOM   968  C  CB   . SER   A 1 75  ? 7.788   -0.867  -11.6   1   49.02  ? 768  SER   A CB   1 1 
ATOM   969  O  OG   . SER   A 1 75  ? 6.812   -1.446  -10.748 1   51.27  ? 768  SER   A OG   1 1 
ATOM   970  H  H    . SER   A 1 75  ? 7.231   0.832   -9.93   0   52.5   ? 768  SER   A H    1 1 
ATOM   971  H  HA   . SER   A 1 75  ? 9.432   -0.862  -10.24  0   55.23  ? 768  SER   A HA   1 1 
ATOM   972  H  HB2  . SER   A 1 75  ? 7.315   -0.168  -12.288 0   54.81  ? 768  SER   A HB2  1 1 
ATOM   973  H  HB3  . SER   A 1 75  ? 8.27    -1.661  -12.167 0   56.45  ? 768  SER   A HB3  1 1 
ATOM   974  H  HG   . SER   A 1 75  ? 6.019   -0.855  -10.654 0   57.59  ? 768  SER   A HG   1 1 
ATOM   975  N  N    . VAL   A 1 76  ? 9.451   1.805   -12.205 1   47.73  ? 769  VAL   A N    1 1 
ATOM   976  C  CA   . VAL   A 1 76  ? 10.246  2.586   -13.157 1   48.11  ? 769  VAL   A CA   1 1 
ATOM   977  C  C    . VAL   A 1 76  ? 11.133  3.665   -12.485 1   48.76  ? 769  VAL   A C    1 1 
ATOM   978  O  O    . VAL   A 1 76  ? 11.666  4.507   -13.201 1   48.67  ? 769  VAL   A O    1 1 
ATOM   979  C  CB   . VAL   A 1 76  ? 9.359   3.206   -14.283 1   48.6   ? 769  VAL   A CB   1 1 
ATOM   980  C  CG1  . VAL   A 1 76  ? 8.533   2.134   -14.991 1   49.03  ? 769  VAL   A CG1  1 1 
ATOM   981  C  CG2  . VAL   A 1 76  ? 8.46    4.334   -13.77  1   48.89  ? 769  VAL   A CG2  1 1 
ATOM   982  H  H    . VAL   A 1 76  ? 8.617   2.284   -11.883 0   52.18  ? 769  VAL   A H    1 1 
ATOM   983  H  HA   . VAL   A 1 76  ? 10.932  1.916   -13.673 0   53.65  ? 769  VAL   A HA   1 1 
ATOM   984  H  HB   . VAL   A 1 76  ? 10.014  3.638   -15.039 0   52.26  ? 769  VAL   A HB   1 1 
ATOM   985  H  HG11 . VAL   A 1 76  ? 7.948   2.612   -15.776 0   52.34  ? 769  VAL   A HG11 1 1 
ATOM   986  H  HG12 . VAL   A 1 76  ? 9.209   1.401   -15.427 0   53.78  ? 769  VAL   A HG12 1 1 
ATOM   987  H  HG13 . VAL   A 1 76  ? 7.862   1.649   -14.284 0   53.24  ? 769  VAL   A HG13 1 1 
ATOM   988  H  HG21 . VAL   A 1 76  ? 7.86    4.7     -14.602 0   51.01  ? 769  VAL   A HG21 1 1 
ATOM   989  H  HG22 . VAL   A 1 76  ? 7.804   3.944   -12.993 0   51.72  ? 769  VAL   A HG22 1 1 
ATOM   990  H  HG23 . VAL   A 1 76  ? 9.061   5.151   -13.375 0   51.5   ? 769  VAL   A HG23 1 1 
ATOM   991  N  N    . ASP   A 1 77  ? 11.37   3.614   -11.156 1   49.33  ? 770  ASP   A N    1 1 
ATOM   992  C  CA   . ASP   A 1 77  ? 12.173  4.637   -10.44  1   50.32  ? 770  ASP   A CA   1 1 
ATOM   993  C  C    . ASP   A 1 77  ? 13.676  4.555   -10.728 1   50.7   ? 770  ASP   A C    1 1 
ATOM   994  O  O    . ASP   A 1 77  ? 14.298  5.607   -10.839 1   51.39  ? 770  ASP   A O    1 1 
ATOM   995  C  CB   . ASP   A 1 77  ? 11.833  4.419   -8.942  1   52.67  ? 770  ASP   A CB   1 1 
ATOM   996  C  CG   . ASP   A 1 77  ? 12.188  5.74    -8.188  1   58.41  ? 770  ASP   A CG   1 1 
ATOM   997  O  OD1  . ASP   A 1 77  ? 13.238  6.343   -8.497  1   59.37  ? 770  ASP   A OD1  1 1 
ATOM   998  O  OD2  . ASP   A 1 77  ? 11.407  6.143   -7.299  1   61.11  ? 770  ASP   A OD2  1 1 
ATOM   999  H  H    . ASP   A 1 77  ? 11.069  2.816   -10.604 0   54.8   ? 770  ASP   A H    1 1 
ATOM   1000 H  HA   . ASP   A 1 77  ? 11.821  5.617   -10.767 0   54.68  ? 770  ASP   A HA   1 1 
ATOM   1001 H  HB2  . ASP   A 1 77  ? 10.768  4.216   -8.836  0   57.54  ? 770  ASP   A HB2  1 1 
ATOM   1002 H  HB3  . ASP   A 1 77  ? 12.421  3.588   -8.555  0   58.91  ? 770  ASP   A HB3  1 1 
ATOM   1003 N  N    . ASN   A 1 78  A 14.279  3.363   -10.826 1   50.11  ? 770  ASN   A N    1 1 
ATOM   1004 C  CA   . ASN   A 1 78  A 15.708  3.185   -11.128 1   50.13  ? 770  ASN   A CA   1 1 
ATOM   1005 C  C    . ASN   A 1 78  A 15.858  2.757   -12.601 1   49.48  ? 770  ASN   A C    1 1 
ATOM   1006 O  O    . ASN   A 1 78  A 15.281  1.727   -12.951 1   49.74  ? 770  ASN   A O    1 1 
ATOM   1007 C  CB   . ASN   A 1 78  A 16.143  2.095   -10.123 1   51.39  ? 770  ASN   A CB   1 1 
ATOM   1008 C  CG   . ASN   A 1 78  A 17.687  2.063   -10.202 1   54.7   ? 770  ASN   A CG   1 1 
ATOM   1009 O  OD1  . ASN   A 1 78  A 18.277  1.491   -11.124 1   56     ? 770  ASN   A OD1  1 1 
ATOM   1010 N  ND2  . ASN   A 1 78  A 18.359  2.689   -9.243  1   55.5   ? 770  ASN   A ND2  1 1 
ATOM   1011 H  H    . ASN   A 1 78  A 13.797  2.479   -10.696 0   57.53  ? 770  ASN   A H    1 1 
ATOM   1012 H  HA   . ASN   A 1 78  A 16.245  4.11    -10.921 0   58.53  ? 770  ASN   A HA   1 1 
ATOM   1013 H  HB2  . ASN   A 1 78  A 15.804  2.365   -9.123  0   60.77  ? 770  ASN   A HB2  1 1 
ATOM   1014 H  HB3  . ASN   A 1 78  A 15.73   1.13    -10.413 0   61.26  ? 770  ASN   A HB3  1 1 
ATOM   1015 H  HD21 . ASN   A 1 78  A 19.373  2.689   -9.257  0   67.97  ? 770  ASN   A HD21 1 1 
ATOM   1016 H  HD22 . ASN   A 1 78  A 17.865  3.163   -8.494  0   66.34  ? 770  ASN   A HD22 1 1 
ATOM   1017 N  N    . PRO   A 1 79  B 16.576  3.489   -13.496 1   48.39  ? 770  PRO   A N    1 1 
ATOM   1018 C  CA   . PRO   A 1 79  B 17.369  4.717   -13.276 1   47.96  ? 770  PRO   A CA   1 1 
ATOM   1019 C  C    . PRO   A 1 79  B 16.565  6.016   -13.18  1   47.76  ? 770  PRO   A C    1 1 
ATOM   1020 O  O    . PRO   A 1 79  B 17.037  6.995   -12.605 1   48.49  ? 770  PRO   A O    1 1 
ATOM   1021 C  CB   . PRO   A 1 79  B 18.303  4.733   -14.491 1   48.66  ? 770  PRO   A CB   1 1 
ATOM   1022 C  CG   . PRO   A 1 79  B 17.484  4.119   -15.579 1   49.15  ? 770  PRO   A CG   1 1 
ATOM   1023 C  CD   . PRO   A 1 79  B 16.679  3.039   -14.903 1   47.67  ? 770  PRO   A CD   1 1 
ATOM   1024 H  HA   . PRO   A 1 79  B 17.985  4.613   -12.383 0   57.24  ? 770  PRO   A HA   1 1 
ATOM   1025 H  HB2  . PRO   A 1 79  B 18.573  5.758   -14.742 0   57.78  ? 770  PRO   A HB2  1 1 
ATOM   1026 H  HB3  . PRO   A 1 79  B 19.186  4.13    -14.286 0   59.25  ? 770  PRO   A HB3  1 1 
ATOM   1027 H  HG2  . PRO   A 1 79  B 16.832  4.871   -16.019 0   56.8   ? 770  PRO   A HG2  1 1 
ATOM   1028 H  HG3  . PRO   A 1 79  B 18.145  3.689   -16.331 0   58.6   ? 770  PRO   A HG3  1 1 
ATOM   1029 H  HD2  . PRO   A 1 79  B 15.688  2.981   -15.35  0   55.5   ? 770  PRO   A HD2  1 1 
ATOM   1030 H  HD3  . PRO   A 1 79  B 17.199  2.083   -14.963 0   57.4   ? 770  PRO   A HD3  1 1 
ATOM   1031 N  N    . GLY   A 1 80  C 15.37   6.031   -13.749 1   46.47  ? 770  GLY   A N    1 1 
ATOM   1032 C  CA   . GLY   A 1 80  C 14.482  7.179   -13.803 1   45.49  ? 770  GLY   A CA   1 1 
ATOM   1033 C  C    . GLY   A 1 80  C 14.843  8.101   -14.949 1   44.11  ? 770  GLY   A C    1 1 
ATOM   1034 O  O    . GLY   A 1 80  C 15.74   7.807   -15.747 1   44.27  ? 770  GLY   A O    1 1 
ATOM   1035 H  H    . GLY   A 1 80  C 14.959  5.233   -14.222 0   52.62  ? 770  GLY   A H    1 1 
ATOM   1036 H  HA2  . GLY   A 1 80  C 13.458  6.836   -13.95  0   49.76  ? 770  GLY   A HA2  1 1 
ATOM   1037 H  HA3  . GLY   A 1 80  C 14.522  7.723   -12.862 0   50.41  ? 770  GLY   A HA3  1 1 
ATOM   1038 N  N    . ASN   A 1 81  ? 14.139  9.22    -15.043 1   42.62  ? 771  ASN   A N    1 1 
ATOM   1039 C  CA   . ASN   A 1 81  ? 14.356  10.184  -16.111 1   41.34  ? 771  ASN   A CA   1 1 
ATOM   1040 C  C    . ASN   A 1 81  ? 14.072  11.589  -15.578 1   40.57  ? 771  ASN   A C    1 1 
ATOM   1041 O  O    . ASN   A 1 81  ? 13.107  11.731  -14.821 1   40.9   ? 771  ASN   A O    1 1 
ATOM   1042 C  CB   . ASN   A 1 81  ? 13.409  9.874   -17.266 1   41.24  ? 771  ASN   A CB   1 1 
ATOM   1043 C  CG   . ASN   A 1 81  ? 13.711  10.652  -18.514 1   42.55  ? 771  ASN   A CG   1 1 
ATOM   1044 O  OD1  . ASN   A 1 81  ? 13.065  11.661  -18.81  1   42.37  ? 771  ASN   A OD1  1 1 
ATOM   1045 N  ND2  . ASN   A 1 81  ? 14.709  10.214  -19.275 1   42.78  ? 771  ASN   A ND2  1 1 
ATOM   1046 H  H    . ASN   A 1 81  ? 13.405  9.487   -14.395 0   45.85  ? 771  ASN   A H    1 1 
ATOM   1047 H  HA   . ASN   A 1 81  ? 15.379  10.105  -16.474 0   45.66  ? 771  ASN   A HA   1 1 
ATOM   1048 H  HB2  . ASN   A 1 81  ? 13.479  8.814   -17.505 0   44.24  ? 771  ASN   A HB2  1 1 
ATOM   1049 H  HB3  . ASN   A 1 81  ? 12.391  10.115  -16.962 0   43.18  ? 771  ASN   A HB3  1 1 
ATOM   1050 H  HD21 . ASN   A 1 81  ? 14.944  10.71   -20.129 0   46.16  ? 771  ASN   A HD21 1 1 
ATOM   1051 H  HD22 . ASN   A 1 81  ? 15.233  9.386   -19.014 0   46.84  ? 771  ASN   A HD22 1 1 
ATOM   1052 N  N    . PRO   A 1 82  ? 14.835  12.65   -15.949 1   39.33  ? 772  PRO   A N    1 1 
ATOM   1053 C  CA   . PRO   A 1 82  ? 14.482  13.994  -15.45  1   38.48  ? 772  PRO   A CA   1 1 
ATOM   1054 C  C    . PRO   A 1 82  ? 13.072  14.451  -15.819 1   37.92  ? 772  PRO   A C    1 1 
ATOM   1055 O  O    . PRO   A 1 82  ? 12.548  15.331  -15.148 1   37.83  ? 772  PRO   A O    1 1 
ATOM   1056 C  CB   . PRO   A 1 82  ? 15.512  14.916  -16.113 1   39.1   ? 772  PRO   A CB   1 1 
ATOM   1057 C  CG   . PRO   A 1 82  ? 16.599  14.037  -16.578 1   39.76  ? 772  PRO   A CG   1 1 
ATOM   1058 C  CD   . PRO   A 1 82  ? 16.019  12.698  -16.837 1   38.42  ? 772  PRO   A CD   1 1 
ATOM   1059 H  HA   . PRO   A 1 82  ? 14.611  14.045  -14.37  0   41.91  ? 772  PRO   A HA   1 1 
ATOM   1060 H  HB2  . PRO   A 1 82  ? 15.052  15.438  -16.951 0   42.62  ? 772  PRO   A HB2  1 1 
ATOM   1061 H  HB3  . PRO   A 1 82  ? 15.887  15.625  -15.376 0   43.61  ? 772  PRO   A HB3  1 1 
ATOM   1062 H  HG2  . PRO   A 1 82  ? 17.023  14.448  -17.493 0   45.02  ? 772  PRO   A HG2  1 1 
ATOM   1063 H  HG3  . PRO   A 1 82  ? 17.358  13.968  -15.799 0   45.59  ? 772  PRO   A HG3  1 1 
ATOM   1064 H  HD2  . PRO   A 1 82  ? 15.715  12.615  -17.88  0   42.45  ? 772  PRO   A HD2  1 1 
ATOM   1065 H  HD3  . PRO   A 1 82  ? 16.752  11.939  -16.569 0   43.62  ? 772  PRO   A HD3  1 1 
ATOM   1066 N  N    . HIS   A 1 83  ? 12.469  13.882  -16.889 1   37.35  ? 773  HIS   A N    1 1 
ATOM   1067 C  CA   . HIS   A 1 83  ? 11.15   14.278  -17.392 1   37.08  ? 773  HIS   A CA   1 1 
ATOM   1068 C  C    . HIS   A 1 83  ? 10.026  13.295  -17.044 1   37.63  ? 773  HIS   A C    1 1 
ATOM   1069 O  O    . HIS   A 1 83  ? 9.009   13.29   -17.728 1   37.35  ? 773  HIS   A O    1 1 
ATOM   1070 C  CB   . HIS   A 1 83  ? 11.217  14.474  -18.913 1   37.05  ? 773  HIS   A CB   1 1 
ATOM   1071 C  CG   . HIS   A 1 83  ? 12.379  15.304  -19.344 1   38.7   ? 773  HIS   A CG   1 1 
ATOM   1072 N  ND1  . HIS   A 1 83  ? 12.539  16.599  -18.897 1   40.45  ? 773  HIS   A ND1  1 1 
ATOM   1073 C  CD2  . HIS   A 1 83  ? 13.453  14.963  -20.095 1   39.62  ? 773  HIS   A CD2  1 1 
ATOM   1074 C  CE1  . HIS   A 1 83  ? 13.701  17.009  -19.384 1   40.81  ? 773  HIS   A CE1  1 1 
ATOM   1075 N  NE2  . HIS   A 1 83  ? 14.274  16.065  -20.134 1   40.6   ? 773  HIS   A NE2  1 1 
ATOM   1076 H  H    . HIS   A 1 83  ? 12.876  13.138  -17.446 0   39.07  ? 773  HIS   A H    1 1 
ATOM   1077 H  HA   . HIS   A 1 83  ? 10.871  15.244  -16.974 0   37.44  ? 773  HIS   A HA   1 1 
ATOM   1078 H  HB2  . HIS   A 1 83  ? 11.297  13.502  -19.396 0   37.36  ? 773  HIS   A HB2  1 1 
ATOM   1079 H  HB3  . HIS   A 1 83  ? 10.314  14.983  -19.248 0   36.7   ? 773  HIS   A HB3  1 1 
ATOM   1080 H  HD1  . HIS   A 1 83  ? 11.898  17.132  -18.319 0   41.41  ? 773  HIS   A HD1  1 1 
ATOM   1081 H  HD2  . HIS   A 1 83  ? 13.626  14.012  -20.569 0   41.45  ? 773  HIS   A HD2  1 1 
ATOM   1082 H  HE1  . HIS   A 1 83  ? 14.13   17.98   -19.199 0   43.51  ? 773  HIS   A HE1  1 1 
ATOM   1083 N  N    . VAL   A 1 84  ? 10.196  12.48   -15.99  1   38.19  ? 774  VAL   A N    1 1 
ATOM   1084 C  CA   . VAL   A 1 84  ? 9.179   11.543  -15.509 1   39     ? 774  VAL   A CA   1 1 
ATOM   1085 C  C    . VAL   A 1 84  ? 9.092   11.778  -14.006 1   39.83  ? 774  VAL   A C    1 1 
ATOM   1086 O  O    . VAL   A 1 84  ? 10.122  11.742  -13.322 1   39.46  ? 774  VAL   A O    1 1 
ATOM   1087 C  CB   . VAL   A 1 84  ? 9.502   10.057  -15.844 1   39.73  ? 774  VAL   A CB   1 1 
ATOM   1088 C  CG1  . VAL   A 1 84  ? 8.606   9.089   -15.063 1   40.26  ? 774  VAL   A CG1  1 1 
ATOM   1089 C  CG2  . VAL   A 1 84  ? 9.364   9.795   -17.339 1   40.22  ? 774  VAL   A CG2  1 1 
ATOM   1090 H  H    . VAL   A 1 84  ? 11.039  12.445  -15.427 0   39.04  ? 774  VAL   A H    1 1 
ATOM   1091 H  HA   . VAL   A 1 84  ? 8.21    11.779  -15.947 0   38.36  ? 774  VAL   A HA   1 1 
ATOM   1092 H  HB   . VAL   A 1 84  ? 10.535  9.852   -15.565 0   40.77  ? 774  VAL   A HB   1 1 
ATOM   1093 H  HG11 . VAL   A 1 84  ? 8.849   8.074   -15.374 0   41.07  ? 774  VAL   A HG11 1 1 
ATOM   1094 H  HG12 . VAL   A 1 84  ? 8.779   9.179   -13.992 0   40.84  ? 774  VAL   A HG12 1 1 
ATOM   1095 H  HG13 . VAL   A 1 84  ? 7.564   9.302   -15.296 0   40.08  ? 774  VAL   A HG13 1 1 
ATOM   1096 H  HG21 . VAL   A 1 84  ? 9.597   8.748   -17.531 0   40.81  ? 774  VAL   A HG21 1 1 
ATOM   1097 H  HG22 . VAL   A 1 84  ? 8.343   10.013  -17.648 0   39.79  ? 774  VAL   A HG22 1 1 
ATOM   1098 H  HG23 . VAL   A 1 84  ? 10.06   10.438  -17.875 0   40.5   ? 774  VAL   A HG23 1 1 
ATOM   1099 N  N    . CYS   A 1 85  ? 7.866   12.028  -13.49  1   40.6   ? 775  CYS   A N    1 1 
ATOM   1100 C  CA   . CYS   A 1 85  ? 7.643   12.268  -12.063 1   41.96  ? 775  CYS   A CA   1 1 
ATOM   1101 C  C    . CYS   A 1 85  ? 8.086   11.064  -11.254 1   42.71  ? 775  CYS   A C    1 1 
ATOM   1102 O  O    . CYS   A 1 85  ? 7.776   9.934   -11.633 1   42.79  ? 775  CYS   A O    1 1 
ATOM   1103 C  CB   . CYS   A 1 85  ? 6.176   12.599  -11.775 1   43.4   ? 775  CYS   A CB   1 1 
ATOM   1104 S  SG   . CYS   A 1 85  ? 5.865   14.326  -11.322 1   49.04  ? 775  CYS   A SG   1 1 
ATOM   1105 H  H    . CYS   A 1 85  ? 7.025   12.069  -14.057 0   39.74  ? 775  CYS   A H    1 1 
ATOM   1106 H  HA   . CYS   A 1 85  ? 8.298   13.092  -11.783 0   41.93  ? 775  CYS   A HA   1 1 
ATOM   1107 H  HB2  . CYS   A 1 85  ? 5.548   12.36   -12.631 0   42.28  ? 775  CYS   A HB2  1 1 
ATOM   1108 H  HB3  . CYS   A 1 85  ? 5.863   11.988  -10.929 0   42.79  ? 775  CYS   A HB3  1 1 
ATOM   1109 H  HG   . CYS   A 1 85  ? 4.565   14.478  -11.04  0   47.78  ? 775  CYS   A HG   1 1 
ATOM   1110 N  N    . ARG   A 1 86  ? 8.806   11.309  -10.14  1   43.25  ? 776  ARG   A N    1 1 
ATOM   1111 C  CA   . ARG   A 1 86  ? 9.33    10.25   -9.278  1   44.29  ? 776  ARG   A CA   1 1 
ATOM   1112 C  C    . ARG   A 1 86  ? 8.506   10.176  -8.018  1   44.73  ? 776  ARG   A C    1 1 
ATOM   1113 O  O    . ARG   A 1 86  ? 8.279   11.199  -7.37   1   45.02  ? 776  ARG   A O    1 1 
ATOM   1114 C  CB   . ARG   A 1 86  ? 10.784  10.506  -8.849  1   46     ? 776  ARG   A CB   1 1 
ATOM   1115 C  CG   . ARG   A 1 86  ? 11.705  11.109  -9.892  1   49.98  ? 776  ARG   A CG   1 1 
ATOM   1116 C  CD   . ARG   A 1 86  ? 13.112  11.263  -9.33   1   53.29  ? 776  ARG   A CD   1 1 
ATOM   1117 N  NE   . ARG   A 1 86  ? 13.82   9.985   -9.314  1   56.54  ? 776  ARG   A NE   1 1 
ATOM   1118 C  CZ   . ARG   A 1 86  ? 14.477  9.453   -10.344 1   59.9   ? 776  ARG   A CZ   1 1 
ATOM   1119 N  NH1  . ARG   A 1 86  ? 14.536  10.091  -11.512 1   60.44  ? 776  ARG   A NH1  1 1 
ATOM   1120 N  NH2  . ARG   A 1 86  ? 15.084  8.281   -10.215 1   59.91  ? 776  ARG   A NH2  1 1 
ATOM   1121 H  H    . ARG   A 1 86  ? 8.999   12.243  -9.794  0   44.13  ? 776  ARG   A H    1 1 
ATOM   1122 H  HA   . ARG   A 1 86  ? 9.301   9.288   -9.788  0   45.93  ? 776  ARG   A HA   1 1 
ATOM   1123 H  HB2  . ARG   A 1 86  ? 10.779  11.187  -7.999  0   48.44  ? 776  ARG   A HB2  1 1 
ATOM   1124 H  HB3  . ARG   A 1 86  ? 11.215  9.556   -8.539  0   48.94  ? 776  ARG   A HB3  1 1 
ATOM   1125 H  HG2  . ARG   A 1 86  ? 11.75   10.453  -10.761 0   52.5   ? 776  ARG   A HG2  1 1 
ATOM   1126 H  HG3  . ARG   A 1 86  ? 11.352  12.098  -10.18  0   52.08  ? 776  ARG   A HG3  1 1 
ATOM   1127 H  HD2  . ARG   A 1 86  ? 13.666  12.008  -9.899  0   57.11  ? 776  ARG   A HD2  1 1 
ATOM   1128 H  HD3  . ARG   A 1 86  ? 13.047  11.598  -8.296  0   57.08  ? 776  ARG   A HD3  1 1 
ATOM   1129 H  HE   . ARG   A 1 86  ? 13.797  9.462   -8.445  0   61.29  ? 776  ARG   A HE   1 1 
ATOM   1130 H  HH11 . ARG   A 1 86  ? 14.095  10.987  -11.686 0   64.36  ? 776  ARG   A HH11 1 1 
ATOM   1131 H  HH12 . ARG   A 1 86  ? 15.063  9.677   -12.272 0   65.29  ? 776  ARG   A HH12 1 1 
ATOM   1132 H  HH21 . ARG   A 1 86  ? 15.051  7.789   -9.327  0   65.94  ? 776  ARG   A HH21 1 1 
ATOM   1133 H  HH22 . ARG   A 1 86  ? 15.598  7.877   -10.991 0   66     ? 776  ARG   A HH22 1 1 
ATOM   1134 N  N    . LEU   A 1 87  ? 8.122   8.969   -7.625  1   44.63  ? 777  LEU   A N    1 1 
ATOM   1135 C  CA   . LEU   A 1 87  ? 7.387   8.765   -6.392  1   45.23  ? 777  LEU   A CA   1 1 
ATOM   1136 C  C    . LEU   A 1 87  ? 8.371   8.778   -5.221  1   45.8   ? 777  LEU   A C    1 1 
ATOM   1137 O  O    . LEU   A 1 87  ? 9.259   7.924   -5.164  1   45.8   ? 777  LEU   A O    1 1 
ATOM   1138 C  CB   . LEU   A 1 87  ? 6.668   7.413   -6.452  1   45.55  ? 777  LEU   A CB   1 1 
ATOM   1139 C  CG   . LEU   A 1 87  ? 5.9     6.975   -5.206  1   47.32  ? 777  LEU   A CG   1 1 
ATOM   1140 C  CD1  . LEU   A 1 87  ? 4.646   7.815   -4.99   1   48.05  ? 777  LEU   A CD1  1 1 
ATOM   1141 C  CD2  . LEU   A 1 87  ? 5.48    5.556   -5.343  1   48.28  ? 777  LEU   A CD2  1 1 
ATOM   1142 H  H    . LEU   A 1 87  ? 8.305   8.115   -8.142  0   46.63  ? 777  LEU   A H    1 1 
ATOM   1143 H  HA   . LEU   A 1 87  ? 6.651   9.558   -6.267  0   46.62  ? 777  LEU   A HA   1 1 
ATOM   1144 H  HB2  . LEU   A 1 87  ? 5.954   7.448   -7.274  0   47.21  ? 777  LEU   A HB2  1 1 
ATOM   1145 H  HB3  . LEU   A 1 87  ? 7.415   6.648   -6.661  0   48.17  ? 777  LEU   A HB3  1 1 
ATOM   1146 H  HG   . LEU   A 1 87  ? 6.524   7.043   -4.316  0   50.1   ? 777  LEU   A HG   1 1 
ATOM   1147 H  HD11 . LEU   A 1 87  ? 4.123   7.442   -4.111  0   50.17  ? 777  LEU   A HD11 1 1 
ATOM   1148 H  HD12 . LEU   A 1 87  ? 4.917   8.857   -4.83   0   49.58  ? 777  LEU   A HD12 1 1 
ATOM   1149 H  HD13 . LEU   A 1 87  ? 4.005   7.725   -5.866  0   49.53  ? 777  LEU   A HD13 1 1 
ATOM   1150 H  HD21 . LEU   A 1 87  ? 4.88    5.274   -4.48   0   51.51  ? 777  LEU   A HD21 1 1 
ATOM   1151 H  HD22 . LEU   A 1 87  ? 4.894   5.463   -6.256  0   50.9   ? 777  LEU   A HD22 1 1 
ATOM   1152 H  HD23 . LEU   A 1 87  ? 6.367   4.928   -5.406  0   51.75  ? 777  LEU   A HD23 1 1 
ATOM   1153 N  N    . LEU   A 1 88  ? 8.228   9.738   -4.294  1   46.02  ? 778  LEU   A N    1 1 
ATOM   1154 C  CA   . LEU   A 1 88  ? 9.099   9.777   -3.115  1   46.8   ? 778  LEU   A CA   1 1 
ATOM   1155 C  C    . LEU   A 1 88  ? 8.677   8.653   -2.166  1   47.68  ? 778  LEU   A C    1 1 
ATOM   1156 O  O    . LEU   A 1 88  ? 9.529   7.908   -1.681  1   48.11  ? 778  LEU   A O    1 1 
ATOM   1157 C  CB   . LEU   A 1 88  ? 9.037   11.14   -2.39   1   46.81  ? 778  LEU   A CB   1 1 
ATOM   1158 C  CG   . LEU   A 1 88  ? 9.623   12.354  -3.118  1   48.04  ? 778  LEU   A CG   1 1 
ATOM   1159 C  CD1  . LEU   A 1 88  ? 9.217   13.631  -2.424  1   48.67  ? 778  LEU   A CD1  1 1 
ATOM   1160 C  CD2  . LEU   A 1 88  ? 11.151  12.303  -3.191  1   48.5   ? 778  LEU   A CD2  1 1 
ATOM   1161 H  H    . LEU   A 1 88  ? 7.531   10.475  -4.329  0   48.03  ? 778  LEU   A H    1 1 
ATOM   1162 H  HA   . LEU   A 1 88  ? 10.128  9.581   -3.412  0   50.48  ? 778  LEU   A HA   1 1 
ATOM   1163 H  HB2  . LEU   A 1 88  ? 7.99    11.353  -2.178  0   49.5   ? 778  LEU   A HB2  1 1 
ATOM   1164 H  HB3  . LEU   A 1 88  ? 9.578   11.042  -1.45   0   50.51  ? 778  LEU   A HB3  1 1 
ATOM   1165 H  HG   . LEU   A 1 88  ? 9.24    12.384  -4.137  0   50.54  ? 778  LEU   A HG   1 1 
ATOM   1166 H  HD11 . LEU   A 1 88  ? 9.646   14.476  -2.959  0   51.63  ? 778  LEU   A HD11 1 1 
ATOM   1167 H  HD12 . LEU   A 1 88  ? 8.131   13.706  -2.426  0   51.09  ? 778  LEU   A HD12 1 1 
ATOM   1168 H  HD13 . LEU   A 1 88  ? 9.587   13.613  -1.4    0   52.13  ? 778  LEU   A HD13 1 1 
ATOM   1169 H  HD21 . LEU   A 1 88  ? 11.505  13.205  -3.689  0   52.36  ? 778  LEU   A HD21 1 1 
ATOM   1170 H  HD22 . LEU   A 1 88  ? 11.555  12.26   -2.18   0   52.94  ? 778  LEU   A HD22 1 1 
ATOM   1171 H  HD23 . LEU   A 1 88  ? 11.477  11.433  -3.758  0   52.5   ? 778  LEU   A HD23 1 1 
ATOM   1172 N  N    . GLY   A 1 89  ? 7.371   8.524   -1.941  1   47.81  ? 779  GLY   A N    1 1 
ATOM   1173 C  CA   . GLY   A 1 89  ? 6.806   7.485   -1.096  1   48.51  ? 779  GLY   A CA   1 1 
ATOM   1174 C  C    . GLY   A 1 89  ? 5.302   7.622   -0.953  1   49.17  ? 779  GLY   A C    1 1 
ATOM   1175 O  O    . GLY   A 1 89  ? 4.667   8.408   -1.661  1   49.36  ? 779  GLY   A O    1 1 
ATOM   1176 H  H    . GLY   A 1 89  ? 6.664   9.146   -2.32   0   50.48  ? 779  GLY   A H    1 1 
ATOM   1177 H  HA2  . GLY   A 1 89  ? 7.027   6.507   -1.521  0   52.56  ? 779  GLY   A HA2  1 1 
ATOM   1178 H  HA3  . GLY   A 1 89  ? 7.256   7.535   -0.105  0   52.68  ? 779  GLY   A HA3  1 1 
ATOM   1179 N  N    . ILE   A 1 90  ? 4.719   6.835   -0.047  1   49.29  ? 780  ILE   A N    1 1 
ATOM   1180 C  CA   . ILE   A 1 90  ? 3.284   6.86    0.231   1   49.93  ? 780  ILE   A CA   1 1 
ATOM   1181 C  C    . ILE   A 1 90  ? 3.041   7.131   1.717   1   50.51  ? 780  ILE   A C    1 1 
ATOM   1182 O  O    . ILE   A 1 90  ? 3.924   6.91    2.547   1   50.79  ? 780  ILE   A O    1 1 
ATOM   1183 C  CB   . ILE   A 1 90  ? 2.522   5.598   -0.289  1   50.58  ? 780  ILE   A CB   1 1 
ATOM   1184 C  CG1  . ILE   A 1 90  ? 2.945   4.293   0.434   1   51.49  ? 780  ILE   A CG1  1 1 
ATOM   1185 C  CG2  . ILE   A 1 90  ? 2.691   5.46    -1.809  1   51.26  ? 780  ILE   A CG2  1 1 
ATOM   1186 C  CD1  . ILE   A 1 90  ? 1.858   3.18    0.465   1   52.61  ? 780  ILE   A CD1  1 1 
ATOM   1187 H  H    . ILE   A 1 90  ? 5.236   6.177   0.527   0   53.68  ? 780  ILE   A H    1 1 
ATOM   1188 H  HA   . ILE   A 1 90  ? 2.839   7.706   -0.29   0   52.99  ? 780  ILE   A HA   1 1 
ATOM   1189 H  HB   . ILE   A 1 90  ? 1.462   5.761   -0.097  0   54.57  ? 780  ILE   A HB   1 1 
ATOM   1190 H  HG12 . ILE   A 1 90  ? 3.817   3.879   -0.069  0   56.66  ? 780  ILE   A HG12 1 1 
ATOM   1191 H  HG13 . ILE   A 1 90  ? 3.2     4.505   1.471   0   56.74  ? 780  ILE   A HG13 1 1 
ATOM   1192 H  HG21 . ILE   A 1 90  ? 2.111   4.61    -2.164  0   55.23  ? 780  ILE   A HG21 1 1 
ATOM   1193 H  HG22 . ILE   A 1 90  ? 2.337   6.374   -2.284  0   54.24  ? 780  ILE   A HG22 1 1 
ATOM   1194 H  HG23 . ILE   A 1 90  ? 3.744   5.308   -2.043  0   54.95  ? 780  ILE   A HG23 1 1 
ATOM   1195 H  HD11 . ILE   A 1 90  ? 2.256   2.318   0.999   0   59.07  ? 780  ILE   A HD11 1 1 
ATOM   1196 H  HD12 . ILE   A 1 90  ? 0.978   3.56    0.982   0   58.25  ? 780  ILE   A HD12 1 1 
ATOM   1197 H  HD13 . ILE   A 1 90  ? 1.598   2.895   -0.553  0   58.14  ? 780  ILE   A HD13 1 1 
ATOM   1198 N  N    . CYS   A 1 91  ? 1.852   7.64    2.042   1   50.54  ? 781  CYS   A N    1 1 
ATOM   1199 C  CA   . CYS   A 1 91  ? 1.471   7.957   3.414   1   51.16  ? 781  CYS   A CA   1 1 
ATOM   1200 C  C    . CYS   A 1 91  ? 0.101   7.343   3.706   1   51.49  ? 781  CYS   A C    1 1 
ATOM   1201 O  O    . CYS   A 1 91  ? -0.793  7.408   2.862   1   51.57  ? 781  CYS   A O    1 1 
ATOM   1202 C  CB   . CYS   A 1 91  ? 1.467   9.468   3.626   1   52.04  ? 781  CYS   A CB   1 1 
ATOM   1203 S  SG   . CYS   A 1 91  ? 1.282   9.973   5.351   1   55.69  ? 781  CYS   A SG   1 1 
ATOM   1204 H  H    . CYS   A 1 91  ? 1.123   7.846   1.367   0   54.07  ? 781  CYS   A H    1 1 
ATOM   1205 H  HA   . CYS   A 1 91  ? 2.185   7.524   4.112   0   55.88  ? 781  CYS   A HA   1 1 
ATOM   1206 H  HB2  . CYS   A 1 91  ? 2.41    9.872   3.262   0   55.63  ? 781  CYS   A HB2  1 1 
ATOM   1207 H  HB3  . CYS   A 1 91  ? 0.644   9.907   3.067   0   55.51  ? 781  CYS   A HB3  1 1 
ATOM   1208 H  HG   . CYS   A 1 91  ? 2.467   9.87    5.968   0   60.37  ? 781  CYS   A HG   1 1 
ATOM   1209 N  N    . LEU   A 1 92  ? -0.061  6.745   4.896   1   51.57  ? 782  LEU   A N    1 1 
ATOM   1210 C  CA   . LEU   A 1 92  ? -1.304  6.083   5.293   1   52.13  ? 782  LEU   A CA   1 1 
ATOM   1211 C  C    . LEU   A 1 92  ? -2.034  6.885   6.384   1   52.73  ? 782  LEU   A C    1 1 
ATOM   1212 O  O    . LEU   A 1 92  ? -1.848  6.636   7.574   1   52.72  ? 782  LEU   A O    1 1 
ATOM   1213 C  CB   . LEU   A 1 92  ? -0.998  4.649   5.763   1   52.15  ? 782  LEU   A CB   1 1 
ATOM   1214 C  CG   . LEU   A 1 92  ? -0.153  3.765   4.816   1   53.43  ? 782  LEU   A CG   1 1 
ATOM   1215 C  CD1  . LEU   A 1 92  ? 0.423   2.584   5.559   1   53.98  ? 782  LEU   A CD1  1 1 
ATOM   1216 C  CD2  . LEU   A 1 92  ? -0.972  3.264   3.63    1   53.95  ? 782  LEU   A CD2  1 1 
ATOM   1217 H  H    . LEU   A 1 92  ? 0.658   6.705   5.611   0   57.26  ? 782  LEU   A H    1 1 
ATOM   1218 H  HA   . LEU   A 1 92  ? -1.987  6.009   4.448   0   58.02  ? 782  LEU   A HA   1 1 
ATOM   1219 H  HB2  . LEU   A 1 92  ? -0.48   4.701   6.72    0   59.43  ? 782  LEU   A HB2  1 1 
ATOM   1220 H  HB3  . LEU   A 1 92  ? -1.946  4.131   5.889   0   59.72  ? 782  LEU   A HB3  1 1 
ATOM   1221 H  HG   . LEU   A 1 92  ? 0.688   4.33    4.419   0   59.86  ? 782  LEU   A HG   1 1 
ATOM   1222 H  HD11 . LEU   A 1 92  ? 1.015   1.98    4.873   0   62.13  ? 782  LEU   A HD11 1 1 
ATOM   1223 H  HD12 . LEU   A 1 92  ? 1.049   2.96    6.367   0   62.06  ? 782  LEU   A HD12 1 1 
ATOM   1224 H  HD13 . LEU   A 1 92  ? -0.395  1.995   5.97    0   62.71  ? 782  LEU   A HD13 1 1 
ATOM   1225 H  HD21 . LEU   A 1 92  ? -0.342  2.635   3.003   0   61.05  ? 782  LEU   A HD21 1 1 
ATOM   1226 H  HD22 . LEU   A 1 92  ? -1.814  2.685   4.005   0   61.67  ? 782  LEU   A HD22 1 1 
ATOM   1227 H  HD23 . LEU   A 1 92  ? -1.336  4.11    3.049   0   60.27  ? 782  LEU   A HD23 1 1 
ATOM   1228 N  N    . THR   A 1 93  ? -2.866  7.849   5.954   1   53.05  ? 783  THR   A N    1 1 
ATOM   1229 C  CA   . THR   A 1 93  ? -3.655  8.738   6.817   1   53.78  ? 783  THR   A CA   1 1 
ATOM   1230 C  C    . THR   A 1 93  ? -5.069  8.07    6.91    1   54.29  ? 783  THR   A C    1 1 
ATOM   1231 O  O    . THR   A 1 93  ? -5.109  6.917   7.316   1   54.75  ? 783  THR   A O    1 1 
ATOM   1232 C  CB   . THR   A 1 93  ? -3.54   10.171  6.237   1   55.05  ? 783  THR   A CB   1 1 
ATOM   1233 O  OG1  . THR   A 1 93  ? -4.097  10.151  4.914   1   56.05  ? 783  THR   A OG1  1 1 
ATOM   1234 C  CG2  . THR   A 1 93  ? -2.103  10.677  6.222   1   55.36  ? 783  THR   A CG2  1 1 
ATOM   1235 H  H    . THR   A 1 93  ? -3.025  8.037   4.969   0   58.47  ? 783  THR   A H    1 1 
ATOM   1236 H  HA   . THR   A 1 93  ? -3.224  8.759   7.817   0   60.2   ? 783  THR   A HA   1 1 
ATOM   1237 H  HB   . THR   A 1 93  ? -4.124  10.85   6.855   0   60.63  ? 783  THR   A HB   1 1 
ATOM   1238 H  HG1  . THR   A 1 93  ? -3.838  10.948  4.38    0   60.54  ? 783  THR   A HG1  1 1 
ATOM   1239 H  HG21 . THR   A 1 93  ? -2.071  11.697  5.842   0   59.81  ? 783  THR   A HG21 1 1 
ATOM   1240 H  HG22 . THR   A 1 93  ? -1.694  10.659  7.231   0   60.6   ? 783  THR   A HG22 1 1 
ATOM   1241 H  HG23 . THR   A 1 93  ? -1.489  10.047  5.581   0   60.04  ? 783  THR   A HG23 1 1 
ATOM   1242 N  N    . SER   A 1 94  ? -6.204  8.729   6.571   1   54.18  ? 784  SER   A N    1 1 
ATOM   1243 C  CA   . SER   A 1 94  ? -7.503  8.057   6.511   1   54.45  ? 784  SER   A CA   1 1 
ATOM   1244 C  C    . SER   A 1 94  ? -7.598  7.271   5.169   1   54.39  ? 784  SER   A C    1 1 
ATOM   1245 O  O    . SER   A 1 94  ? -8.266  6.24    5.116   1   54.64  ? 784  SER   A O    1 1 
ATOM   1246 C  CB   . SER   A 1 94  ? -8.638  9.067   6.623   1   55.8   ? 784  SER   A CB   1 1 
ATOM   1247 O  OG   . SER   A 1 94  ? -8.509  10.092  5.654   1   58.11  ? 784  SER   A OG   1 1 
ATOM   1248 H  H    . SER   A 1 94  ? -6.272  9.718   6.353   0   60.69  ? 784  SER   A H    1 1 
ATOM   1249 H  HA   . SER   A 1 94  ? -7.606  7.352   7.335   0   63.02  ? 784  SER   A HA   1 1 
ATOM   1250 H  HB2  . SER   A 1 94  ? -9.586  8.553   6.476   0   64.65  ? 784  SER   A HB2  1 1 
ATOM   1251 H  HB3  . SER   A 1 94  ? -8.612  9.515   7.615   0   64.19  ? 784  SER   A HB3  1 1 
ATOM   1252 H  HG   . SER   A 1 94  ? -9.264  10.732  5.739   0   65.64  ? 784  SER   A HG   1 1 
ATOM   1253 N  N    . THR   A 1 95  ? -6.931  7.773   4.096   1   53.88  ? 785  THR   A N    1 1 
ATOM   1254 C  CA   . THR   A 1 95  ? -6.824  7.156   2.77    1   53.72  ? 785  THR   A CA   1 1 
ATOM   1255 C  C    . THR   A 1 95  ? -5.315  6.921   2.446   1   52.76  ? 785  THR   A C    1 1 
ATOM   1256 O  O    . THR   A 1 95  ? -4.447  7.373   3.196   1   53.07  ? 785  THR   A O    1 1 
ATOM   1257 C  CB   . THR   A 1 95  ? -7.451  8.104   1.73    1   55.52  ? 785  THR   A CB   1 1 
ATOM   1258 O  OG1  . THR   A 1 95  ? -6.733  9.341   1.754   1   56.63  ? 785  THR   A OG1  1 1 
ATOM   1259 C  CG2  . THR   A 1 95  ? -8.944  8.343   1.966   1   56.24  ? 785  THR   A CG2  1 1 
ATOM   1260 H  H    . THR   A 1 95  ? -6.45   8.666   4.111   0   59.94  ? 785  THR   A H    1 1 
ATOM   1261 H  HA   . THR   A 1 95  ? -7.344  6.2     2.736   0   60.83  ? 785  THR   A HA   1 1 
ATOM   1262 H  HB   . THR   A 1 95  ? -7.338  7.658   0.744   0   61.16  ? 785  THR   A HB   1 1 
ATOM   1263 H  HG1  . THR   A 1 95  ? -6.963  9.88    0.953   0   61.23  ? 785  THR   A HG1  1 1 
ATOM   1264 H  HG21 . THR   A 1 95  ? -9.337  9.01    1.2     0   62.56  ? 785  THR   A HG21 1 1 
ATOM   1265 H  HG22 . THR   A 1 95  ? -9.481  7.397   1.918   0   63.65  ? 785  THR   A HG22 1 1 
ATOM   1266 H  HG23 . THR   A 1 95  ? -9.113  8.796   2.942   0   63.19  ? 785  THR   A HG23 1 1 
ATOM   1267 N  N    . VAL   A 1 96  ? -5.002  6.228   1.332   1   51.35  ? 786  VAL   A N    1 1 
ATOM   1268 C  CA   . VAL   A 1 96  ? -3.619  6.01    0.903   1   50.39  ? 786  VAL   A CA   1 1 
ATOM   1269 C  C    . VAL   A 1 96  ? -3.255  7.228   0.036   1   49.31  ? 786  VAL   A C    1 1 
ATOM   1270 O  O    . VAL   A 1 96  ? -3.983  7.543   -0.903  1   49.36  ? 786  VAL   A O    1 1 
ATOM   1271 C  CB   . VAL   A 1 96  ? -3.453  4.683   0.115   1   51.02  ? 786  VAL   A CB   1 1 
ATOM   1272 C  CG1  . VAL   A 1 96  ? -1.997  4.462   -0.296  1   51.33  ? 786  VAL   A CG1  1 1 
ATOM   1273 C  CG2  . VAL   A 1 96  ? -3.961  3.487   0.922   1   51.49  ? 786  VAL   A CG2  1 1 
ATOM   1274 H  H    . VAL   A 1 96  ? -5.692  5.831   0.702   0   57.14  ? 786  VAL   A H    1 1 
ATOM   1275 H  HA   . VAL   A 1 96  ? -2.954  5.968   1.765   0   55.54  ? 786  VAL   A HA   1 1 
ATOM   1276 H  HB   . VAL   A 1 96  ? -4.048  4.742   -0.796  0   56.27  ? 786  VAL   A HB   1 1 
ATOM   1277 H  HG11 . VAL   A 1 96  ? -1.926  3.51    -0.819  0   56.76  ? 786  VAL   A HG11 1 1 
ATOM   1278 H  HG12 . VAL   A 1 96  ? -1.662  5.262   -0.954  0   55.59  ? 786  VAL   A HG12 1 1 
ATOM   1279 H  HG13 . VAL   A 1 96  ? -1.38   4.434   0.601   0   56.57  ? 786  VAL   A HG13 1 1 
ATOM   1280 H  HG21 . VAL   A 1 96  ? -3.802  2.581   0.338   0   58.52  ? 786  VAL   A HG21 1 1 
ATOM   1281 H  HG22 . VAL   A 1 96  ? -3.401  3.426   1.854   0   58.32  ? 786  VAL   A HG22 1 1 
ATOM   1282 H  HG23 . VAL   A 1 96  ? -5.023  3.602   1.13    0   58.5   ? 786  VAL   A HG23 1 1 
ATOM   1283 N  N    . GLN   A 1 97  ? -2.147  7.914   0.349   1   48.31  ? 787  GLN   A N    1 1 
ATOM   1284 C  CA   . GLN   A 1 97  ? -1.727  9.102   -0.391  1   47.87  ? 787  GLN   A CA   1 1 
ATOM   1285 C  C    . GLN   A 1 97  ? -0.399  8.89    -1.102  1   47.38  ? 787  GLN   A C    1 1 
ATOM   1286 O  O    . GLN   A 1 97  ? 0.472   8.217   -0.56   1   47.81  ? 787  GLN   A O    1 1 
ATOM   1287 C  CB   . GLN   A 1 97  ? -1.544  10.278  0.567   1   49.15  ? 787  GLN   A CB   1 1 
ATOM   1288 C  CG   . GLN   A 1 97  ? -2.756  10.635  1.419   1   51.82  ? 787  GLN   A CG   1 1 
ATOM   1289 C  CD   . GLN   A 1 97  ? -2.434  11.782  2.352   1   55.52  ? 787  GLN   A CD   1 1 
ATOM   1290 O  OE1  . GLN   A 1 97  ? -1.327  11.886  2.894   1   56.57  ? 787  GLN   A OE1  1 1 
ATOM   1291 N  NE2  . GLN   A 1 97  ? -3.386  12.675  2.573   1   55.95  ? 787  GLN   A NE2  1 1 
ATOM   1292 H  H    . GLN   A 1 97  ? -1.52   7.671   1.109   0   52.07  ? 787  GLN   A H    1 1 
ATOM   1293 H  HA   . GLN   A 1 97  ? -2.477  9.389   -1.127  0   50.39  ? 787  GLN   A HA   1 1 
ATOM   1294 H  HB2  . GLN   A 1 97  ? -0.714  10.034  1.227   0   51.98  ? 787  GLN   A HB2  1 1 
ATOM   1295 H  HB3  . GLN   A 1 97  ? -1.294  11.153  -0.029  0   51.3   ? 787  GLN   A HB3  1 1 
ATOM   1296 H  HG2  . GLN   A 1 97  ? -3.573  10.929  0.762   0   54.77  ? 787  GLN   A HG2  1 1 
ATOM   1297 H  HG3  . GLN   A 1 97  ? -3.056  9.783   2.027   0   55.44  ? 787  GLN   A HG3  1 1 
ATOM   1298 H  HE21 . GLN   A 1 97  ? -4.298  12.588  2.137   0   59.26  ? 787  GLN   A HE21 1 1 
ATOM   1299 H  HE22 . GLN   A 1 97  ? -3.194  13.456  3.192   0   59.28  ? 787  GLN   A HE22 1 1 
ATOM   1300 N  N    . LEU   A 1 98  ? -0.217  9.516   -2.281  1   46.46  ? 788  LEU   A N    1 1 
ATOM   1301 C  CA   . LEU   A 1 98  ? 1.052   9.47    -3.021  1   46.01  ? 788  LEU   A CA   1 1 
ATOM   1302 C  C    . LEU   A 1 98  ? 1.808   10.76   -2.748  1   45.32  ? 788  LEU   A C    1 1 
ATOM   1303 O  O    . LEU   A 1 98  ? 1.196   11.818  -2.627  1   45.4   ? 788  LEU   A O    1 1 
ATOM   1304 C  CB   . LEU   A 1 98  ? 0.849   9.325   -4.54   1   46.08  ? 788  LEU   A CB   1 1 
ATOM   1305 C  CG   . LEU   A 1 98  ? -0.02   8.187   -5.051  1   47.5   ? 788  LEU   A CG   1 1 
ATOM   1306 C  CD1  . LEU   A 1 98  ? -0.051  8.205   -6.552  1   47.99  ? 788  LEU   A CD1  1 1 
ATOM   1307 C  CD2  . LEU   A 1 98  ? 0.483   6.819   -4.587  1   48.16  ? 788  LEU   A CD2  1 1 
ATOM   1308 H  H    . LEU   A 1 98  ? -0.931  10.069  -2.745  0   47.92  ? 788  LEU   A H    1 1 
ATOM   1309 H  HA   . LEU   A 1 98  ? 1.671   8.646   -2.671  0   47.87  ? 788  LEU   A HA   1 1 
ATOM   1310 H  HB2  . LEU   A 1 98  ? 0.404   10.249  -4.907  0   46.71  ? 788  LEU   A HB2  1 1 
ATOM   1311 H  HB3  . LEU   A 1 98  ? 1.83    9.198   -4.994  0   47.02  ? 788  LEU   A HB3  1 1 
ATOM   1312 H  HG   . LEU   A 1 98  ? -1.039  8.322   -4.69   0   49     ? 788  LEU   A HG   1 1 
ATOM   1313 H  HD11 . LEU   A 1 98  ? -0.675  7.386   -6.905  0   49.22  ? 788  LEU   A HD11 1 1 
ATOM   1314 H  HD12 . LEU   A 1 98  ? -0.465  9.156   -6.884  0   48.47  ? 788  LEU   A HD12 1 1 
ATOM   1315 H  HD13 . LEU   A 1 98  ? 0.964   8.089   -6.928  0   48.8   ? 788  LEU   A HD13 1 1 
ATOM   1316 H  HD21 . LEU   A 1 98  ? -0.118  6.043   -5.059  0   50.55  ? 788  LEU   A HD21 1 1 
ATOM   1317 H  HD22 . LEU   A 1 98  ? 1.526   6.704   -4.877  0   50.18  ? 788  LEU   A HD22 1 1 
ATOM   1318 H  HD23 . LEU   A 1 98  ? 0.382   6.733   -3.506  0   50.56  ? 788  LEU   A HD23 1 1 
ATOM   1319 N  N    . ILE   A 1 99  ? 3.134   10.674  -2.649  1   44.55  ? 789  ILE   A N    1 1 
ATOM   1320 C  CA   . ILE   A 1 99  ? 3.986   11.821  -2.362  1   44.32  ? 789  ILE   A CA   1 1 
ATOM   1321 C  C    . ILE   A 1 99  ? 5.032   11.937  -3.478  1   43.69  ? 789  ILE   A C    1 1 
ATOM   1322 O  O    . ILE   A 1 99  ? 5.65    10.937  -3.84   1   43.94  ? 789  ILE   A O    1 1 
ATOM   1323 C  CB   . ILE   A 1 99  ? 4.689   11.661  -0.969  1   45.04  ? 789  ILE   A CB   1 1 
ATOM   1324 C  CG1  . ILE   A 1 99  ? 3.72    11.118  0.15    1   46.07  ? 789  ILE   A CG1  1 1 
ATOM   1325 C  CG2  . ILE   A 1 99  ? 5.382   12.985  -0.552  1   45.49  ? 789  ILE   A CG2  1 1 
ATOM   1326 C  CD1  . ILE   A 1 99  ? 2.559   12.017  0.581   1   47.31  ? 789  ILE   A CD1  1 1 
ATOM   1327 H  H    . ILE   A 1 99  ? 3.657   9.812   -2.771  0   46.17  ? 789  ILE   A H    1 1 
ATOM   1328 H  HA   . ILE   A 1 99  ? 3.396   12.736  -2.345  0   45.43  ? 789  ILE   A HA   1 1 
ATOM   1329 H  HB   . ILE   A 1 99  ? 5.474   10.915  -1.08   0   47.31  ? 789  ILE   A HB   1 1 
ATOM   1330 H  HG12 . ILE   A 1 99  ? 3.287   10.172  -0.171  0   48.39  ? 789  ILE   A HG12 1 1 
ATOM   1331 H  HG13 . ILE   A 1 99  ? 4.305   10.925  1.047   0   48.82  ? 789  ILE   A HG13 1 1 
ATOM   1332 H  HG21 . ILE   A 1 99  ? 5.821   12.878  0.438   0   48.1   ? 789  ILE   A HG21 1 1 
ATOM   1333 H  HG22 . ILE   A 1 99  ? 6.167   13.222  -1.269  0   47.55  ? 789  ILE   A HG22 1 1 
ATOM   1334 H  HG23 . ILE   A 1 99  ? 4.652   13.794  -0.544  0   47.38  ? 789  ILE   A HG23 1 1 
ATOM   1335 H  HD11 . ILE   A 1 99  ? 1.965   11.485  1.323   0   49.75  ? 789  ILE   A HD11 1 1 
ATOM   1336 H  HD12 . ILE   A 1 99  ? 2.967   12.919  1.033   0   49.48  ? 789  ILE   A HD12 1 1 
ATOM   1337 H  HD13 . ILE   A 1 99  ? 1.94    12.264  -0.28   0   49.03  ? 789  ILE   A HD13 1 1 
ATOM   1338 N  N    . THR   A 1 100 ? 5.233   13.149  -4.008  1   42.69  ? 790  THR   A N    1 1 
ATOM   1339 C  CA   . THR   A 1 100 ? 6.253   13.433  -5.022  1   42.47  ? 790  THR   A CA   1 1 
ATOM   1340 C  C    . THR   A 1 100 ? 6.844   14.831  -4.777  1   42.5   ? 790  THR   A C    1 1 
ATOM   1341 O  O    . THR   A 1 100 ? 6.288   15.609  -3.999  1   42.71  ? 790  THR   A O    1 1 
ATOM   1342 C  CB   . THR   A 1 100 ? 5.679   13.312  -6.458  1   42.93  ? 790  THR   A CB   1 1 
ATOM   1343 O  OG1  . THR   A 1 100 ? 6.763   13.376  -7.398  1   43.21  ? 790  THR   A OG1  1 1 
ATOM   1344 C  CG2  . THR   A 1 100 ? 4.679   14.421  -6.79   1   43.09  ? 790  THR   A CG2  1 1 
ATOM   1345 H  H    . THR   A 1 100 ? 4.703   13.972  -3.741  0   43.49  ? 790  THR   A H    1 1 
ATOM   1346 H  HA   . THR   A 1 100 ? 7.068   12.719  -4.918  0   43.74  ? 790  THR   A HA   1 1 
ATOM   1347 H  HB   . THR   A 1 100 ? 5.168   12.356  -6.556  0   43.18  ? 790  THR   A HB   1 1 
ATOM   1348 H  HG1  . THR   A 1 100 ? 7.47    12.711  -7.187  0   44.02  ? 790  THR   A HG1  1 1 
ATOM   1349 H  HG21 . THR   A 1 100 ? 4.298   14.275  -7.799  0   42.59  ? 790  THR   A HG21 1 1 
ATOM   1350 H  HG22 . THR   A 1 100 ? 3.843   14.369  -6.095  0   42.97  ? 790  THR   A HG22 1 1 
ATOM   1351 H  HG23 . THR   A 1 100 ? 5.137   15.408  -6.737  0   43.09  ? 790  THR   A HG23 1 1 
ATOM   1352 N  N    . GLN   A 1 101 ? 7.96    15.167  -5.45   1   42.03  ? 791  GLN   A N    1 1 
ATOM   1353 C  CA   . GLN   A 1 101 ? 8.549   16.493  -5.335  1   42.34  ? 791  GLN   A CA   1 1 
ATOM   1354 C  C    . GLN   A 1 101 ? 7.557   17.488  -5.98   1   41.72  ? 791  GLN   A C    1 1 
ATOM   1355 O  O    . GLN   A 1 101 ? 7.001   17.202  -7.042  1   41.82  ? 791  GLN   A O    1 1 
ATOM   1356 C  CB   . GLN   A 1 101 ? 9.92    16.534  -6.04   1   44.92  ? 791  GLN   A CB   1 1 
ATOM   1357 C  CG   . GLN   A 1 101 ? 10.767  17.754  -5.689  1   49.75  ? 791  GLN   A CG   1 1 
ATOM   1358 C  CD   . GLN   A 1 101 ? 12.036  17.802  -6.51   1   55.84  ? 791  GLN   A CD   1 1 
ATOM   1359 O  OE1  . GLN   A 1 101 ? 12.001  17.788  -7.748  1   57.48  ? 791  GLN   A OE1  1 1 
ATOM   1360 N  NE2  . GLN   A 1 101 ? 13.194  17.869  -5.852  1   57.49  ? 791  GLN   A NE2  1 1 
ATOM   1361 H  H    . GLN   A 1 101 ? 8.464   14.543  -6.072  0   43.45  ? 791  GLN   A H    1 1 
ATOM   1362 H  HA   . GLN   A 1 101 ? 8.686   16.744  -4.284  0   44.55  ? 791  GLN   A HA   1 1 
ATOM   1363 H  HB2  . GLN   A 1 101 ? 10.492  15.652  -5.757  0   47.53  ? 791  GLN   A HB2  1 1 
ATOM   1364 H  HB3  . GLN   A 1 101 ? 9.754   16.538  -7.117  0   46.82  ? 791  GLN   A HB3  1 1 
ATOM   1365 H  HG2  . GLN   A 1 101 ? 10.2    18.66   -5.9    0   52.63  ? 791  GLN   A HG2  1 1 
ATOM   1366 H  HG3  . GLN   A 1 101 ? 11.017  17.714  -4.63   0   53.32  ? 791  GLN   A HG3  1 1 
ATOM   1367 H  HE21 . GLN   A 1 101 ? 13.216  17.894  -4.837  0   62.58  ? 791  GLN   A HE21 1 1 
ATOM   1368 H  HE22 . GLN   A 1 101 ? 14.065  17.904  -6.372  0   62.82  ? 791  GLN   A HE22 1 1 
ATOM   1369 N  N    . LEU   A 1 102 ? 7.249   18.577  -5.28   1   40.83  ? 792  LEU   A N    1 1 
ATOM   1370 C  CA   . LEU   A 1 102 ? 6.296   19.559  -5.774  1   40.61  ? 792  LEU   A CA   1 1 
ATOM   1371 C  C    . LEU   A 1 102 ? 6.858   20.244  -7.009  1   40.34  ? 792  LEU   A C    1 1 
ATOM   1372 O  O    . LEU   A 1 102 ? 8.028   20.619  -7.022  1   40.58  ? 792  LEU   A O    1 1 
ATOM   1373 C  CB   . LEU   A 1 102 ? 5.998   20.592  -4.671  1   40.67  ? 792  LEU   A CB   1 1 
ATOM   1374 C  CG   . LEU   A 1 102 ? 5.109   21.792  -5.006  1   42.01  ? 792  LEU   A CG   1 1 
ATOM   1375 C  CD1  . LEU   A 1 102 ? 3.663   21.388  -5.189  1   42.6   ? 792  LEU   A CD1  1 1 
ATOM   1376 C  CD2  . LEU   A 1 102 ? 5.186   22.836  -3.908  1   42.59  ? 792  LEU   A CD2  1 1 
ATOM   1377 H  H    . LEU   A 1 102 ? 7.638   18.801  -4.37   0   42.87  ? 792  LEU   A H    1 1 
ATOM   1378 H  HA   . LEU   A 1 102 ? 5.373   19.045  -6.036  0   41.32  ? 792  LEU   A HA   1 1 
ATOM   1379 H  HB2  . LEU   A 1 102 ? 5.53    20.067  -3.839  0   42.39  ? 792  LEU   A HB2  1 1 
ATOM   1380 H  HB3  . LEU   A 1 102 ? 6.956   20.993  -4.349  0   43.06  ? 792  LEU   A HB3  1 1 
ATOM   1381 H  HG   . LEU   A 1 102 ? 5.441   22.27   -5.927  0   43.77  ? 792  LEU   A HG   1 1 
ATOM   1382 H  HD11 . LEU   A 1 102 ? 3.096   22.289  -5.416  0   43.89  ? 792  LEU   A HD11 1 1 
ATOM   1383 H  HD12 . LEU   A 1 102 ? 3.571   20.682  -6.014  0   43.26  ? 792  LEU   A HD12 1 1 
ATOM   1384 H  HD13 . LEU   A 1 102 ? 3.297   20.939  -4.267  0   43.84  ? 792  LEU   A HD13 1 1 
ATOM   1385 H  HD21 . LEU   A 1 102 ? 4.544   23.675  -4.171  0   45.28  ? 792  LEU   A HD21 1 1 
ATOM   1386 H  HD22 . LEU   A 1 102 ? 4.855   22.395  -2.969  0   45.21  ? 792  LEU   A HD22 1 1 
ATOM   1387 H  HD23 . LEU   A 1 102 ? 6.217   23.173  -3.816  0   45.74  ? 792  LEU   A HD23 1 1 
ATOM   1388 N  N    . MET   A 1 103 ? 6.035   20.358  -8.053  1   39.65  ? 793  MET   A N    1 1 
ATOM   1389 C  CA   . MET   A 1 103 ? 6.385   21.044  -9.294  1   39.24  ? 793  MET   A CA   1 1 
ATOM   1390 C  C    . MET   A 1 103 ? 5.764   22.431  -9.082  1   38.34  ? 793  MET   A C    1 1 
ATOM   1391 O  O    . MET   A 1 103 ? 4.543   22.531  -9.107  1   38.28  ? 793  MET   A O    1 1 
ATOM   1392 C  CB   . MET   A 1 103 ? 5.798   20.295  -10.497 1   39.76  ? 793  MET   A CB   1 1 
ATOM   1393 C  CG   . MET   A 1 103 ? 6.343   18.873  -10.636 1   41.73  ? 793  MET   A CG   1 1 
ATOM   1394 S  SD   . MET   A 1 103 ? 8.067   18.8    -11.162 1   47.07  ? 793  MET   A SD   1 1 
ATOM   1395 C  CE   . MET   A 1 103 ? 8.879   18.252  -9.662  1   44.18  ? 793  MET   A CE   1 1 
ATOM   1396 H  H    . MET   A 1 103 ? 5.09    19.989  -8.063  0   39.91  ? 793  MET   A H    1 1 
ATOM   1397 H  HA   . MET   A 1 103 ? 7.463   21.088  -9.433  0   40.35  ? 793  MET   A HA   1 1 
ATOM   1398 H  HB2  . MET   A 1 103 ? 4.717   20.22   -10.386 0   39.35  ? 793  MET   A HB2  1 1 
ATOM   1399 H  HB3  . MET   A 1 103 ? 6.043   20.838  -11.409 0   39.71  ? 793  MET   A HB3  1 1 
ATOM   1400 H  HG2  . MET   A 1 103 ? 6.252   18.336  -9.693  0   41.57  ? 793  MET   A HG2  1 1 
ATOM   1401 H  HG3  . MET   A 1 103 ? 5.761   18.362  -11.401 0   40.97  ? 793  MET   A HG3  1 1 
ATOM   1402 H  HE1  . MET   A 1 103 ? 9.948   18.16   -9.853  0   45.72  ? 793  MET   A HE1  1 1 
ATOM   1403 H  HE2  . MET   A 1 103 ? 8.702   18.985  -8.876  0   45.46  ? 793  MET   A HE2  1 1 
ATOM   1404 H  HE3  . MET   A 1 103 ? 8.467   17.287  -9.37   0   44.9   ? 793  MET   A HE3  1 1 
ATOM   1405 N  N    . PRO   A 1 104 ? 6.55    23.461  -8.678  1   37.55  ? 794  PRO   A N    1 1 
ATOM   1406 C  CA   . PRO   A 1 104 ? 5.938   24.746  -8.29   1   37.1   ? 794  PRO   A CA   1 1 
ATOM   1407 C  C    . PRO   A 1 104 ? 5.074   25.466  -9.31   1   36.9   ? 794  PRO   A C    1 1 
ATOM   1408 O  O    . PRO   A 1 104 ? 4.131   26.144  -8.921  1   37.38  ? 794  PRO   A O    1 1 
ATOM   1409 C  CB   . PRO   A 1 104 ? 7.141   25.614  -7.93   1   37.65  ? 794  PRO   A CB   1 1 
ATOM   1410 C  CG   . PRO   A 1 104 ? 8.218   24.686  -7.646  1   38.06  ? 794  PRO   A CG   1 1 
ATOM   1411 C  CD   . PRO   A 1 104 ? 8.014   23.5    -8.497  1   36.53  ? 794  PRO   A CD   1 1 
ATOM   1412 H  HA   . PRO   A 1 104 ? 5.348   24.607  -7.386  0   39.38  ? 794  PRO   A HA   1 1 
ATOM   1413 H  HB2  . PRO   A 1 104 ? 7.396   26.259  -8.769  0   41.47  ? 794  PRO   A HB2  1 1 
ATOM   1414 H  HB3  . PRO   A 1 104 ? 6.9     26.2    -7.044  0   41.73  ? 794  PRO   A HB3  1 1 
ATOM   1415 H  HG2  . PRO   A 1 104 ? 9.169   25.163  -7.876  0   42.41  ? 794  PRO   A HG2  1 1 
ATOM   1416 H  HG3  . PRO   A 1 104 ? 8.172   24.398  -6.597  0   41.84  ? 794  PRO   A HG3  1 1 
ATOM   1417 H  HD2  . PRO   A 1 104 ? 8.513   23.636  -9.454  0   39.23  ? 794  PRO   A HD2  1 1 
ATOM   1418 H  HD3  . PRO   A 1 104 ? 8.385   22.625  -7.966  0   39.08  ? 794  PRO   A HD3  1 1 
ATOM   1419 N  N    . PHE   A 1 105 ? 5.412   25.372  -10.594 1   36.11  ? 795  PHE   A N    1 1 
ATOM   1420 C  CA   . PHE   A 1 105 ? 4.647   26.046  -11.642 1   35.62  ? 795  PHE   A CA   1 1 
ATOM   1421 C  C    . PHE   A 1 105 ? 3.348   25.29   -12.053 1   35.5   ? 795  PHE   A C    1 1 
ATOM   1422 O  O    . PHE   A 1 105 ? 2.641   25.74   -12.955 1   35.54  ? 795  PHE   A O    1 1 
ATOM   1423 C  CB   . PHE   A 1 105 ? 5.567   26.325  -12.839 1   35.32  ? 795  PHE   A CB   1 1 
ATOM   1424 C  CG   . PHE   A 1 105 ? 6.657   27.334  -12.541 1   35.91  ? 795  PHE   A CG   1 1 
ATOM   1425 C  CD1  . PHE   A 1 105 ? 7.876   26.93   -12.026 1   36.67  ? 795  PHE   A CD1  1 1 
ATOM   1426 C  CD2  . PHE   A 1 105 ? 6.457   28.683  -12.766 1   36.7   ? 795  PHE   A CD2  1 1 
ATOM   1427 C  CE1  . PHE   A 1 105 ? 8.862   27.859  -11.722 1   37.5   ? 795  PHE   A CE1  1 1 
ATOM   1428 C  CE2  . PHE   A 1 105 ? 7.458   29.606  -12.494 1   37.33  ? 795  PHE   A CE2  1 1 
ATOM   1429 C  CZ   . PHE   A 1 105 ? 8.65    29.191  -11.963 1   37.21  ? 795  PHE   A CZ   1 1 
ATOM   1430 H  H    . PHE   A 1 105 ? 6.207   24.843  -10.94  0   37.95  ? 795  PHE   A H    1 1 
ATOM   1431 H  HA   . PHE   A 1 105 ? 4.322   27.016  -11.267 0   37.96  ? 795  PHE   A HA   1 1 
ATOM   1432 H  HB2  . PHE   A 1 105 ? 6.08    25.401  -13.095 0   36.83  ? 795  PHE   A HB2  1 1 
ATOM   1433 H  HB3  . PHE   A 1 105 ? 4.988   26.685  -13.689 0   37.08  ? 795  PHE   A HB3  1 1 
ATOM   1434 H  HD1  . PHE   A 1 105 ? 8.047   25.886  -11.822 0   39.74  ? 795  PHE   A HD1  1 1 
ATOM   1435 H  HD2  . PHE   A 1 105 ? 5.518   29.021  -13.167 0   40.39  ? 795  PHE   A HD2  1 1 
ATOM   1436 H  HE1  . PHE   A 1 105 ? 9.807   27.527  -11.326 0   42.81  ? 795  PHE   A HE1  1 1 
ATOM   1437 H  HE2  . PHE   A 1 105 ? 7.284   30.654  -12.671 0   43.28  ? 795  PHE   A HE2  1 1 
ATOM   1438 H  HZ   . PHE   A 1 105 ? 9.425   29.908  -11.75  0   44.01  ? 795  PHE   A HZ   1 1 
ATOM   1439 N  N    . GLY   A 1 106 ? 3.02    24.193  -11.369 1   35.02  ? 796  GLY   A N    1 1 
ATOM   1440 C  CA   . GLY   A 1 106 ? 1.78    23.467  -11.6   1   35.03  ? 796  GLY   A CA   1 1 
ATOM   1441 C  C    . GLY   A 1 106 ? 1.703   22.603  -12.842 1   34.86  ? 796  GLY   A C    1 1 
ATOM   1442 O  O    . GLY   A 1 106 ? 2.681   21.977  -13.252 1   34.93  ? 796  GLY   A O    1 1 
ATOM   1443 H  H    . GLY   A 1 106 ? 3.59    23.763  -10.648 0   35.55  ? 796  GLY   A H    1 1 
ATOM   1444 H  HA2  . GLY   A 1 106 ? 1.604   22.815  -10.745 0   34.74  ? 796  GLY   A HA2  1 1 
ATOM   1445 H  HA3  . GLY   A 1 106 ? 0.962   24.186  -11.631 0   35.02  ? 796  GLY   A HA3  1 1 
ATOM   1446 N  N    . CYS   A 1 107 ? 0.5     22.52   -13.399 1   34.69  ? 797  CYS   A N    1 1 
ATOM   1447 C  CA   . CYS   A 1 107 ? 0.203   21.727  -14.577 1   34.66  ? 797  CYS   A CA   1 1 
ATOM   1448 C  C    . CYS   A 1 107 ? 0.526   22.512  -15.834 1   33.52  ? 797  CYS   A C    1 1 
ATOM   1449 O  O    . CYS   A 1 107 ? 0.18    23.689  -15.926 1   33.63  ? 797  CYS   A O    1 1 
ATOM   1450 C  CB   . CYS   A 1 107 ? -1.258  21.287  -14.55  1   36.39  ? 797  CYS   A CB   1 1 
ATOM   1451 S  SG   . CYS   A 1 107 ? -1.806  20.454  -16.058 1   41.75  ? 797  CYS   A SG   1 1 
ATOM   1452 H  H    . CYS   A 1 107 ? -0.317  23.005  -13.041 0   33.76  ? 797  CYS   A H    1 1 
ATOM   1453 H  HA   . CYS   A 1 107 ? 0.819   20.831  -14.579 0   32.71  ? 797  CYS   A HA   1 1 
ATOM   1454 H  HB2  . CYS   A 1 107 ? -1.402  20.602  -13.717 0   34.57  ? 797  CYS   A HB2  1 1 
ATOM   1455 H  HB3  . CYS   A 1 107 ? -1.895  22.161  -14.418 0   34.89  ? 797  CYS   A HB3  1 1 
ATOM   1456 H  HG   . CYS   A 1 107 ? -0.742  20.045  -16.761 0   39.15  ? 797  CYS   A HG   1 1 
ATOM   1457 N  N    . LEU   A 1 108 ? 1.145   21.845  -16.822 1   32.28  ? 798  LEU   A N    1 1 
ATOM   1458 C  CA   . LEU   A 1 108 ? 1.506   22.467  -18.088 1   31.57  ? 798  LEU   A CA   1 1 
ATOM   1459 C  C    . LEU   A 1 108 ? 0.289   22.922  -18.888 1   31.02  ? 798  LEU   A C    1 1 
ATOM   1460 O  O    . LEU   A 1 108 ? 0.393   23.934  -19.576 1   30.85  ? 798  LEU   A O    1 1 
ATOM   1461 C  CB   . LEU   A 1 108 ? 2.405   21.549  -18.929 1   31.33  ? 798  LEU   A CB   1 1 
ATOM   1462 C  CG   . LEU   A 1 108 ? 2.889   22.068  -20.297 1   32.37  ? 798  LEU   A CG   1 1 
ATOM   1463 C  CD1  . LEU   A 1 108 ? 3.776   23.313  -20.172 1   33.13  ? 798  LEU   A CD1  1 1 
ATOM   1464 C  CD2  . LEU   A 1 108 ? 3.656   20.994  -21.023 1   32.84  ? 798  LEU   A CD2  1 1 
ATOM   1465 H  H    . LEU   A 1 108 ? 1.402   20.865  -16.774 0   29.95  ? 798  LEU   A H    1 1 
ATOM   1466 H  HA   . LEU   A 1 108 ? 2.079   23.358  -17.836 0   29.99  ? 798  LEU   A HA   1 1 
ATOM   1467 H  HB2  . LEU   A 1 108 ? 3.296   21.324  -18.344 0   29.17  ? 798  LEU   A HB2  1 1 
ATOM   1468 H  HB3  . LEU   A 1 108 ? 1.859   20.625  -19.117 0   28.83  ? 798  LEU   A HB3  1 1 
ATOM   1469 H  HG   . LEU   A 1 108 ? 2.036   22.325  -20.923 0   29.9   ? 798  LEU   A HG   1 1 
ATOM   1470 H  HD11 . LEU   A 1 108 ? 4.092   23.613  -21.171 0   31.59  ? 798  LEU   A HD11 1 1 
ATOM   1471 H  HD12 . LEU   A 1 108 ? 3.226   24.132  -19.712 0   31.78  ? 798  LEU   A HD12 1 1 
ATOM   1472 H  HD13 . LEU   A 1 108 ? 4.653   23.066  -19.575 0   31.76  ? 798  LEU   A HD13 1 1 
ATOM   1473 H  HD21 . LEU   A 1 108 ? 3.996   21.385  -21.981 0   30.5   ? 798  LEU   A HD21 1 1 
ATOM   1474 H  HD22 . LEU   A 1 108 ? 4.508   20.69   -20.417 0   30.54  ? 798  LEU   A HD22 1 1 
ATOM   1475 H  HD23 . LEU   A 1 108 ? 2.996   20.143  -21.182 0   30.28  ? 798  LEU   A HD23 1 1 
ATOM   1476 N  N    . LEU   A 1 109 ? -0.865  22.242  -18.779 1   30.97  ? 799  LEU   A N    1 1 
ATOM   1477 C  CA   . LEU   A 1 109 ? -2.071  22.699  -19.486 1   31.3   ? 799  LEU   A CA   1 1 
ATOM   1478 C  C    . LEU   A 1 109 ? -2.492  24.087  -18.974 1   32.42  ? 799  LEU   A C    1 1 
ATOM   1479 O  O    . LEU   A 1 109 ? -2.738  24.98   -19.775 1   32.87  ? 799  LEU   A O    1 1 
ATOM   1480 C  CB   . LEU   A 1 109 ? -3.234  21.696  -19.351 1   31     ? 799  LEU   A CB   1 1 
ATOM   1481 C  CG   . LEU   A 1 109 ? -4.594  22.141  -19.926 1   31.53  ? 799  LEU   A CG   1 1 
ATOM   1482 C  CD1  . LEU   A 1 109 ? -4.53   22.385  -21.436 1   31.75  ? 799  LEU   A CD1  1 1 
ATOM   1483 C  CD2  . LEU   A 1 109 ? -5.662  21.115  -19.63  1   32.21  ? 799  LEU   A CD2  1 1 
ATOM   1484 H  H    . LEU   A 1 109 ? -0.999  21.39   -18.243 0   28.42  ? 799  LEU   A H    1 1 
ATOM   1485 H  HA   . LEU   A 1 109 ? -1.818  22.8    -20.541 0   28.85  ? 799  LEU   A HA   1 1 
ATOM   1486 H  HB2  . LEU   A 1 109 ? -2.95   20.777  -19.863 0   28.72  ? 799  LEU   A HB2  1 1 
ATOM   1487 H  HB3  . LEU   A 1 109 ? -3.385  21.492  -18.292 0   28.7   ? 799  LEU   A HB3  1 1 
ATOM   1488 H  HG   . LEU   A 1 109 ? -4.919  23.067  -19.453 0   29.82  ? 799  LEU   A HG   1 1 
ATOM   1489 H  HD11 . LEU   A 1 109 ? -5.524  22.663  -21.784 0   29.71  ? 799  LEU   A HD11 1 1 
ATOM   1490 H  HD12 . LEU   A 1 109 ? -3.834  23.19   -21.667 0   29.5   ? 799  LEU   A HD12 1 1 
ATOM   1491 H  HD13 . LEU   A 1 109 ? -4.215  21.468  -21.932 0   29.39  ? 799  LEU   A HD13 1 1 
ATOM   1492 H  HD21 . LEU   A 1 109 ? -6.608  21.458  -20.047 0   30.44  ? 799  LEU   A HD21 1 1 
ATOM   1493 H  HD22 . LEU   A 1 109 ? -5.38   20.164  -20.081 0   29.89  ? 799  LEU   A HD22 1 1 
ATOM   1494 H  HD23 . LEU   A 1 109 ? -5.75   21.002  -18.551 0   30.3   ? 799  LEU   A HD23 1 1 
ATOM   1495 N  N    . ASP   A 1 110 ? -2.547  24.274  -17.649 1   32.79  ? 800  ASP   A N    1 1 
ATOM   1496 C  CA   . ASP   A 1 110 ? -2.888  25.574  -17.061 1   33.26  ? 800  ASP   A CA   1 1 
ATOM   1497 C  C    . ASP   A 1 110 ? -1.764  26.59   -17.294 1   33.43  ? 800  ASP   A C    1 1 
ATOM   1498 O  O    . ASP   A 1 110 ? -2.047  27.779  -17.419 1   33.93  ? 800  ASP   A O    1 1 
ATOM   1499 C  CB   . ASP   A 1 110 ? -3.138  25.441  -15.554 1   35.21  ? 800  ASP   A CB   1 1 
ATOM   1500 C  CG   . ASP   A 1 110 ? -4.317  24.564  -15.196 1   39.56  ? 800  ASP   A CG   1 1 
ATOM   1501 O  OD1  . ASP   A 1 110 ? -5.434  24.859  -15.659 1   40.19  ? 800  ASP   A OD1  1 1 
ATOM   1502 O  OD2  . ASP   A 1 110 ? -4.121  23.588  -14.44  1   41.92  ? 800  ASP   A OD2  1 1 
ATOM   1503 H  H    . ASP   A 1 110 ? -2.358  23.549  -16.964 0   31.28  ? 800  ASP   A H    1 1 
ATOM   1504 H  HA   . ASP   A 1 110 ? -3.796  25.956  -17.524 0   32.91  ? 800  ASP   A HA   1 1 
ATOM   1505 H  HB2  . ASP   A 1 110 ? -2.249  25.018  -15.088 0   34.75  ? 800  ASP   A HB2  1 1 
ATOM   1506 H  HB3  . ASP   A 1 110 ? -3.328  26.433  -15.148 0   35.57  ? 800  ASP   A HB3  1 1 
ATOM   1507 N  N    . TYR   A 1 111 ? -0.497  26.136  -17.331 1   32.88  ? 801  TYR   A N    1 1 
ATOM   1508 C  CA   . TYR   A 1 111 ? 0.642   27.017  -17.568 1   33.09  ? 801  TYR   A CA   1 1 
ATOM   1509 C  C    . TYR   A 1 111 ? 0.578   27.605  -18.978 1   32.99  ? 801  TYR   A C    1 1 
ATOM   1510 O  O    . TYR   A 1 111 ? 0.766   28.811  -19.13  1   33.39  ? 801  TYR   A O    1 1 
ATOM   1511 C  CB   . TYR   A 1 111 ? 1.978   26.262  -17.372 1   33.14  ? 801  TYR   A CB   1 1 
ATOM   1512 C  CG   . TYR   A 1 111 ? 3.169   27.186  -17.25  1   34.2   ? 801  TYR   A CG   1 1 
ATOM   1513 C  CD1  . TYR   A 1 111 ? 3.479   27.796  -16.044 1   35.31  ? 801  TYR   A CD1  1 1 
ATOM   1514 C  CD2  . TYR   A 1 111 ? 3.978   27.459  -18.343 1   35.12  ? 801  TYR   A CD2  1 1 
ATOM   1515 C  CE1  . TYR   A 1 111 ? 4.558   28.663  -15.93  1   36.22  ? 801  TYR   A CE1  1 1 
ATOM   1516 C  CE2  . TYR   A 1 111 ? 5.053   28.333  -18.245 1   36.11  ? 801  TYR   A CE2  1 1 
ATOM   1517 C  CZ   . TYR   A 1 111 ? 5.338   28.939  -17.034 1   37.19  ? 801  TYR   A CZ   1 1 
ATOM   1518 O  OH   . TYR   A 1 111 ? 6.391   29.817  -16.907 1   38.83  ? 801  TYR   A OH   1 1 
ATOM   1519 H  H    . TYR   A 1 111 ? -0.225  25.168  -17.192 0   31.99  ? 801  TYR   A H    1 1 
ATOM   1520 H  HA   . TYR   A 1 111 ? 0.597   27.837  -16.854 0   33.87  ? 801  TYR   A HA   1 1 
ATOM   1521 H  HB2  . TYR   A 1 111 ? 1.928   25.659  -16.466 0   32.88  ? 801  TYR   A HB2  1 1 
ATOM   1522 H  HB3  . TYR   A 1 111 ? 2.145   25.624  -18.237 0   32.56  ? 801  TYR   A HB3  1 1 
ATOM   1523 H  HD1  . TYR   A 1 111 ? 2.863   27.602  -15.182 0   36.69  ? 801  TYR   A HD1  1 1 
ATOM   1524 H  HD2  . TYR   A 1 111 ? 3.751   27.007  -19.293 0   35.53  ? 801  TYR   A HD2  1 1 
ATOM   1525 H  HE1  . TYR   A 1 111 ? 4.766   29.142  -14.99  0   39.29  ? 801  TYR   A HE1  1 1 
ATOM   1526 H  HE2  . TYR   A 1 111 ? 5.654   28.534  -19.115 0   38.26  ? 801  TYR   A HE2  1 1 
ATOM   1527 H  HH   . TYR   A 1 111 ? 6.878   29.901  -17.768 0   42.8   ? 801  TYR   A HH   1 1 
ATOM   1528 N  N    . VAL   A 1 112 ? 0.312   26.774  -20.008 1   32.39  ? 802  VAL   A N    1 1 
ATOM   1529 C  CA   . VAL   A 1 112 ? 0.242   27.287  -21.386 1   32.61  ? 802  VAL   A CA   1 1 
ATOM   1530 C  C    . VAL   A 1 112 ? -0.944  28.246  -21.568 1   33.16  ? 802  VAL   A C    1 1 
ATOM   1531 O  O    . VAL   A 1 112 ? -0.848  29.158  -22.38  1   32.8   ? 802  VAL   A O    1 1 
ATOM   1532 C  CB   . VAL   A 1 112 ? 0.292   26.212  -22.52  1   32.82  ? 802  VAL   A CB   1 1 
ATOM   1533 C  CG1  . VAL   A 1 112 ? 1.589   25.405  -22.472 1   33.21  ? 802  VAL   A CG1  1 1 
ATOM   1534 C  CG2  . VAL   A 1 112 ? -0.921  25.291  -22.52  1   32.74  ? 802  VAL   A CG2  1 1 
ATOM   1535 H  H    . VAL   A 1 112 ? 0.151   25.778  -19.901 0   31.34  ? 802  VAL   A H    1 1 
ATOM   1536 H  HA   . VAL   A 1 112 ? 1.134   27.893  -21.542 0   32.63  ? 802  VAL   A HA   1 1 
ATOM   1537 H  HB   . VAL   A 1 112 ? 0.288   26.737  -23.474 0   31.81  ? 802  VAL   A HB   1 1 
ATOM   1538 H  HG11 . VAL   A 1 112 ? 1.579   24.682  -23.286 0   31.3   ? 802  VAL   A HG11 1 1 
ATOM   1539 H  HG12 . VAL   A 1 112 ? 2.434   26.081  -22.587 0   32.26  ? 802  VAL   A HG12 1 1 
ATOM   1540 H  HG13 . VAL   A 1 112 ? 1.656   24.889  -21.515 0   31.65  ? 802  VAL   A HG13 1 1 
ATOM   1541 H  HG21 . VAL   A 1 112 ? -0.806  24.564  -23.323 0   30.57  ? 802  VAL   A HG21 1 1 
ATOM   1542 H  HG22 . VAL   A 1 112 ? -0.973  24.776  -21.562 0   30.9   ? 802  VAL   A HG22 1 1 
ATOM   1543 H  HG23 . VAL   A 1 112 ? -1.829  25.87   -22.682 0   31.3   ? 802  VAL   A HG23 1 1 
ATOM   1544 N  N    . ARG   A 1 113 ? -2.038  28.067  -20.805 1   33.96  ? 803  ARG   A N    1 1 
ATOM   1545 C  CA   . ARG   A 1 113 ? -3.209  28.941  -20.906 1   35.26  ? 803  ARG   A CA   1 1 
ATOM   1546 C  C    . ARG   A 1 113 ? -2.961  30.282  -20.211 1   37.07  ? 803  ARG   A C    1 1 
ATOM   1547 O  O    . ARG   A 1 113 ? -3.374  31.317  -20.724 1   37.21  ? 803  ARG   A O    1 1 
ATOM   1548 C  CB   . ARG   A 1 113 ? -4.443  28.263  -20.293 1   35.9   ? 803  ARG   A CB   1 1 
ATOM   1549 C  CG   . ARG   A 1 113 ? -4.922  27.057  -21.081 1   37.68  ? 803  ARG   A CG   1 1 
ATOM   1550 C  CD   . ARG   A 1 113 ? -6.003  26.298  -20.341 1   39.52  ? 803  ARG   A CD   1 1 
ATOM   1551 N  NE   . ARG   A 1 113 ? -6.687  25.335  -21.204 1   40.74  ? 803  ARG   A NE   1 1 
ATOM   1552 C  CZ   . ARG   A 1 113 ? -7.505  24.37   -20.786 1   41.21  ? 803  ARG   A CZ   1 1 
ATOM   1553 N  NH1  . ARG   A 1 113 ? -7.744  24.203  -19.488 1   40.94  ? 803  ARG   A NH1  1 1 
ATOM   1554 N  NH2  . ARG   A 1 113 ? -8.074  23.551  -21.66  1   39.86  ? 803  ARG   A NH2  1 1 
ATOM   1555 H  H    . ARG   A 1 113 ? -2.136  27.336  -20.108 0   33.73  ? 803  ARG   A H    1 1 
ATOM   1556 H  HA   . ARG   A 1 113 ? -3.422  29.139  -21.956 0   35.99  ? 803  ARG   A HA   1 1 
ATOM   1557 H  HB2  . ARG   A 1 113 ? -4.212  27.937  -19.28  0   36.43  ? 803  ARG   A HB2  1 1 
ATOM   1558 H  HB3  . ARG   A 1 113 ? -5.256  28.987  -20.264 0   37.13  ? 803  ARG   A HB3  1 1 
ATOM   1559 H  HG2  . ARG   A 1 113 ? -5.31   27.388  -22.043 0   37.61  ? 803  ARG   A HG2  1 1 
ATOM   1560 H  HG3  . ARG   A 1 113 ? -4.084  26.377  -21.22  0   36.95  ? 803  ARG   A HG3  1 1 
ATOM   1561 H  HD2  . ARG   A 1 113 ? -5.543  25.757  -19.516 0   39.09  ? 803  ARG   A HD2  1 1 
ATOM   1562 H  HD3  . ARG   A 1 113 ? -6.741  27      -19.957 0   40     ? 803  ARG   A HD3  1 1 
ATOM   1563 H  HE   . ARG   A 1 113 ? -6.53   25.418  -22.204 0   39.99  ? 803  ARG   A HE   1 1 
ATOM   1564 H  HH11 . ARG   A 1 113 ? -7.337  24.799  -18.776 0   40.76  ? 803  ARG   A HH11 1 1 
ATOM   1565 H  HH12 . ARG   A 1 113 ? -8.369  23.46   -19.193 0   40.61  ? 803  ARG   A HH12 1 1 
ATOM   1566 H  HH21 . ARG   A 1 113 ? -7.895  23.658  -22.653 0   38.84  ? 803  ARG   A HH21 1 1 
ATOM   1567 H  HH22 . ARG   A 1 113 ? -8.691  22.812  -21.341 0   39.12  ? 803  ARG   A HH22 1 1 
ATOM   1568 N  N    . GLU   A 1 114 ? -2.3    30.27   -19.043 1   38.36  ? 804  GLU   A N    1 1 
ATOM   1569 C  CA   . GLU   A 1 114 ? -2.035  31.504  -18.301 1   39.97  ? 804  GLU   A CA   1 1 
ATOM   1570 C  C    . GLU   A 1 114 ? -0.887  32.312  -18.915 1   41.01  ? 804  GLU   A C    1 1 
ATOM   1571 O  O    . GLU   A 1 114 ? -1.039  33.515  -19.126 1   41.66  ? 804  GLU   A O    1 1 
ATOM   1572 C  CB   . GLU   A 1 114 ? -1.748  31.197  -16.81  1   42.71  ? 804  GLU   A CB   1 1 
ATOM   1573 C  CG   . GLU   A 1 114 ? -3.004  30.869  -16.007 1   49.3   ? 804  GLU   A CG   1 1 
ATOM   1574 C  CD   . GLU   A 1 114 ? -2.832  30.024  -14.758 1   56.94  ? 804  GLU   A CD   1 1 
ATOM   1575 O  OE1  . GLU   A 1 114 ? -3.849  29.465  -14.285 1   57.58  ? 804  GLU   A OE1  1 1 
ATOM   1576 O  OE2  . GLU   A 1 114 ? -1.69   29.913  -14.255 1   60.4   ? 804  GLU   A OE2  1 1 
ATOM   1577 H  H    . GLU   A 1 114 ? -1.955  29.432  -18.588 0   39.77  ? 804  GLU   A H    1 1 
ATOM   1578 H  HA   . GLU   A 1 114 ? -2.933  32.119  -18.346 0   43.61  ? 804  GLU   A HA   1 1 
ATOM   1579 H  HB2  . GLU   A 1 114 ? -1.059  30.356  -16.741 0   45.22  ? 804  GLU   A HB2  1 1 
ATOM   1580 H  HB3  . GLU   A 1 114 ? -1.293  32.078  -16.361 0   46.71  ? 804  GLU   A HB3  1 1 
ATOM   1581 H  HG2  . GLU   A 1 114 ? -3.453  31.811  -15.697 0   53.31  ? 804  GLU   A HG2  1 1 
ATOM   1582 H  HG3  . GLU   A 1 114 ? -3.703  30.341  -16.654 0   51.95  ? 804  GLU   A HG3  1 1 
ATOM   1583 N  N    . HIS   A 1 115 ? 0.25    31.67   -19.216 1   41.27  ? 805  HIS   A N    1 1 
ATOM   1584 C  CA   . HIS   A 1 115 ? 1.413   32.383  -19.759 1   41.95  ? 805  HIS   A CA   1 1 
ATOM   1585 C  C    . HIS   A 1 115 ? 1.534   32.391  -21.307 1   42.55  ? 805  HIS   A C    1 1 
ATOM   1586 O  O    . HIS   A 1 115 ? 2.655   32.487  -21.799 1   42.7   ? 805  HIS   A O    1 1 
ATOM   1587 C  CB   . HIS   A 1 115 ? 2.692   31.808  -19.125 1   42.61  ? 805  HIS   A CB   1 1 
ATOM   1588 C  CG   . HIS   A 1 115 ? 2.677   31.872  -17.63  1   44.72  ? 805  HIS   A CG   1 1 
ATOM   1589 N  ND1  . HIS   A 1 115 ? 2.115   30.864  -16.871 1   46.68  ? 805  HIS   A ND1  1 1 
ATOM   1590 C  CD2  . HIS   A 1 115 ? 3.12    32.845  -16.802 1   45.62  ? 805  HIS   A CD2  1 1 
ATOM   1591 C  CE1  . HIS   A 1 115 ? 2.242   31.243  -15.61  1   47.08  ? 805  HIS   A CE1  1 1 
ATOM   1592 N  NE2  . HIS   A 1 115 ? 2.843   32.431  -15.52  1   46.79  ? 805  HIS   A NE2  1 1 
ATOM   1593 H  H    . HIS   A 1 115 ? 0.401   30.675  -19.089 0   43.63  ? 805  HIS   A H    1 1 
ATOM   1594 H  HA   . HIS   A 1 115 ? 1.379   33.423  -19.438 0   46.8   ? 805  HIS   A HA   1 1 
ATOM   1595 H  HB2  . HIS   A 1 115 ? 2.801   30.765  -19.418 0   45.45  ? 805  HIS   A HB2  1 1 
ATOM   1596 H  HB3  . HIS   A 1 115 ? 3.557   32.384  -19.451 0   47.03  ? 805  HIS   A HB3  1 1 
ATOM   1597 H  HD1  . HIS   A 1 115 ? 1.691   30.008  -17.213 0   49.09  ? 805  HIS   A HD1  1 1 
ATOM   1598 H  HD2  . HIS   A 1 115 ? 3.599   33.764  -17.092 0   51.88  ? 805  HIS   A HD2  1 1 
ATOM   1599 H  HE1  . HIS   A 1 115 ? 1.903   30.666  -14.766 0   50.61  ? 805  HIS   A HE1  1 1 
ATOM   1600 N  N    A LYS   A 1 116 ? 0.417   32.326  -22.039 0.5 42.65  ? 806  LYS   A N    1 1 
ATOM   1601 N  N    B LYS   A 1 116 ? 0.397   32.355  -22.064 0.5 42.58  ? 806  LYS   A N    1 1 
ATOM   1602 C  CA   A LYS   A 1 116 ? 0.42    32.331  -23.505 0.5 43.34  ? 806  LYS   A CA   1 1 
ATOM   1603 C  CA   B LYS   A 1 116 ? 0.443   32.339  -23.547 0.5 43.21  ? 806  LYS   A CA   1 1 
ATOM   1604 C  C    A LYS   A 1 116 ? 1.205   33.52   -24.11  0.5 43.81  ? 806  LYS   A C    1 1 
ATOM   1605 C  C    B LYS   A 1 116 ? 1.225   33.525  -24.12  0.5 43.74  ? 806  LYS   A C    1 1 
ATOM   1606 O  O    A LYS   A 1 116 ? 2.025   33.315  -25.005 0.5 43.94  ? 806  LYS   A O    1 1 
ATOM   1607 O  O    B LYS   A 1 116 ? 2.042   33.337  -25.018 0.5 43.86  ? 806  LYS   A O    1 1 
ATOM   1608 C  CB   A LYS   A 1 116 ? -1.038  32.305  -24.026 0.5 45.21  ? 806  LYS   A CB   1 1 
ATOM   1609 C  CB   B LYS   A 1 116 ? -0.941  32.369  -24.263 0.5 44.9   ? 806  LYS   A CB   1 1 
ATOM   1610 C  CG   A LYS   A 1 116 ? -1.211  32.681  -25.493 0.5 49.09  ? 806  LYS   A CG   1 1 
ATOM   1611 C  CG   B LYS   A 1 116 ? -2.175  31.778  -23.605 0.5 48.52  ? 806  LYS   A CG   1 1 
ATOM   1612 C  CD   A LYS   A 1 116 ? -2.631  32.491  -25.978 0.5 53.49  ? 806  LYS   A CD   1 1 
ATOM   1613 C  CD   B LYS   A 1 116 ? -3.357  31.882  -24.576 0.5 52.3   ? 806  LYS   A CD   1 1 
ATOM   1614 C  CE   A LYS   A 1 116 ? -2.902  33.259  -27.252 0.5 57.22  ? 806  LYS   A CE   1 1 
ATOM   1615 C  CE   B LYS   A 1 116 ? -4.701  31.556  -23.958 0.5 55.45  ? 806  LYS   A CE   1 1 
ATOM   1616 N  NZ   A LYS   A 1 116 ? -2.032  32.839  -28.392 0.5 59.43  ? 806  LYS   A NZ   1 1 
ATOM   1617 N  NZ   B LYS   A 1 116 ? -4.994  30.095  -23.867 0.5 57.32  ? 806  LYS   A NZ   1 1 
ATOM   1618 H  H    A LYS   A 1 116 ? -0.514  32.27   -21.637 0   45.82  ? 806  LYS   A H    1 1 
ATOM   1619 H  H    B LYS   A 1 116 ? -0.532  32.368  -21.658 0   45.79  ? 806  LYS   A H    1 1 
ATOM   1620 H  HA   A LYS   A 1 116 ? 0.902   31.416  -23.847 0   45.65  ? 806  LYS   A HA   1 1 
ATOM   1621 H  HA   B LYS   A 1 116 ? 0.948   31.427  -23.862 0   45.48  ? 806  LYS   A HA   1 1 
ATOM   1622 H  HB2  A LYS   A 1 116 ? -1.432  31.298  -23.895 0   47.18  ? 806  LYS   A HB2  1 1 
ATOM   1623 H  HB2  B LYS   A 1 116 ? -1.177  33.409  -24.48  0   48.64  ? 806  LYS   A HB2  1 1 
ATOM   1624 H  HB3  A LYS   A 1 116 ? -1.635  33.008  -23.447 0   48.68  ? 806  LYS   A HB3  1 1 
ATOM   1625 H  HB3  B LYS   A 1 116 ? -0.821  31.839  -25.206 0   47.18  ? 806  LYS   A HB3  1 1 
ATOM   1626 H  HG2  A LYS   A 1 116 ? -0.963  33.733  -25.626 0   52.98  ? 806  LYS   A HG2  1 1 
ATOM   1627 H  HG2  B LYS   A 1 116 ? -2.012  30.729  -23.362 0   50.14  ? 806  LYS   A HG2  1 1 
ATOM   1628 H  HG3  A LYS   A 1 116 ? -0.559  32.059  -26.106 0   51.48  ? 806  LYS   A HG3  1 1 
ATOM   1629 H  HG3  B LYS   A 1 116 ? -2.415  32.349  -22.709 0   51.55  ? 806  LYS   A HG3  1 1 
ATOM   1630 H  HD2  A LYS   A 1 116 ? -2.809  31.434  -26.168 0   55.31  ? 806  LYS   A HD2  1 1 
ATOM   1631 H  HD2  B LYS   A 1 116 ? -3.417  32.904  -24.946 0   55.53  ? 806  LYS   A HD2  1 1 
ATOM   1632 H  HD3  A LYS   A 1 116 ? -3.317  32.852  -25.214 0   56.63  ? 806  LYS   A HD3  1 1 
ATOM   1633 H  HD3  B LYS   A 1 116 ? -3.188  31.204  -25.411 0   54.05  ? 806  LYS   A HD3  1 1 
ATOM   1634 H  HE2  A LYS   A 1 116 ? -3.936  33.084  -27.546 0   60.41  ? 806  LYS   A HE2  1 1 
ATOM   1635 H  HE2  B LYS   A 1 116 ? -4.742  31.968  -22.95  0   58.38  ? 806  LYS   A HE2  1 1 
ATOM   1636 H  HE3  A LYS   A 1 116 ? -2.74   34.321  -27.073 0   61.48  ? 806  LYS   A HE3  1 1 
ATOM   1637 H  HE3  B LYS   A 1 116 ? -5.478  32.004  -24.576 0   58.31  ? 806  LYS   A HE3  1 1 
ATOM   1638 H  HZ1  A LYS   A 1 116 ? -2.273  33.385  -29.212 0   62.64  ? 806  LYS   A HZ1  1 1 
ATOM   1639 H  HZ1  B LYS   A 1 116 ? -5.789  29.873  -24.458 0   58.62  ? 806  LYS   A HZ1  1 1 
ATOM   1640 H  HZ2  A LYS   A 1 116 ? -1.047  32.988  -28.197 0   62.35  ? 806  LYS   A HZ2  1 1 
ATOM   1641 H  HZ2  B LYS   A 1 116 ? -4.207  29.524  -24.159 0   58.12  ? 806  LYS   A HZ2  1 1 
ATOM   1642 H  HZ3  A LYS   A 1 116 ? -2.181  31.857  -28.6   0   61.32  ? 806  LYS   A HZ3  1 1 
ATOM   1643 H  HZ3  B LYS   A 1 116 ? -5.229  29.854  -22.909 0   58.69  ? 806  LYS   A HZ3  1 1 
ATOM   1644 N  N    . ASP   A 1 117 ? 0.964   34.747  -23.621 1   43.86  ? 807  ASP   A N    1 1 
ATOM   1645 C  CA   . ASP   A 1 117 ? 1.614   35.953  -24.154 1   44.59  ? 807  ASP   A CA   1 1 
ATOM   1646 C  C    . ASP   A 1 117 ? 3.118   36.095  -23.816 1   44.81  ? 807  ASP   A C    1 1 
ATOM   1647 O  O    . ASP   A 1 117 ? 3.694   37.146  -24.091 1   45.16  ? 807  ASP   A O    1 1 
ATOM   1648 C  CB   . ASP   A 1 117 ? 0.842   37.213  -23.719 1   46.63  ? 807  ASP   A CB   1 1 
ATOM   1649 C  CG   . ASP   A 1 117 ? -0.628  37.177  -24.104 1   52.28  ? 807  ASP   A CG   1 1 
ATOM   1650 O  OD1  . ASP   A 1 117 ? -1.364  36.331  -23.553 1   53.27  ? 807  ASP   A OD1  1 1 
ATOM   1651 O  OD2  . ASP   A 1 117 ? -1.037  37.986  -24.958 1   55.17  ? 807  ASP   A OD2  1 1 
ATOM   1652 H  H    A ASP   A 1 117 ? 0.351   34.926  -22.832 0   49.46  ? 807  ASP   A H    1 1 
ATOM   1653 H  H    B ASP   A 1 117 ? 0.34    34.922  -22.84  0   49.45  ? 807  ASP   A H    1 1 
ATOM   1654 H  HA   . ASP   A 1 117 ? 1.542   35.921  -25.24  0   51.04  ? 807  ASP   A HA   1 1 
ATOM   1655 H  HB2  . ASP   A 1 117 ? 0.912   37.317  -22.638 0   54.99  ? 807  ASP   A HB2  1 1 
ATOM   1656 H  HB3  . ASP   A 1 117 ? 1.278   38.085  -24.204 0   55.72  ? 807  ASP   A HB3  1 1 
ATOM   1657 N  N    . ASN   A 1 118 ? 3.748   35.054  -23.24  1   44.36  ? 808  ASN   A N    1 1 
ATOM   1658 C  CA   . ASN   A 1 118 ? 5.178   35.048  -22.943 1   44.46  ? 808  ASN   A CA   1 1 
ATOM   1659 C  C    . ASN   A 1 118 ? 5.849   33.677  -23.212 1   43.44  ? 808  ASN   A C    1 1 
ATOM   1660 O  O    . ASN   A 1 118 ? 7.03    33.522  -22.886 1   43.28  ? 808  ASN   A O    1 1 
ATOM   1661 C  CB   . ASN   A 1 118 ? 5.424   35.519  -21.486 1   46.49  ? 808  ASN   A CB   1 1 
ATOM   1662 C  CG   . ASN   A 1 118 ? 6.086   36.873  -21.344 1   51.37  ? 808  ASN   A CG   1 1 
ATOM   1663 O  OD1  . ASN   A 1 118 ? 6.376   37.565  -22.327 1   53.29  ? 808  ASN   A OD1  1 1 
ATOM   1664 N  ND2  . ASN   A 1 118 ? 6.351   37.278  -20.108 1   52.69  ? 808  ASN   A ND2  1 1 
ATOM   1665 H  H    . ASN   A 1 118 ? 3.28    34.216  -22.911 0   49.88  ? 808  ASN   A H    1 1 
ATOM   1666 H  HA   . ASN   A 1 118 ? 5.668   35.717  -23.649 0   52.45  ? 808  ASN   A HA   1 1 
ATOM   1667 H  HB2  . ASN   A 1 118 ? 4.464   35.592  -20.976 0   54.19  ? 808  ASN   A HB2  1 1 
ATOM   1668 H  HB3  . ASN   A 1 118 ? 6.048   34.796  -20.963 0   54.02  ? 808  ASN   A HB3  1 1 
ATOM   1669 H  HD21 . ASN   A 1 118 ? 6.797   38.178  -19.96  0   64.75  ? 808  ASN   A HD21 1 1 
ATOM   1670 H  HD22 . ASN   A 1 118 ? 6.115   36.696  -19.311 0   62.71  ? 808  ASN   A HD22 1 1 
ATOM   1671 N  N    . ILE   A 1 119 ? 5.15    32.724  -23.883 1   42.55  ? 809  ILE   A N    1 1 
ATOM   1672 C  CA   . ILE   A 1 119 ? 5.738   31.424  -24.226 1   42.29  ? 809  ILE   A CA   1 1 
ATOM   1673 C  C    . ILE   A 1 119 ? 6.246   31.505  -25.667 1   41.56  ? 809  ILE   A C    1 1 
ATOM   1674 O  O    . ILE   A 1 119 ? 5.457   31.69   -26.591 1   41.62  ? 809  ILE   A O    1 1 
ATOM   1675 C  CB   . ILE   A 1 119 ? 4.744   30.242  -24.019 1   42.85  ? 809  ILE   A CB   1 1 
ATOM   1676 C  CG1  . ILE   A 1 119 ? 4.497   30      -22.51  1   43.7   ? 809  ILE   A CG1  1 1 
ATOM   1677 C  CG2  . ILE   A 1 119 ? 5.291   28.952  -24.673 1   43.41  ? 809  ILE   A CG2  1 1 
ATOM   1678 C  CD1  . ILE   A 1 119 ? 3.226   29.234  -22.17  1   44.84  ? 809  ILE   A CD1  1 1 
ATOM   1679 H  H    . ILE   A 1 119 ? 4.196   32.82   -24.214 0   46.9   ? 809  ILE   A H    1 1 
ATOM   1680 H  HA   . ILE   A 1 119 ? 6.594   31.227  -23.583 0   46.27  ? 809  ILE   A HA   1 1 
ATOM   1681 H  HB   . ILE   A 1 119 ? 3.797   30.497  -24.493 0   45     ? 809  ILE   A HB   1 1 
ATOM   1682 H  HG12 . ILE   A 1 119 ? 5.337   29.436  -22.107 0   45.91  ? 809  ILE   A HG12 1 1 
ATOM   1683 H  HG13 . ILE   A 1 119 ? 4.431   30.961  -22.003 0   46.79  ? 809  ILE   A HG13 1 1 
ATOM   1684 H  HG21 . ILE   A 1 119 ? 4.599   28.128  -24.508 0   44.08  ? 809  ILE   A HG21 1 1 
ATOM   1685 H  HG22 . ILE   A 1 119 ? 5.396   29.098  -25.747 0   44.96  ? 809  ILE   A HG22 1 1 
ATOM   1686 H  HG23 . ILE   A 1 119 ? 6.258   28.714  -24.232 0   45.18  ? 809  ILE   A HG23 1 1 
ATOM   1687 H  HD11 . ILE   A 1 119 ? 3.157   29.141  -21.087 0   46.22  ? 809  ILE   A HD11 1 1 
ATOM   1688 H  HD12 . ILE   A 1 119 ? 2.368   29.79   -22.546 0   46.29  ? 809  ILE   A HD12 1 1 
ATOM   1689 H  HD13 . ILE   A 1 119 ? 3.253   28.244  -22.621 0   45.41  ? 809  ILE   A HD13 1 1 
ATOM   1690 N  N    . GLY   A 1 120 ? 7.553   31.369  -25.839 1   40.65  ? 810  GLY   A N    1 1 
ATOM   1691 C  CA   . GLY   A 1 120 ? 8.176   31.406  -27.15  1   40.3   ? 810  GLY   A CA   1 1 
ATOM   1692 C  C    . GLY   A 1 120 ? 8.286   30.042  -27.796 1   39.62  ? 810  GLY   A C    1 1 
ATOM   1693 O  O    . GLY   A 1 120 ? 7.985   29.022  -27.175 1   39.79  ? 810  GLY   A O    1 1 
ATOM   1694 H  H    . GLY   A 1 120 ? 8.223   31.234  -25.089 0   45.34  ? 810  GLY   A H    1 1 
ATOM   1695 H  HA2  . GLY   A 1 120 ? 7.629   32.066  -27.823 0   45.12  ? 810  GLY   A HA2  1 1 
ATOM   1696 H  HA3  . GLY   A 1 120 ? 9.184   31.804  -27.048 0   45.92  ? 810  GLY   A HA3  1 1 
ATOM   1697 N  N    . SER   A 1 121 ? 8.764   30.026  -29.043 1   38.91  ? 811  SER   A N    1 1 
ATOM   1698 C  CA   . SER   A 1 121 ? 8.955   28.815  -29.835 1   38.62  ? 811  SER   A CA   1 1 
ATOM   1699 C  C    . SER   A 1 121 ? 9.972   27.865  -29.232 1   38.44  ? 811  SER   A C    1 1 
ATOM   1700 O  O    . SER   A 1 121 ? 9.815   26.652  -29.362 1   39.14  ? 811  SER   A O    1 1 
ATOM   1701 C  CB   . SER   A 1 121 ? 9.395   29.173  -31.249 1   39.96  ? 811  SER   A CB   1 1 
ATOM   1702 O  OG   . SER   A 1 121 ? 10.569  29.971  -31.236 1   42.72  ? 811  SER   A OG   1 1 
ATOM   1703 H  H    . SER   A 1 121 ? 9.028   30.874  -29.534 0   43.43  ? 811  SER   A H    1 1 
ATOM   1704 H  HA   . SER   A 1 121 ? 8.001   28.296  -29.9   0   40.53  ? 811  SER   A HA   1 1 
ATOM   1705 H  HB2  . SER   A 1 121 ? 9.598   28.256  -31.799 0   42.77  ? 811  SER   A HB2  1 1 
ATOM   1706 H  HB3  . SER   A 1 121 ? 8.599   29.743  -31.726 0   43.18  ? 811  SER   A HB3  1 1 
ATOM   1707 H  HG   . SER   A 1 121 ? 10.348  30.922  -31.054 0   48.07  ? 811  SER   A HG   1 1 
ATOM   1708 N  N    . GLN   A 1 122 ? 11.031  28.402  -28.606 1   37.6   ? 812  GLN   A N    1 1 
ATOM   1709 C  CA   . GLN   A 1 122 ? 12.073  27.598  -27.971 1   37.1   ? 812  GLN   A CA   1 1 
ATOM   1710 C  C    . GLN   A 1 122 ? 11.461  26.744  -26.86  1   36.28  ? 812  GLN   A C    1 1 
ATOM   1711 O  O    . GLN   A 1 122 ? 11.753  25.557  -26.783 1   36.22  ? 812  GLN   A O    1 1 
ATOM   1712 C  CB   . GLN   A 1 122 ? 13.172  28.515  -27.4   1   39.03  ? 812  GLN   A CB   1 1 
ATOM   1713 C  CG   . GLN   A 1 122 ? 14.384  27.79   -26.819 1   42.36  ? 812  GLN   A CG   1 1 
ATOM   1714 C  CD   . GLN   A 1 122 ? 15.304  27.265  -27.89  1   45.71  ? 812  GLN   A CD   1 1 
ATOM   1715 O  OE1  . GLN   A 1 122 ? 16.174  27.982  -28.381 1   46.85  ? 812  GLN   A OE1  1 1 
ATOM   1716 N  NE2  . GLN   A 1 122 ? 15.141  26.004  -28.277 1   46.3   ? 812  GLN   A NE2  1 1 
ATOM   1717 H  H    . GLN   A 1 122 ? 11.2    29.401  -28.541 0   42.5   ? 812  GLN   A H    1 1 
ATOM   1718 H  HA   . GLN   A 1 122 ? 12.519  26.936  -28.711 0   41.3   ? 812  GLN   A HA   1 1 
ATOM   1719 H  HB2  . GLN   A 1 122 ? 13.532  29.163  -28.197 0   45.69  ? 812  GLN   A HB2  1 1 
ATOM   1720 H  HB3  . GLN   A 1 122 ? 12.74   29.12   -26.604 0   45.1   ? 812  GLN   A HB3  1 1 
ATOM   1721 H  HG2  . GLN   A 1 122 ? 14.954  28.507  -26.229 0   49.97  ? 812  GLN   A HG2  1 1 
ATOM   1722 H  HG3  . GLN   A 1 122 ? 14.076  26.963  -26.181 0   48.07  ? 812  GLN   A HG3  1 1 
ATOM   1723 H  HE21 . GLN   A 1 122 ? 14.419  25.424  -27.863 0   51.26  ? 812  GLN   A HE21 1 1 
ATOM   1724 H  HE22 . GLN   A 1 122 ? 15.744  25.617  -28.996 0   52.58  ? 812  GLN   A HE22 1 1 
ATOM   1725 N  N    . TYR   A 1 123 ? 10.596  27.335  -26.028 1   35.8   ? 813  TYR   A N    1 1 
ATOM   1726 C  CA   . TYR   A 1 123 ? 9.927   26.618  -24.94  1   35.98  ? 813  TYR   A CA   1 1 
ATOM   1727 C  C    . TYR   A 1 123 ? 9.003   25.512  -25.455 1   35.19  ? 813  TYR   A C    1 1 
ATOM   1728 O  O    . TYR   A 1 123 ? 9.053   24.397  -24.945 1   35.21  ? 813  TYR   A O    1 1 
ATOM   1729 C  CB   . TYR   A 1 123 ? 9.11    27.594  -24.066 1   36.59  ? 813  TYR   A CB   1 1 
ATOM   1730 C  CG   . TYR   A 1 123 ? 9.967   28.435  -23.15  1   38.26  ? 813  TYR   A CG   1 1 
ATOM   1731 C  CD1  . TYR   A 1 123 ? 10.264  28.01   -21.864 1   39.43  ? 813  TYR   A CD1  1 1 
ATOM   1732 C  CD2  . TYR   A 1 123 ? 10.564  29.602  -23.602 1   39.54  ? 813  TYR   A CD2  1 1 
ATOM   1733 C  CE1  . TYR   A 1 123 ? 11.078  28.759  -21.028 1   40.76  ? 813  TYR   A CE1  1 1 
ATOM   1734 C  CE2  . TYR   A 1 123 ? 11.391  30.354  -22.779 1   40.84  ? 813  TYR   A CE2  1 1 
ATOM   1735 C  CZ   . TYR   A 1 123 ? 11.637  29.934  -21.486 1   42.06  ? 813  TYR   A CZ   1 1 
ATOM   1736 O  OH   . TYR   A 1 123 ? 12.474  30.642  -20.66  1   44.92  ? 813  TYR   A OH   1 1 
ATOM   1737 H  H    . TYR   A 1 123 ? 10.354  28.32   -26.068 0   39.47  ? 813  TYR   A H    1 1 
ATOM   1738 H  HA   . TYR   A 1 123 ? 10.693  26.15   -24.322 0   38.65  ? 813  TYR   A HA   1 1 
ATOM   1739 H  HB2  . TYR   A 1 123 ? 8.53    28.262  -24.701 0   39.17  ? 813  TYR   A HB2  1 1 
ATOM   1740 H  HB3  . TYR   A 1 123 ? 8.434   27.013  -23.44  0   38.42  ? 813  TYR   A HB3  1 1 
ATOM   1741 H  HD1  . TYR   A 1 123 ? 9.819   27.103  -21.493 0   42.44  ? 813  TYR   A HD1  1 1 
ATOM   1742 H  HD2  . TYR   A 1 123 ? 10.373  29.936  -24.608 0   44.6   ? 813  TYR   A HD2  1 1 
ATOM   1743 H  HE1  . TYR   A 1 123 ? 11.27   28.425  -20.024 0   45.94  ? 813  TYR   A HE1  1 1 
ATOM   1744 H  HE2  . TYR   A 1 123 ? 11.827  31.265  -23.154 0   48.32  ? 813  TYR   A HE2  1 1 
ATOM   1745 H  HH   . TYR   A 1 123 ? 12.815  31.454  -21.118 0   53.64  ? 813  TYR   A HH   1 1 
ATOM   1746 N  N    . LEU   A 1 124 ? 8.162   25.813  -26.451 1   34.55  ? 814  LEU   A N    1 1 
ATOM   1747 C  CA   . LEU   A 1 124 ? 7.214   24.822  -26.976 1   34.19  ? 814  LEU   A CA   1 1 
ATOM   1748 C  C    . LEU   A 1 124 ? 7.923   23.624  -27.588 1   34.25  ? 814  LEU   A C    1 1 
ATOM   1749 O  O    . LEU   A 1 124 ? 7.521   22.489  -27.342 1   34.56  ? 814  LEU   A O    1 1 
ATOM   1750 C  CB   . LEU   A 1 124 ? 6.279   25.462  -28.017 1   33.85  ? 814  LEU   A CB   1 1 
ATOM   1751 C  CG   . LEU   A 1 124 ? 5.182   26.394  -27.458 1   34.81  ? 814  LEU   A CG   1 1 
ATOM   1752 C  CD1  . LEU   A 1 124 ? 4.726   27.389  -28.49  1   35.29  ? 814  LEU   A CD1  1 1 
ATOM   1753 C  CD2  . LEU   A 1 124 ? 3.989   25.607  -26.945 1   34.84  ? 814  LEU   A CD2  1 1 
ATOM   1754 H  H    . LEU   A 1 124 ? 8.124   26.718  -26.907 0   35.69  ? 814  LEU   A H    1 1 
ATOM   1755 H  HA   . LEU   A 1 124 ? 6.612   24.462  -26.142 0   33.42  ? 814  LEU   A HA   1 1 
ATOM   1756 H  HB2  . LEU   A 1 124 ? 6.893   26.029  -28.715 0   33.83  ? 814  LEU   A HB2  1 1 
ATOM   1757 H  HB3  . LEU   A 1 124 ? 5.786   24.657  -28.561 0   32.65  ? 814  LEU   A HB3  1 1 
ATOM   1758 H  HG   . LEU   A 1 124 ? 5.581   26.961  -26.618 0   34.9   ? 814  LEU   A HG   1 1 
ATOM   1759 H  HD11 . LEU   A 1 124 ? 3.952   28.02   -28.056 0   35.35  ? 814  LEU   A HD11 1 1 
ATOM   1760 H  HD12 . LEU   A 1 124 ? 5.576   27.999  -28.793 0   35.88  ? 814  LEU   A HD12 1 1 
ATOM   1761 H  HD13 . LEU   A 1 124 ? 4.329   26.852  -29.35  0   34.67  ? 814  LEU   A HD13 1 1 
ATOM   1762 H  HD21 . LEU   A 1 124 ? 3.241   26.304  -26.57  0   33.76  ? 814  LEU   A HD21 1 1 
ATOM   1763 H  HD22 . LEU   A 1 124 ? 3.569   25.024  -27.764 0   33.09  ? 814  LEU   A HD22 1 1 
ATOM   1764 H  HD23 . LEU   A 1 124 ? 4.306   24.945  -26.141 0   33.4   ? 814  LEU   A HD23 1 1 
ATOM   1765 N  N    . LEU   A 1 125 ? 8.997   23.865  -28.351 1   33.96  ? 815  LEU   A N    1 1 
ATOM   1766 C  CA   . LEU   A 1 125 ? 9.732   22.771  -28.984 1   33.77  ? 815  LEU   A CA   1 1 
ATOM   1767 C  C    . LEU   A 1 125 ? 10.553  21.994  -27.948 1   32.91  ? 815  LEU   A C    1 1 
ATOM   1768 O  O    . LEU   A 1 125 ? 10.613  20.769  -28.034 1   33.03  ? 815  LEU   A O    1 1 
ATOM   1769 C  CB   . LEU   A 1 125 ? 10.596  23.285  -30.16  1   33.98  ? 815  LEU   A CB   1 1 
ATOM   1770 C  CG   . LEU   A 1 125 ? 9.782   23.903  -31.338 1   35.16  ? 815  LEU   A CG   1 1 
ATOM   1771 C  CD1  . LEU   A 1 125 ? 10.667  24.717  -32.235 1   35.7   ? 815  LEU   A CD1  1 1 
ATOM   1772 C  CD2  . LEU   A 1 125 ? 9.052   22.837  -32.177 1   35.25  ? 815  LEU   A CD2  1 1 
ATOM   1773 H  H    . LEU   A 1 125 ? 9.382   24.786  -28.532 0   34.66  ? 815  LEU   A H    1 1 
ATOM   1774 H  HA   . LEU   A 1 125 ? 9.001   22.076  -29.392 0   33.05  ? 815  LEU   A HA   1 1 
ATOM   1775 H  HB2  . LEU   A 1 125 ? 11.272  24.051  -29.784 0   35.55  ? 815  LEU   A HB2  1 1 
ATOM   1776 H  HB3  . LEU   A 1 125 ? 11.172  22.45   -30.558 0   34.78  ? 815  LEU   A HB3  1 1 
ATOM   1777 H  HG   . LEU   A 1 125 ? 9.026   24.575  -30.936 0   35.45  ? 815  LEU   A HG   1 1 
ATOM   1778 H  HD11 . LEU   A 1 125 ? 10.07   25.12   -33.052 0   36.92  ? 815  LEU   A HD11 1 1 
ATOM   1779 H  HD12 . LEU   A 1 125 ? 11.089  25.532  -31.65  0   37.86  ? 815  LEU   A HD12 1 1 
ATOM   1780 H  HD13 . LEU   A 1 125 ? 11.461  24.085  -32.629 0   37.38  ? 815  LEU   A HD13 1 1 
ATOM   1781 H  HD21 . LEU   A 1 125 ? 8.538   23.332  -32.998 0   34.66  ? 815  LEU   A HD21 1 1 
ATOM   1782 H  HD22 . LEU   A 1 125 ? 9.785   22.136  -32.575 0   34.97  ? 815  LEU   A HD22 1 1 
ATOM   1783 H  HD23 . LEU   A 1 125 ? 8.32    22.305  -31.572 0   34.19  ? 815  LEU   A HD23 1 1 
ATOM   1784 N  N    . ASN   A 1 126 ? 11.107  22.673  -26.929 1   31.99  ? 816  ASN   A N    1 1 
ATOM   1785 C  CA   . ASN   A 1 126 ? 11.845  21.982  -25.866 1   31.46  ? 816  ASN   A CA   1 1 
ATOM   1786 C  C    . ASN   A 1 126 ? 10.903  21.105  -25.036 1   30.59  ? 816  ASN   A C    1 1 
ATOM   1787 O  O    . ASN   A 1 126 ? 11.251  19.967  -24.73  1   30.65  ? 816  ASN   A O    1 1 
ATOM   1788 C  CB   . ASN   A 1 126 ? 12.591  22.972  -24.966 1   32.67  ? 816  ASN   A CB   1 1 
ATOM   1789 C  CG   . ASN   A 1 126 ? 13.888  23.482  -25.579 1   36.22  ? 816  ASN   A CG   1 1 
ATOM   1790 O  OD1  . ASN   A 1 126 ? 14.481  22.84   -26.451 1   37.06  ? 816  ASN   A OD1  1 1 
ATOM   1791 N  ND2  . ASN   A 1 126 ? 14.356  24.646  -25.137 1   36.86  ? 816  ASN   A ND2  1 1 
ATOM   1792 H  H    . ASN   A 1 126 ? 11.081  23.682  -26.825 0   33.37  ? 816  ASN   A H    1 1 
ATOM   1793 H  HA   . ASN   A 1 126 ? 12.572  21.319  -26.335 0   33.07  ? 816  ASN   A HA   1 1 
ATOM   1794 H  HB2  . ASN   A 1 126 ? 11.951  23.827  -24.752 0   34.92  ? 816  ASN   A HB2  1 1 
ATOM   1795 H  HB3  . ASN   A 1 126 ? 12.846  22.469  -24.034 0   35.08  ? 816  ASN   A HB3  1 1 
ATOM   1796 H  HD21 . ASN   A 1 126 ? 15.217  25.022  -25.522 0   42.49  ? 816  ASN   A HD21 1 1 
ATOM   1797 H  HD22 . ASN   A 1 126 ? 13.853  25.166  -24.425 0   41.4   ? 816  ASN   A HD22 1 1 
ATOM   1798 N  N    . TRP   A 1 127 ? 9.688   21.589  -24.721 1   29.64  ? 817  TRP   A N    1 1 
ATOM   1799 C  CA   . TRP   A 1 127 ? 8.703   20.782  -23.99  1   28.98  ? 817  TRP   A CA   1 1 
ATOM   1800 C  C    . TRP   A 1 127 ? 8.348   19.525  -24.781 1   27.7   ? 817  TRP   A C    1 1 
ATOM   1801 O  O    . TRP   A 1 127 ? 8.302   18.44   -24.202 1   27.69  ? 817  TRP   A O    1 1 
ATOM   1802 C  CB   . TRP   A 1 127 ? 7.432   21.587  -23.679 1   29.16  ? 817  TRP   A CB   1 1 
ATOM   1803 C  CG   . TRP   A 1 127 ? 7.623   22.729  -22.718 1   29.99  ? 817  TRP   A CG   1 1 
ATOM   1804 C  CD1  . TRP   A 1 127 ? 8.576   22.848  -21.742 1   30.99  ? 817  TRP   A CD1  1 1 
ATOM   1805 C  CD2  . TRP   A 1 127 ? 6.827   23.913  -22.647 1   29.97  ? 817  TRP   A CD2  1 1 
ATOM   1806 N  NE1  . TRP   A 1 127 ? 8.423   24.041  -21.077 1   31.19  ? 817  TRP   A NE1  1 1 
ATOM   1807 C  CE2  . TRP   A 1 127 ? 7.34    24.703  -21.597 1   30.69  ? 817  TRP   A CE2  1 1 
ATOM   1808 C  CE3  . TRP   A 1 127 ? 5.731   24.387  -23.372 1   30.5   ? 817  TRP   A CE3  1 1 
ATOM   1809 C  CZ2  . TRP   A 1 127 ? 6.788   25.932  -21.257 1   31.02  ? 817  TRP   A CZ2  1 1 
ATOM   1810 C  CZ3  . TRP   A 1 127 ? 5.186   25.603  -23.03  1   31.12  ? 817  TRP   A CZ3  1 1 
ATOM   1811 C  CH2  . TRP   A 1 127 ? 5.722   26.367  -21.993 1   31.11  ? 817  TRP   A CH2  1 1 
ATOM   1812 H  H    . TRP   A 1 127 ? 9.364   22.523  -24.951 0   29.92  ? 817  TRP   A H    1 1 
ATOM   1813 H  HA   . TRP   A 1 127 ? 9.146   20.466  -23.047 0   29.25  ? 817  TRP   A HA   1 1 
ATOM   1814 H  HB2  . TRP   A 1 127 ? 7.052   22.003  -24.611 0   28.84  ? 817  TRP   A HB2  1 1 
ATOM   1815 H  HB3  . TRP   A 1 127 ? 6.69    20.915  -23.25  0   28.54  ? 817  TRP   A HB3  1 1 
ATOM   1816 H  HD1  . TRP   A 1 127 ? 9.333   22.119  -21.503 0   31.1   ? 817  TRP   A HD1  1 1 
ATOM   1817 H  HE1  . TRP   A 1 127 ? 8.994   24.359  -20.267 0   32.28  ? 817  TRP   A HE1  1 1 
ATOM   1818 H  HE3  . TRP   A 1 127 ? 5.305   23.8    -24.169 0   29.38  ? 817  TRP   A HE3  1 1 
ATOM   1819 H  HZ2  . TRP   A 1 127 ? 7.208   26.534  -20.47  0   32.29  ? 817  TRP   A HZ2  1 1 
ATOM   1820 H  HZ3  . TRP   A 1 127 ? 4.343   25.979  -23.584 0   30.49  ? 817  TRP   A HZ3  1 1 
ATOM   1821 H  HH2  . TRP   A 1 127 ? 5.269   27.313  -21.751 0   31.87  ? 817  TRP   A HH2  1 1 
ATOM   1822 N  N    . CYS   A 1 128 ? 8.179   19.64   -26.112 1   26.5   ? 818  CYS   A N    1 1 
ATOM   1823 C  CA   . CYS   A 1 128 ? 7.93    18.471  -26.959 1   26.14  ? 818  CYS   A CA   1 1 
ATOM   1824 C  C    . CYS   A 1 128 ? 9.103   17.464  -26.846 1   25.69  ? 818  CYS   A C    1 1 
ATOM   1825 O  O    . CYS   A 1 128 ? 8.86    16.269  -26.698 1   25.17  ? 818  CYS   A O    1 1 
ATOM   1826 C  CB   . CYS   A 1 128 ? 7.708   18.897  -28.408 1   26.95  ? 818  CYS   A CB   1 1 
ATOM   1827 S  SG   . CYS   A 1 128 ? 6.193   19.864  -28.689 1   29.53  ? 818  CYS   A SG   1 1 
ATOM   1828 H  H    . CYS   A 1 128 ? 8.188   20.518  -26.621 0   26.94  ? 818  CYS   A H    1 1 
ATOM   1829 H  HA   . CYS   A 1 128 ? 7.025   17.971  -26.615 0   26.04  ? 818  CYS   A HA   1 1 
ATOM   1830 H  HB2  . CYS   A 1 128 ? 8.549   19.511  -28.726 0   27.62  ? 818  CYS   A HB2  1 1 
ATOM   1831 H  HB3  . CYS   A 1 128 ? 7.655   18.005  -29.03  0   27.15  ? 818  CYS   A HB3  1 1 
ATOM   1832 H  HG   . CYS   A 1 128 ? 5.893   19.832  -29.994 0   29.03  ? 818  CYS   A HG   1 1 
ATOM   1833 N  N    . VAL   A 1 129 ? 10.368  17.961  -26.884 1   25.67  ? 819  VAL   A N    1 1 
ATOM   1834 C  CA   . VAL   A 1 129 ? 11.583  17.136  -26.735 1   26.35  ? 819  VAL   A CA   1 1 
ATOM   1835 C  C    . VAL   A 1 129 ? 11.54   16.393  -25.394 1   26.57  ? 819  VAL   A C    1 1 
ATOM   1836 O  O    . VAL   A 1 129 ? 11.732  15.184  -25.36  1   26.73  ? 819  VAL   A O    1 1 
ATOM   1837 C  CB   . VAL   A 1 129 ? 12.883  18.003  -26.817 1   27.22  ? 819  VAL   A CB   1 1 
ATOM   1838 C  CG1  . VAL   A 1 129 ? 14.128  17.213  -26.4   1   28.91  ? 819  VAL   A CG1  1 1 
ATOM   1839 C  CG2  . VAL   A 1 129 ? 13.076  18.591  -28.201 1   27.22  ? 819  VAL   A CG2  1 1 
ATOM   1840 H  H    . VAL   A 1 129 ? 10.564  18.951  -26.998 0   26.88  ? 819  VAL   A H    1 1 
ATOM   1841 H  HA   . VAL   A 1 129 ? 11.615  16.396  -27.533 0   27.63  ? 819  VAL   A HA   1 1 
ATOM   1842 H  HB   . VAL   A 1 129 ? 12.783  18.836  -26.122 0   28.83  ? 819  VAL   A HB   1 1 
ATOM   1843 H  HG11 . VAL   A 1 129 ? 14.998  17.856  -26.523 0   31.79  ? 819  VAL   A HG11 1 1 
ATOM   1844 H  HG12 . VAL   A 1 129 ? 14.066  16.905  -25.358 0   30.78  ? 819  VAL   A HG12 1 1 
ATOM   1845 H  HG13 . VAL   A 1 129 ? 14.226  16.341  -27.045 0   30.98  ? 819  VAL   A HG13 1 1 
ATOM   1846 H  HG21 . VAL   A 1 129 ? 13.999  19.169  -28.21  0   29.82  ? 819  VAL   A HG21 1 1 
ATOM   1847 H  HG22 . VAL   A 1 129 ? 13.137  17.782  -28.927 0   29.04  ? 819  VAL   A HG22 1 1 
ATOM   1848 H  HG23 . VAL   A 1 129 ? 12.234  19.241  -28.436 0   28.5   ? 819  VAL   A HG23 1 1 
ATOM   1849 N  N    . GLN   A 1 130 ? 11.266  17.125  -24.303 1   26.39  ? 820  GLN   A N    1 1 
ATOM   1850 C  CA   . GLN   A 1 130 ? 11.28   16.616  -22.94  1   26.65  ? 820  GLN   A CA   1 1 
ATOM   1851 C  C    . GLN   A 1 130 ? 10.179  15.603  -22.675 1   26.97  ? 820  GLN   A C    1 1 
ATOM   1852 O  O    . GLN   A 1 130 ? 10.42   14.626  -21.967 1   27.95  ? 820  GLN   A O    1 1 
ATOM   1853 C  CB   . GLN   A 1 130 ? 11.224  17.787  -21.945 1   28.3   ? 820  GLN   A CB   1 1 
ATOM   1854 C  CG   . GLN   A 1 130 ? 12.489  18.668  -21.981 1   31.93  ? 820  GLN   A CG   1 1 
ATOM   1855 C  CD   . GLN   A 1 130 ? 12.355  19.923  -21.161 1   36.13  ? 820  GLN   A CD   1 1 
ATOM   1856 O  OE1  . GLN   A 1 130 ? 11.467  20.057  -20.311 1   37.25  ? 820  GLN   A OE1  1 1 
ATOM   1857 N  NE2  . GLN   A 1 130 ? 13.236  20.879  -21.395 1   36.39  ? 820  GLN   A NE2  1 1 
ATOM   1858 H  H    . GLN   A 1 130 ? 10.999  18.102  -24.36  0   27.33  ? 820  GLN   A H    1 1 
ATOM   1859 H  HA   . GLN   A 1 130 ? 12.232  16.108  -22.789 0   28.14  ? 820  GLN   A HA   1 1 
ATOM   1860 H  HB2  . GLN   A 1 130 ? 10.363  18.417  -22.167 0   28.51  ? 820  GLN   A HB2  1 1 
ATOM   1861 H  HB3  . GLN   A 1 130 ? 11.133  17.383  -20.938 0   28.83  ? 820  GLN   A HB3  1 1 
ATOM   1862 H  HG2  . GLN   A 1 130 ? 13.332  18.097  -21.594 0   33.7   ? 820  GLN   A HG2  1 1 
ATOM   1863 H  HG3  . GLN   A 1 130 ? 12.696  18.968  -23.008 0   33.23  ? 820  GLN   A HG3  1 1 
ATOM   1864 H  HE21 . GLN   A 1 130 ? 13.96   20.757  -22.096 0   39.29  ? 820  GLN   A HE21 1 1 
ATOM   1865 H  HE22 . GLN   A 1 130 ? 13.19   21.745  -20.868 0   39.16  ? 820  GLN   A HE22 1 1 
ATOM   1866 N  N    . ILE   A 1 131 ? 8.998   15.782  -23.278 1   25.8   ? 821  ILE   A N    1 1 
ATOM   1867 C  CA   . ILE   A 1 131 ? 7.913   14.81   -23.132 1   25.24  ? 821  ILE   A CA   1 1 
ATOM   1868 C  C    . ILE   A 1 131 ? 8.302   13.57   -23.949 1   25.1   ? 821  ILE   A C    1 1 
ATOM   1869 O  O    . ILE   A 1 131 ? 8.112   12.462  -23.468 1   24.92  ? 821  ILE   A O    1 1 
ATOM   1870 C  CB   . ILE   A 1 131 ? 6.525   15.393  -23.564 1   24.82  ? 821  ILE   A CB   1 1 
ATOM   1871 C  CG1  . ILE   A 1 131 ? 6.119   16.594  -22.676 1   25.57  ? 821  ILE   A CG1  1 1 
ATOM   1872 C  CG2  . ILE   A 1 131 ? 5.418   14.297  -23.515 1   25.05  ? 821  ILE   A CG2  1 1 
ATOM   1873 C  CD1  . ILE   A 1 131 ? 5.113   17.601  -23.381 1   27.17  ? 821  ILE   A CD1  1 1 
ATOM   1874 H  H    . ILE   A 1 131 ? 8.769   16.57   -23.876 0   26.14  ? 821  ILE   A H    1 1 
ATOM   1875 H  HA   . ILE   A 1 131 ? 7.831   14.511  -22.088 0   25.39  ? 821  ILE   A HA   1 1 
ATOM   1876 H  HB   . ILE   A 1 131 ? 6.613   15.743  -24.591 0   24.93  ? 821  ILE   A HB   1 1 
ATOM   1877 H  HG12 . ILE   A 1 131 ? 5.632   16.224  -21.774 0   25.23  ? 821  ILE   A HG12 1 1 
ATOM   1878 H  HG13 . ILE   A 1 131 ? 7.003   17.168  -22.402 0   25.73  ? 821  ILE   A HG13 1 1 
ATOM   1879 H  HG21 . ILE   A 1 131 ? 4.465   14.729  -23.816 0   24.63  ? 821  ILE   A HG21 1 1 
ATOM   1880 H  HG22 . ILE   A 1 131 ? 5.668   13.481  -24.19  0   25.01  ? 821  ILE   A HG22 1 1 
ATOM   1881 H  HG23 . ILE   A 1 131 ? 5.345   13.923  -22.495 0   24.83  ? 821  ILE   A HG23 1 1 
ATOM   1882 H  HD11 . ILE   A 1 131 ? 4.897   18.423  -22.701 0   26.53  ? 821  ILE   A HD11 1 1 
ATOM   1883 H  HD12 . ILE   A 1 131 ? 5.582   17.989  -24.285 0   26.81  ? 821  ILE   A HD12 1 1 
ATOM   1884 H  HD13 . ILE   A 1 131 ? 4.19    17.082  -23.635 0   26.39  ? 821  ILE   A HD13 1 1 
ATOM   1885 N  N    . ALA   A 1 132 ? 8.862   13.742  -25.17  1   25.22  ? 822  ALA   A N    1 1 
ATOM   1886 C  CA   . ALA   A 1 132 ? 9.292   12.595  -25.972 1   26.06  ? 822  ALA   A CA   1 1 
ATOM   1887 C  C    . ALA   A 1 132 ? 10.423  11.817  -25.276 1   26.63  ? 822  ALA   A C    1 1 
ATOM   1888 O  O    . ALA   A 1 132 ? 10.496  10.599  -25.451 1   26.43  ? 822  ALA   A O    1 1 
ATOM   1889 C  CB   . ALA   A 1 132 ? 9.742   13.048  -27.352 1   26.14  ? 822  ALA   A CB   1 1 
ATOM   1890 H  H    . ALA   A 1 132 ? 9.011   14.637  -25.625 0   25.81  ? 822  ALA   A H    1 1 
ATOM   1891 H  HA   . ALA   A 1 132 ? 8.446   11.921  -26.103 0   26.24  ? 822  ALA   A HA   1 1 
ATOM   1892 H  HB1  . ALA   A 1 132 ? 10.052  12.177  -27.927 0   27.03  ? 822  ALA   A HB1  1 1 
ATOM   1893 H  HB2  . ALA   A 1 132 ? 8.91    13.546  -27.848 0   26.42  ? 822  ALA   A HB2  1 1 
ATOM   1894 H  HB3  . ALA   A 1 132 ? 10.575  13.74   -27.242 0   27.23  ? 822  ALA   A HB3  1 1 
ATOM   1895 N  N    . LYS   A 1 133 ? 11.287  12.511  -24.472 1   26.99  ? 823  LYS   A N    1 1 
ATOM   1896 C  CA   . LYS   A 1 133 ? 12.389  11.867  -23.734 1   28.36  ? 823  LYS   A CA   1 1 
ATOM   1897 C  C    . LYS   A 1 133 ? 11.857  11.001  -22.602 1   29.62  ? 823  LYS   A C    1 1 
ATOM   1898 O  O    . LYS   A 1 133 ? 12.319  9.871   -22.413 1   29.75  ? 823  LYS   A O    1 1 
ATOM   1899 C  CB   . LYS   A 1 133 ? 13.414  12.896  -23.19  1   29.26  ? 823  LYS   A CB   1 1 
ATOM   1900 C  CG   . LYS   A 1 133 ? 14.309  13.481  -24.264 1   31.25  ? 823  LYS   A CG   1 1 
ATOM   1901 C  CD   . LYS   A 1 133 ? 15.321  14.447  -23.696 1   35.08  ? 823  LYS   A CD   1 1 
ATOM   1902 C  CE   . LYS   A 1 133 ? 16.404  14.74   -24.714 1   37.16  ? 823  LYS   A CE   1 1 
ATOM   1903 N  NZ   . LYS   A 1 133 ? 17.235  15.912  -24.333 1   38.49  ? 823  LYS   A NZ   1 1 
ATOM   1904 H  H    . LYS   A 1 133 ? 11.248  13.515  -24.33  0   27.83  ? 823  LYS   A H    1 1 
ATOM   1905 H  HA   . LYS   A 1 133 ? 12.926  11.208  -24.412 0   29.88  ? 823  LYS   A HA   1 1 
ATOM   1906 H  HB2  . LYS   A 1 133 ? 12.888  13.716  -22.703 0   30.32  ? 823  LYS   A HB2  1 1 
ATOM   1907 H  HB3  . LYS   A 1 133 ? 14.053  12.398  -22.463 0   31.37  ? 823  LYS   A HB3  1 1 
ATOM   1908 H  HG2  . LYS   A 1 133 ? 14.843  12.671  -24.76  0   33.84  ? 823  LYS   A HG2  1 1 
ATOM   1909 H  HG3  . LYS   A 1 133 ? 13.697  14.022  -24.985 0   32.77  ? 823  LYS   A HG3  1 1 
ATOM   1910 H  HD2  . LYS   A 1 133 ? 14.821  15.377  -23.429 0   37.64  ? 823  LYS   A HD2  1 1 
ATOM   1911 H  HD3  . LYS   A 1 133 ? 15.79   14.002  -22.82  0   38.53  ? 823  LYS   A HD3  1 1 
ATOM   1912 H  HE2  . LYS   A 1 133 ? 17.061  13.876  -24.798 0   41.7   ? 823  LYS   A HE2  1 1 
ATOM   1913 H  HE3  . LYS   A 1 133 ? 15.942  14.954  -25.677 0   40.58  ? 823  LYS   A HE3  1 1 
ATOM   1914 H  HZ1  . LYS   A 1 133 ? 17.752  16.242  -25.142 0   43.8   ? 823  LYS   A HZ1  1 1 
ATOM   1915 H  HZ2  . LYS   A 1 133 ? 16.656  16.668  -23.98  0   42.78  ? 823  LYS   A HZ2  1 1 
ATOM   1916 H  HZ3  . LYS   A 1 133 ? 17.899  15.645  -23.613 0   44.03  ? 823  LYS   A HZ3  1 1 
ATOM   1917 N  N    . GLY   A 1 134 ? 10.904  11.536  -21.854 1   30.26  ? 824  GLY   A N    1 1 
ATOM   1918 C  CA   . GLY   A 1 134 ? 10.284  10.799  -20.766 1   31.56  ? 824  GLY   A CA   1 1 
ATOM   1919 C  C    . GLY   A 1 134 ? 9.478   9.62    -21.279 1   32.52  ? 824  GLY   A C    1 1 
ATOM   1920 O  O    . GLY   A 1 134 ? 9.537   8.531   -20.697 1   33.1   ? 824  GLY   A O    1 1 
ATOM   1921 H  H    . GLY   A 1 134 ? 10.548  12.481  -21.957 0   30.28  ? 824  GLY   A H    1 1 
ATOM   1922 H  HA2  . GLY   A 1 134 ? 11.06   10.417  -20.104 0   32.16  ? 824  GLY   A HA2  1 1 
ATOM   1923 H  HA3  . GLY   A 1 134 ? 9.657   11.474  -20.187 0   31.09  ? 824  GLY   A HA3  1 1 
ATOM   1924 N  N    . MET   A 1 135 ? 8.795   9.794   -22.424 1   32.28  ? 825  MET   A N    1 1 
ATOM   1925 C  CA   . MET   A 1 135 ? 8.028   8.706   -23.044 1   32.7   ? 825  MET   A CA   1 1 
ATOM   1926 C  C    . MET   A 1 135 ? 8.933   7.633   -23.625 1   33.33  ? 825  MET   A C    1 1 
ATOM   1927 O  O    . MET   A 1 135 ? 8.586   6.454   -23.571 1   33.39  ? 825  MET   A O    1 1 
ATOM   1928 C  CB   . MET   A 1 135 ? 7.102   9.239   -24.141 1   32.92  ? 825  MET   A CB   1 1 
ATOM   1929 C  CG   . MET   A 1 135 ? 5.913   10.04   -23.623 1   34.35  ? 825  MET   A CG   1 1 
ATOM   1930 S  SD   . MET   A 1 135 ? 4.967   9.239   -22.301 1   37.65  ? 825  MET   A SD   1 1 
ATOM   1931 C  CE   . MET   A 1 135 ? 4.196   7.931   -23.196 1   39.23  ? 825  MET   A CE   1 1 
ATOM   1932 H  H    . MET   A 1 135 ? 8.754   10.67   -22.935 0   31.38  ? 825  MET   A H    1 1 
ATOM   1933 H  HA   . MET   A 1 135 ? 7.428   8.225   -22.274 0   32     ? 825  MET   A HA   1 1 
ATOM   1934 H  HB2  . MET   A 1 135 ? 7.674   9.891   -24.799 0   31.75  ? 825  MET   A HB2  1 1 
ATOM   1935 H  HB3  . MET   A 1 135 ? 6.726   8.397   -24.72  0   31.73  ? 825  MET   A HB3  1 1 
ATOM   1936 H  HG2  . MET   A 1 135 ? 6.277   10.992  -23.238 0   32.23  ? 825  MET   A HG2  1 1 
ATOM   1937 H  HG3  . MET   A 1 135 ? 5.236   10.22   -24.457 0   32.05  ? 825  MET   A HG3  1 1 
ATOM   1938 H  HE1  . MET   A 1 135 ? 3.56    7.369   -22.515 0   37.84  ? 825  MET   A HE1  1 1 
ATOM   1939 H  HE2  . MET   A 1 135 ? 3.595   8.363   -23.995 0   37.27  ? 825  MET   A HE2  1 1 
ATOM   1940 H  HE3  . MET   A 1 135 ? 4.954   7.272   -23.615 0   38.06  ? 825  MET   A HE3  1 1 
ATOM   1941 N  N    . ASN   A 1 136 ? 10.095  8.017   -24.162 1   33.56  ? 826  ASN   A N    1 1 
ATOM   1942 C  CA   . ASN   A 1 136 ? 11.062  7.042   -24.66  1   34.24  ? 826  ASN   A CA   1 1 
ATOM   1943 C  C    . ASN   A 1 136 ? 11.578  6.203   -23.487 1   34.96  ? 826  ASN   A C    1 1 
ATOM   1944 O  O    . ASN   A 1 136 ? 11.688  4.986   -23.624 1   35.2   ? 826  ASN   A O    1 1 
ATOM   1945 C  CB   . ASN   A 1 136 ? 12.213  7.743   -25.354 1   35.08  ? 826  ASN   A CB   1 1 
ATOM   1946 C  CG   . ASN   A 1 136 ? 13.236  6.797   -25.924 1   37.65  ? 826  ASN   A CG   1 1 
ATOM   1947 O  OD1  . ASN   A 1 136 ? 12.926  5.981   -26.796 1   38.95  ? 826  ASN   A OD1  1 1 
ATOM   1948 N  ND2  . ASN   A 1 136 ? 14.47   6.871   -25.445 1   37.92  ? 826  ASN   A ND2  1 1 
ATOM   1949 H  H    . ASN   A 1 136 ? 10.392  8.98    -24.286 0   33.87  ? 826  ASN   A H    1 1 
ATOM   1950 H  HA   . ASN   A 1 136 ? 10.578  6.378   -25.376 0   35.71  ? 826  ASN   A HA   1 1 
ATOM   1951 H  HB2  . ASN   A 1 136 ? 11.802  8.311   -26.187 0   36.4   ? 826  ASN   A HB2  1 1 
ATOM   1952 H  HB3  . ASN   A 1 136 ? 12.692  8.413   -24.64  0   37.03  ? 826  ASN   A HB3  1 1 
ATOM   1953 H  HD21 . ASN   A 1 136 ? 15.182  6.247   -25.81  0   42.69  ? 826  ASN   A HD21 1 1 
ATOM   1954 H  HD22 . ASN   A 1 136 ? 14.715  7.537   -24.719 0   41.73  ? 826  ASN   A HD22 1 1 
ATOM   1955 N  N    . TYR   A 1 137 ? 11.846  6.842   -22.328 1   35.25  ? 827  TYR   A N    1 1 
ATOM   1956 C  CA   . TYR   A 1 137 ? 12.271  6.131   -21.122 1   36.14  ? 827  TYR   A CA   1 1 
ATOM   1957 C  C    . TYR   A 1 137 ? 11.185  5.136   -20.679 1   36.69  ? 827  TYR   A C    1 1 
ATOM   1958 O  O    . TYR   A 1 137 ? 11.512  4.003   -20.341 1   37.25  ? 827  TYR   A O    1 1 
ATOM   1959 C  CB   . TYR   A 1 137 ? 12.582  7.122   -19.978 1   36.57  ? 827  TYR   A CB   1 1 
ATOM   1960 C  CG   . TYR   A 1 137 ? 12.823  6.435   -18.651 1   37.89  ? 827  TYR   A CG   1 1 
ATOM   1961 C  CD1  . TYR   A 1 137 ? 13.939  5.633   -18.455 1   39.07  ? 827  TYR   A CD1  1 1 
ATOM   1962 C  CD2  . TYR   A 1 137 ? 11.88   6.494   -17.633 1   39.11  ? 827  TYR   A CD2  1 1 
ATOM   1963 C  CE1  . TYR   A 1 137 ? 14.126  4.931   -17.273 1   40.23  ? 827  TYR   A CE1  1 1 
ATOM   1964 C  CE2  . TYR   A 1 137 ? 12.067  5.812   -16.438 1   40.29  ? 827  TYR   A CE2  1 1 
ATOM   1965 C  CZ   . TYR   A 1 137 ? 13.201  5.043   -16.256 1   41.39  ? 827  TYR   A CZ   1 1 
ATOM   1966 O  OH   . TYR   A 1 137 ? 13.391  4.335   -15.093 1   43.33  ? 827  TYR   A OH   1 1 
ATOM   1967 H  H    . TYR   A 1 137 ? 11.798  7.848   -22.202 0   36.96  ? 827  TYR   A H    1 1 
ATOM   1968 H  HA   . TYR   A 1 137 ? 13.177  5.569   -21.344 0   39.9   ? 827  TYR   A HA   1 1 
ATOM   1969 H  HB2  . TYR   A 1 137 ? 13.479  7.684   -20.232 0   39.66  ? 827  TYR   A HB2  1 1 
ATOM   1970 H  HB3  . TYR   A 1 137 ? 11.742  7.805   -19.858 0   38.48  ? 827  TYR   A HB3  1 1 
ATOM   1971 H  HD1  . TYR   A 1 137 ? 14.67   5.543   -19.241 0   44.16  ? 827  TYR   A HD1  1 1 
ATOM   1972 H  HD2  . TYR   A 1 137 ? 10.996  7.094   -17.762 0   41.1   ? 827  TYR   A HD2  1 1 
ATOM   1973 H  HE1  . TYR   A 1 137 ? 15.012  4.334   -17.135 0   46.45  ? 827  TYR   A HE1  1 1 
ATOM   1974 H  HE2  . TYR   A 1 137 ? 11.329  5.89    -15.656 0   43.32  ? 827  TYR   A HE2  1 1 
ATOM   1975 H  HH   . TYR   A 1 137 ? 12.906  4.767   -14.342 0   48.14  ? 827  TYR   A HH   1 1 
ATOM   1976 N  N    . LEU   A 1 138 ? 9.907   5.552   -20.691 1   36.61  ? 828  LEU   A N    1 1 
ATOM   1977 C  CA   . LEU   A 1 138 ? 8.803   4.679   -20.298 1   36.96  ? 828  LEU   A CA   1 1 
ATOM   1978 C  C    . LEU   A 1 138 ? 8.655   3.521   -21.285 1   37.96  ? 828  LEU   A C    1 1 
ATOM   1979 O  O    . LEU   A 1 138 ? 8.363   2.407   -20.861 1   38.21  ? 828  LEU   A O    1 1 
ATOM   1980 C  CB   . LEU   A 1 138 ? 7.472   5.467   -20.177 1   36.64  ? 828  LEU   A CB   1 1 
ATOM   1981 C  CG   . LEU   A 1 138 ? 7.411   6.609   -19.133 1   37.24  ? 828  LEU   A CG   1 1 
ATOM   1982 C  CD1  . LEU   A 1 138 ? 6.095   7.358   -19.222 1   37.5   ? 828  LEU   A CD1  1 1 
ATOM   1983 C  CD2  . LEU   A 1 138 ? 7.631   6.116   -17.691 1   37.56  ? 828  LEU   A CD2  1 1 
ATOM   1984 H  H    . LEU   A 1 138 ? 9.616   6.478   -20.985 0   37.78  ? 828  LEU   A H    1 1 
ATOM   1985 H  HA   . LEU   A 1 138 ? 9.041   4.238   -19.331 0   39.22  ? 828  LEU   A HA   1 1 
ATOM   1986 H  HB2  . LEU   A 1 138 ? 7.263   5.919   -21.145 0   37.06  ? 828  LEU   A HB2  1 1 
ATOM   1987 H  HB3  . LEU   A 1 138 ? 6.685   4.752   -19.944 0   37.62  ? 828  LEU   A HB3  1 1 
ATOM   1988 H  HG   . LEU   A 1 138 ? 8.205   7.32    -19.358 0   37.55  ? 828  LEU   A HG   1 1 
ATOM   1989 H  HD11 . LEU   A 1 138 ? 6.084   8.15    -18.475 0   36.76  ? 828  LEU   A HD11 1 1 
ATOM   1990 H  HD12 . LEU   A 1 138 ? 6.003   7.786   -20.219 0   36.68  ? 828  LEU   A HD12 1 1 
ATOM   1991 H  HD13 . LEU   A 1 138 ? 5.277   6.662   -19.041 0   37.14  ? 828  LEU   A HD13 1 1 
ATOM   1992 H  HD21 . LEU   A 1 138 ? 7.52    6.964   -17.017 0   38.06  ? 828  LEU   A HD21 1 1 
ATOM   1993 H  HD22 . LEU   A 1 138 ? 6.886   5.36    -17.449 0   38.54  ? 828  LEU   A HD22 1 1 
ATOM   1994 H  HD23 . LEU   A 1 138 ? 8.632   5.704   -17.575 0   39.05  ? 828  LEU   A HD23 1 1 
ATOM   1995 N  N    . GLU   A 1 139 ? 8.877   3.763   -22.585 1   38.49  ? 829  GLU   A N    1 1 
ATOM   1996 C  CA   . GLU   A 1 139 ? 8.822   2.7     -23.584 1   39.53  ? 829  GLU   A CA   1 1 
ATOM   1997 C  C    . GLU   A 1 139 ? 9.926   1.668   -23.322 1   40.65  ? 829  GLU   A C    1 1 
ATOM   1998 O  O    . GLU   A 1 139 ? 9.659   0.474   -23.424 1   40.91  ? 829  GLU   A O    1 1 
ATOM   1999 C  CB   . GLU   A 1 139 ? 8.938   3.279   -25.004 1   41.35  ? 829  GLU   A CB   1 1 
ATOM   2000 C  CG   . GLU   A 1 139 ? 8.875   2.211   -26.085 1   45.1   ? 829  GLU   A CG   1 1 
ATOM   2001 C  CD   . GLU   A 1 139 ? 8.696   2.71    -27.503 1   49.78  ? 829  GLU   A CD   1 1 
ATOM   2002 O  OE1  . GLU   A 1 139 ? 8.726   3.943   -27.713 1   51.13  ? 829  GLU   A OE1  1 1 
ATOM   2003 O  OE2  . GLU   A 1 139 ? 8.53    1.862   -28.409 1   51.46  ? 829  GLU   A OE2  1 1 
ATOM   2004 H  H    . GLU   A 1 139 ? 9.075   4.675   -22.985 0   40.24  ? 829  GLU   A H    1 1 
ATOM   2005 H  HA   . GLU   A 1 139 ? 7.862   2.19    -23.508 0   42.39  ? 829  GLU   A HA   1 1 
ATOM   2006 H  HB2  . GLU   A 1 139 ? 8.114   3.974   -25.16  0   42.99  ? 829  GLU   A HB2  1 1 
ATOM   2007 H  HB3  . GLU   A 1 139 ? 9.89    3.8     -25.097 0   43.9   ? 829  GLU   A HB3  1 1 
ATOM   2008 H  HG2  . GLU   A 1 139 ? 9.805   1.645   -26.077 0   49.14  ? 829  GLU   A HG2  1 1 
ATOM   2009 H  HG3  . GLU   A 1 139 ? 8.045   1.543   -25.863 0   48.45  ? 829  GLU   A HG3  1 1 
ATOM   2010 N  N    . ASP   A 1 140 ? 11.151  2.115   -22.964 1   41.13  ? 830  ASP   A N    1 1 
ATOM   2011 C  CA   . ASP   A 1 140 ? 12.266  1.211   -22.644 1   41.87  ? 830  ASP   A CA   1 1 
ATOM   2012 C  C    . ASP   A 1 140 ? 11.945  0.309   -21.436 1   42.02  ? 830  ASP   A C    1 1 
ATOM   2013 O  O    . ASP   A 1 140 ? 12.389  -0.838  -21.4   1   41.89  ? 830  ASP   A O    1 1 
ATOM   2014 C  CB   . ASP   A 1 140 ? 13.558  2.008   -22.366 1   43.73  ? 830  ASP   A CB   1 1 
ATOM   2015 C  CG   . ASP   A 1 140 ? 14.203  2.638   -23.592 1   49.01  ? 830  ASP   A CG   1 1 
ATOM   2016 O  OD1  . ASP   A 1 140 ? 13.681  2.435   -24.713 1   50.2   ? 830  ASP   A OD1  1 1 
ATOM   2017 O  OD2  . ASP   A 1 140 ? 15.229  3.34    -23.43  1   51.02  ? 830  ASP   A OD2  1 1 
ATOM   2018 H  H    . ASP   A 1 140 ? 11.4    3.097   -22.901 0   45.09  ? 830  ASP   A H    1 1 
ATOM   2019 H  HA   . ASP   A 1 140 ? 12.443  0.552   -23.493 0   48.29  ? 830  ASP   A HA   1 1 
ATOM   2020 H  HB2  . ASP   A 1 140 ? 13.341  2.804   -21.655 0   49.23  ? 830  ASP   A HB2  1 1 
ATOM   2021 H  HB3  . ASP   A 1 140 ? 14.288  1.327   -21.931 0   50.93  ? 830  ASP   A HB3  1 1 
ATOM   2022 N  N    . ARG   A 1 141 ? 11.158  0.816   -20.468 1   41.88  ? 831  ARG   A N    1 1 
ATOM   2023 C  CA   . ARG   A 1 141 ? 10.747  0.043   -19.292 1   42.23  ? 831  ARG   A CA   1 1 
ATOM   2024 C  C    . ARG   A 1 141 ? 9.433   -0.744  -19.556 1   41.72  ? 831  ARG   A C    1 1 
ATOM   2025 O  O    . ARG   A 1 141 ? 8.78    -1.155  -18.599 1   41.9   ? 831  ARG   A O    1 1 
ATOM   2026 C  CB   . ARG   A 1 141 ? 10.553  0.989   -18.085 1   44.29  ? 831  ARG   A CB   1 1 
ATOM   2027 C  CG   . ARG   A 1 141 ? 11.707  1.979   -17.81  1   48.82  ? 831  ARG   A CG   1 1 
ATOM   2028 C  CD   . ARG   A 1 141 ? 13.064  1.332   -17.573 1   53.56  ? 831  ARG   A CD   1 1 
ATOM   2029 N  NE   . ARG   A 1 141 ? 13.003  0.305   -16.529 1   57.69  ? 831  ARG   A NE   1 1 
ATOM   2030 C  CZ   . ARG   A 1 141 ? 13.043  0.53    -15.216 1   60.56  ? 831  ARG   A CZ   1 1 
ATOM   2031 N  NH1  . ARG   A 1 141 ? 13.178  1.767   -14.747 1   60.48  ? 831  ARG   A NH1  1 1 
ATOM   2032 N  NH2  . ARG   A 1 141 ? 12.965  -0.481  -14.362 1   60.77  ? 831  ARG   A NH2  1 1 
ATOM   2033 H  H    . ARG   A 1 141 ? 10.763  1.751   -20.487 0   46.6   ? 831  ARG   A H    1 1 
ATOM   2034 H  HA   . ARG   A 1 141 ? 11.512  -0.687  -19.031 0   49.43  ? 831  ARG   A HA   1 1 
ATOM   2035 H  HB2  . ARG   A 1 141 ? 9.658   1.583   -18.26  0   48.77  ? 831  ARG   A HB2  1 1 
ATOM   2036 H  HB3  . ARG   A 1 141 ? 10.411  0.388   -17.188 0   50.18  ? 831  ARG   A HB3  1 1 
ATOM   2037 H  HG2  . ARG   A 1 141 ? 11.803  2.667   -18.649 0   53.63  ? 831  ARG   A HG2  1 1 
ATOM   2038 H  HG3  . ARG   A 1 141 ? 11.461  2.54    -16.91  0   53.68  ? 831  ARG   A HG3  1 1 
ATOM   2039 H  HD2  . ARG   A 1 141 ? 13.402  0.847   -18.488 0   60.73  ? 831  ARG   A HD2  1 1 
ATOM   2040 H  HD3  . ARG   A 1 141 ? 13.793  2.096   -17.305 0   60.23  ? 831  ARG   A HD3  1 1 
ATOM   2041 H  HE   . ARG   A 1 141 ? 12.899  -0.655  -16.841 0   65.94  ? 831  ARG   A HE   1 1 
ATOM   2042 H  HH11 . ARG   A 1 141 ? 13.224  2.591   -15.336 0   66.7   ? 831  ARG   A HH11 1 1 
ATOM   2043 H  HH12 . ARG   A 1 141 ? 13.204  1.906   -13.742 0   67.34  ? 831  ARG   A HH12 1 1 
ATOM   2044 H  HH21 . ARG   A 1 141 ? 12.878  -1.433  -14.706 0   69.94  ? 831  ARG   A HH21 1 1 
ATOM   2045 H  HH22 . ARG   A 1 141 ? 13.011  -0.312  -13.363 0   69.25  ? 831  ARG   A HH22 1 1 
ATOM   2046 N  N    . ARG   A 1 142 ? 9.055   -0.95   -20.842 1   40.96  ? 832  ARG   A N    1 1 
ATOM   2047 C  CA   . ARG   A 1 142 ? 7.846   -1.655  -21.27  1   40.85  ? 832  ARG   A CA   1 1 
ATOM   2048 C  C    . ARG   A 1 142 ? 6.582   -1.102  -20.608 1   40.23  ? 832  ARG   A C    1 1 
ATOM   2049 O  O    . ARG   A 1 142 ? 5.675   -1.863  -20.287 1   40.37  ? 832  ARG   A O    1 1 
ATOM   2050 C  CB   . ARG   A 1 142 ? 7.988   -3.162  -21.021 1   42.43  ? 832  ARG   A CB   1 1 
ATOM   2051 C  CG   . ARG   A 1 142 ? 9.293   -3.751  -21.564 1   45.39  ? 832  ARG   A CG   1 1 
ATOM   2052 C  CD   . ARG   A 1 142 ? 9.36    -5.262  -21.426 1   48.18  ? 832  ARG   A CD   1 1 
ATOM   2053 N  NE   . ARG   A 1 142 ? 8.255   -5.945  -22.105 1   50.82  ? 832  ARG   A NE   1 1 
ATOM   2054 C  CZ   . ARG   A 1 142 ? 8.153   -6.149  -23.42  1   53.26  ? 832  ARG   A CZ   1 1 
ATOM   2055 N  NH1  . ARG   A 1 142 ? 9.101   -5.714  -24.247 1   52.87  ? 832  ARG   A NH1  1 1 
ATOM   2056 N  NH2  . ARG   A 1 142 ? 7.1     -6.781  -23.919 1   53.57  ? 832  ARG   A NH2  1 1 
ATOM   2057 H  H    . ARG   A 1 142 ? 9.595   -0.64   -21.644 0   46.92  ? 832  ARG   A H    1 1 
ATOM   2058 H  HA   . ARG   A 1 142 ? 7.737   -1.519  -22.345 0   46.81  ? 832  ARG   A HA   1 1 
ATOM   2059 H  HB2  . ARG   A 1 142 ? 7.954   -3.351  -19.949 0   50.47  ? 832  ARG   A HB2  1 1 
ATOM   2060 H  HB3  . ARG   A 1 142 ? 7.157   -3.665  -21.511 0   50.46  ? 832  ARG   A HB3  1 1 
ATOM   2061 H  HG2  . ARG   A 1 142 ? 9.378   -3.507  -22.622 0   53.97  ? 832  ARG   A HG2  1 1 
ATOM   2062 H  HG3  . ARG   A 1 142 ? 10.14   -3.341  -21.016 0   54.19  ? 832  ARG   A HG3  1 1 
ATOM   2063 H  HD2  . ARG   A 1 142 ? 10.303  -5.62   -21.836 0   59.54  ? 832  ARG   A HD2  1 1 
ATOM   2064 H  HD3  . ARG   A 1 142 ? 9.302   -5.514  -20.368 0   59.1   ? 832  ARG   A HD3  1 1 
ATOM   2065 H  HE   . ARG   A 1 142 ? 7.509   -6.299  -21.513 0   61.93  ? 832  ARG   A HE   1 1 
ATOM   2066 H  HH11 . ARG   A 1 142 ? 9.925   -5.217  -23.928 0   63.53  ? 832  ARG   A HH11 1 1 
ATOM   2067 H  HH12 . ARG   A 1 142 ? 8.993   -5.875  -25.244 0   63.9   ? 832  ARG   A HH12 1 1 
ATOM   2068 H  HH21 . ARG   A 1 142 ? 6.372   -7.122  -23.298 0   65.34  ? 832  ARG   A HH21 1 1 
ATOM   2069 H  HH22 . ARG   A 1 142 ? 7.018   -6.938  -24.918 0   65.24  ? 832  ARG   A HH22 1 1 
ATOM   2070 N  N    . LEU   A 1 143 ? 6.509   0.224   -20.429 1   39.22  ? 833  LEU   A N    1 1 
ATOM   2071 C  CA   . LEU   A 1 143 ? 5.38    0.852   -19.76  1   38.52  ? 833  LEU   A CA   1 1 
ATOM   2072 C  C    . LEU   A 1 143 ? 4.534   1.65    -20.753 1   37.83  ? 833  LEU   A C    1 1 
ATOM   2073 O  O    . LEU   A 1 143 ? 5.057   2.535   -21.437 1   38.02  ? 833  LEU   A O    1 1 
ATOM   2074 C  CB   . LEU   A 1 143 ? 5.92    1.766   -18.628 1   38.51  ? 833  LEU   A CB   1 1 
ATOM   2075 C  CG   . LEU   A 1 143 ? 4.947   2.398   -17.592 1   39.61  ? 833  LEU   A CG   1 1 
ATOM   2076 C  CD1  . LEU   A 1 143 ? 4.272   3.644   -18.12  1   39.96  ? 833  LEU   A CD1  1 1 
ATOM   2077 C  CD2  . LEU   A 1 143 ? 3.933   1.408   -17.061 1   40.36  ? 833  LEU   A CD2  1 1 
ATOM   2078 H  H    . LEU   A 1 143 ? 7.205   0.889   -20.749 0   43.05  ? 833  LEU   A H    1 1 
ATOM   2079 H  HA   . LEU   A 1 143 ? 4.758   0.074   -19.323 0   42.51  ? 833  LEU   A HA   1 1 
ATOM   2080 H  HB2  . LEU   A 1 143 ? 6.64    1.182   -18.057 0   42.16  ? 833  LEU   A HB2  1 1 
ATOM   2081 H  HB3  . LEU   A 1 143 ? 6.45    2.589   -19.107 0   40.94  ? 833  LEU   A HB3  1 1 
ATOM   2082 H  HG   . LEU   A 1 143 ? 5.544   2.712   -16.738 0   42.01  ? 833  LEU   A HG   1 1 
ATOM   2083 H  HD11 . LEU   A 1 143 ? 3.687   4.097   -17.322 0   41.01  ? 833  LEU   A HD11 1 1 
ATOM   2084 H  HD12 . LEU   A 1 143 ? 5.036   4.351   -18.434 0   40.9   ? 833  LEU   A HD12 1 1 
ATOM   2085 H  HD13 . LEU   A 1 143 ? 3.634   3.382   -18.963 0   41.26  ? 833  LEU   A HD13 1 1 
ATOM   2086 H  HD21 . LEU   A 1 143 ? 3.348   1.895   -16.286 0   43.03  ? 833  LEU   A HD21 1 1 
ATOM   2087 H  HD22 . LEU   A 1 143 ? 3.256   1.079   -17.848 0   43.51  ? 833  LEU   A HD22 1 1 
ATOM   2088 H  HD23 . LEU   A 1 143 ? 4.458   0.555   -16.633 0   44.2   ? 833  LEU   A HD23 1 1 
ATOM   2089 N  N    . VAL   A 1 144 ? 3.226   1.336   -20.829 1   36.67  ? 834  VAL   A N    1 1 
ATOM   2090 C  CA   . VAL   A 1 144 ? 2.289   2.053   -21.692 1   36     ? 834  VAL   A CA   1 1 
ATOM   2091 C  C    . VAL   A 1 144 ? 1.563   3.003   -20.741 1   34.74  ? 834  VAL   A C    1 1 
ATOM   2092 O  O    . VAL   A 1 144 ? 0.878   2.544   -19.829 1   34.89  ? 834  VAL   A O    1 1 
ATOM   2093 C  CB   . VAL   A 1 144 ? 1.314   1.113   -22.446 1   36.85  ? 834  VAL   A CB   1 1 
ATOM   2094 C  CG1  . VAL   A 1 144 ? 0.466   1.886   -23.448 1   37.48  ? 834  VAL   A CG1  1 1 
ATOM   2095 C  CG2  . VAL   A 1 144 ? 2.07    0.017   -23.173 1   37.64  ? 834  VAL   A CG2  1 1 
ATOM   2096 H  H    . VAL   A 1 144 ? 2.788   0.598   -20.286 0   39.92  ? 834  VAL   A H    1 1 
ATOM   2097 H  HA   . VAL   A 1 144 ? 2.827   2.638   -22.436 0   37.47  ? 834  VAL   A HA   1 1 
ATOM   2098 H  HB   . VAL   A 1 144 ? 0.643   0.641   -21.73  0   39.9   ? 834  VAL   A HB   1 1 
ATOM   2099 H  HG11 . VAL   A 1 144 ? -0.203  1.188   -23.949 0   39.99  ? 834  VAL   A HG11 1 1 
ATOM   2100 H  HG12 . VAL   A 1 144 ? -0.11   2.659   -22.943 0   38.88  ? 834  VAL   A HG12 1 1 
ATOM   2101 H  HG13 . VAL   A 1 144 ? 1.129   2.348   -24.178 0   38.95  ? 834  VAL   A HG13 1 1 
ATOM   2102 H  HG21 . VAL   A 1 144 ? 1.351   -0.611  -23.698 0   41.7   ? 834  VAL   A HG21 1 1 
ATOM   2103 H  HG22 . VAL   A 1 144 ? 2.755   0.469   -23.888 0   40.73  ? 834  VAL   A HG22 1 1 
ATOM   2104 H  HG23 . VAL   A 1 144 ? 2.623   -0.582  -22.452 0   41.73  ? 834  VAL   A HG23 1 1 
ATOM   2105 N  N    . HIS   A 1 145 ? 1.778   4.312   -20.905 1   33.18  ? 835  HIS   A N    1 1 
ATOM   2106 C  CA   . HIS   A 1 145 ? 1.196   5.335   -20.039 1   32.22  ? 835  HIS   A CA   1 1 
ATOM   2107 C  C    . HIS   A 1 145 ? -0.342  5.379   -20.121 1   31.27  ? 835  HIS   A C    1 1 
ATOM   2108 O  O    . HIS   A 1 145 ? -0.981  5.539   -19.085 1   30.96  ? 835  HIS   A O    1 1 
ATOM   2109 C  CB   . HIS   A 1 145 ? 1.805   6.709   -20.381 1   32.45  ? 835  HIS   A CB   1 1 
ATOM   2110 C  CG   . HIS   A 1 145 ? 1.482   7.791   -19.399 1   33.04  ? 835  HIS   A CG   1 1 
ATOM   2111 N  ND1  . HIS   A 1 145 ? 0.233   8.373   -19.357 1   34.1   ? 835  HIS   A ND1  1 1 
ATOM   2112 C  CD2  . HIS   A 1 145 ? 2.279   8.403   -18.493 1   33.73  ? 835  HIS   A CD2  1 1 
ATOM   2113 C  CE1  . HIS   A 1 145 ? 0.289   9.289   -18.406 1   34.65  ? 835  HIS   A CE1  1 1 
ATOM   2114 N  NE2  . HIS   A 1 145 ? 1.506   9.351   -17.865 1   34.53  ? 835  HIS   A NE2  1 1 
ATOM   2115 H  H    . HIS   A 1 145 ? 2.347   4.694   -21.654 0   33.21  ? 835  HIS   A H    1 1 
ATOM   2116 H  HA   . HIS   A 1 145 ? 1.462   5.107   -19.008 0   32.25  ? 835  HIS   A HA   1 1 
ATOM   2117 H  HB2  . HIS   A 1 145 ? 2.889   6.614   -20.412 0   31.54  ? 835  HIS   A HB2  1 1 
ATOM   2118 H  HB3  . HIS   A 1 145 ? 1.435   7.025   -21.355 0   31.14  ? 835  HIS   A HB3  1 1 
ATOM   2119 H  HD2  . HIS   A 1 145 ? 3.317   8.189   -18.304 0   32.38  ? 835  HIS   A HD2  1 1 
ATOM   2120 H  HE1  . HIS   A 1 145 ? -0.542  9.906   -18.109 0   32.53  ? 835  HIS   A HE1  1 1 
ATOM   2121 H  HE2  . HIS   A 1 145 ? 1.808   9.983   -17.13  0   32.51  ? 835  HIS   A HE2  1 1 
ATOM   2122 N  N    . ARG   A 1 146 ? -0.925  5.29    -21.338 1   30.71  ? 836  ARG   A N    1 1 
ATOM   2123 C  CA   . ARG   A 1 146 ? -2.384  5.305   -21.597 1   30.68  ? 836  ARG   A CA   1 1 
ATOM   2124 C  C    . ARG   A 1 146 ? -3.123  6.619   -21.234 1   30.4   ? 836  ARG   A C    1 1 
ATOM   2125 O  O    . ARG   A 1 146 ? -4.291  6.755   -21.605 1   30.28  ? 836  ARG   A O    1 1 
ATOM   2126 C  CB   . ARG   A 1 146 ? -3.098  4.117   -20.928 1   31.94  ? 836  ARG   A CB   1 1 
ATOM   2127 C  CG   . ARG   A 1 146 ? -2.564  2.762   -21.384 1   35.17  ? 836  ARG   A CG   1 1 
ATOM   2128 C  CD   . ARG   A 1 146 ? -3.247  1.598   -20.7   1   37.82  ? 836  ARG   A CD   1 1 
ATOM   2129 N  NE   . ARG   A 1 146 ? -4.696  1.599   -20.937 1   39.85  ? 836  ARG   A NE   1 1 
ATOM   2130 C  CZ   . ARG   A 1 146 ? -5.671  1.518   -20.026 1   41.9   ? 836  ARG   A CZ   1 1 
ATOM   2131 N  NH1  . ARG   A 1 146 ? -5.384  1.414   -18.729 1   41.48  ? 836  ARG   A NH1  1 1 
ATOM   2132 N  NH2  . ARG   A 1 146 ? -6.94   1.533   -20.405 1   41.72  ? 836  ARG   A NH2  1 1 
ATOM   2133 H  H    . ARG   A 1 146 ? -0.394  5.214   -22.199 0   30.42  ? 836  ARG   A H    1 1 
ATOM   2134 H  HA   . ARG   A 1 146 ? -2.52   5.165   -22.668 0   30.64  ? 836  ARG   A HA   1 1 
ATOM   2135 H  HB2  . ARG   A 1 146 ? -2.974  4.18    -19.848 0   32.98  ? 836  ARG   A HB2  1 1 
ATOM   2136 H  HB3  . ARG   A 1 146 ? -4.156  4.167   -21.177 0   33.2   ? 836  ARG   A HB3  1 1 
ATOM   2137 H  HG2  . ARG   A 1 146 ? -2.7    2.666   -22.46  0   37.02  ? 836  ARG   A HG2  1 1 
ATOM   2138 H  HG3  . ARG   A 1 146 ? -1.507  2.692   -21.133 0   36.84  ? 836  ARG   A HG3  1 1 
ATOM   2139 H  HD2  . ARG   A 1 146 ? -2.852  0.681   -21.133 0   41.5   ? 836  ARG   A HD2  1 1 
ATOM   2140 H  HD3  . ARG   A 1 146 ? -2.977  1.644   -19.647 0   40.87  ? 836  ARG   A HD3  1 1 
ATOM   2141 H  HE   . ARG   A 1 146 ? -4.983  1.679   -21.907 0   43.28  ? 836  ARG   A HE   1 1 
ATOM   2142 H  HH11 . ARG   A 1 146 ? -4.451  1.388   -18.336 0   45.28  ? 836  ARG   A HH11 1 1 
ATOM   2143 H  HH12 . ARG   A 1 146 ? -6.155  1.352   -18.071 0   46.06  ? 836  ARG   A HH12 1 1 
ATOM   2144 H  HH21 . ARG   A 1 146 ? -7.177  1.61    -21.389 0   46.22  ? 836  ARG   A HH21 1 1 
ATOM   2145 H  HH22 . ARG   A 1 146 ? -7.682  1.468   -19.715 0   46.77  ? 836  ARG   A HH22 1 1 
ATOM   2146 N  N    . ASP   A 1 147 ? -2.458  7.601   -20.59  1   29.94  ? 837  ASP   A N    1 1 
ATOM   2147 C  CA   . ASP   A 1 147 ? -3.12   8.851   -20.238 1   30.32  ? 837  ASP   A CA   1 1 
ATOM   2148 C  C    . ASP   A 1 147 ? -2.259  10.086  -20.523 1   30.18  ? 837  ASP   A C    1 1 
ATOM   2149 O  O    . ASP   A 1 147 ? -2.362  11.076  -19.794 1   30.55  ? 837  ASP   A O    1 1 
ATOM   2150 C  CB   . ASP   A 1 147 ? -3.535  8.813   -18.761 1   32.13  ? 837  ASP   A CB   1 1 
ATOM   2151 C  CG   . ASP   A 1 147 ? -4.734  9.676   -18.405 1   36.55  ? 837  ASP   A CG   1 1 
ATOM   2152 O  OD1  . ASP   A 1 147 ? -5.253  10.388  -19.304 1   36.72  ? 837  ASP   A OD1  1 1 
ATOM   2153 O  OD2  . ASP   A 1 147 ? -5.128  9.677   -17.223 1   39.03  ? 837  ASP   A OD2  1 1 
ATOM   2154 H  H    . ASP   A 1 147 ? -1.484  7.571   -20.306 0   28.64  ? 837  ASP   A H    1 1 
ATOM   2155 H  HA   . ASP   A 1 147 ? -4.012  8.957   -20.853 0   29.24  ? 837  ASP   A HA   1 1 
ATOM   2156 H  HB2  . ASP   A 1 147 ? -3.767  7.781   -18.503 0   31.42  ? 837  ASP   A HB2  1 1 
ATOM   2157 H  HB3  . ASP   A 1 147 ? -2.698  9.142   -18.148 0   30.6   ? 837  ASP   A HB3  1 1 
ATOM   2158 N  N    . LEU   A 1 148 ? -1.454  10.06   -21.598 1   29.32  ? 838  LEU   A N    1 1 
ATOM   2159 C  CA   . LEU   A 1 148 ? -0.618  11.211  -21.924 1   28.83  ? 838  LEU   A CA   1 1 
ATOM   2160 C  C    . LEU   A 1 148 ? -1.494  12.355  -22.483 1   28.08  ? 838  LEU   A C    1 1 
ATOM   2161 O  O    . LEU   A 1 148 ? -2.245  12.163  -23.441 1   27.58  ? 838  LEU   A O    1 1 
ATOM   2162 C  CB   . LEU   A 1 148 ? 0.504   10.821  -22.894 1   28.86  ? 838  LEU   A CB   1 1 
ATOM   2163 C  CG   . LEU   A 1 148 ? 1.494   11.914  -23.349 1   30.13  ? 838  LEU   A CG   1 1 
ATOM   2164 C  CD1  . LEU   A 1 148 ? 2.19    12.636  -22.179 1   29.89  ? 838  LEU   A CD1  1 1 
ATOM   2165 C  CD2  . LEU   A 1 148 ? 2.549   11.311  -24.199 1   31.11  ? 838  LEU   A CD2  1 1 
ATOM   2166 H  H    . LEU   A 1 148 ? -1.367  9.288   -22.25  0   28.42  ? 838  LEU   A H    1 1 
ATOM   2167 H  HA   . LEU   A 1 148 ? -0.153  11.542  -20.997 0   27.76  ? 838  LEU   A HA   1 1 
ATOM   2168 H  HB2  . LEU   A 1 148 ? 1.094   10.039  -22.419 0   27.93  ? 838  LEU   A HB2  1 1 
ATOM   2169 H  HB3  . LEU   A 1 148 ? 0.042   10.421  -23.795 0   27.96  ? 838  LEU   A HB3  1 1 
ATOM   2170 H  HG   . LEU   A 1 148 ? 0.974   12.65   -23.959 0   28.9   ? 838  LEU   A HG   1 1 
ATOM   2171 H  HD11 . LEU   A 1 148 ? 2.897   13.357  -22.588 0   28.79  ? 838  LEU   A HD11 1 1 
ATOM   2172 H  HD12 . LEU   A 1 148 ? 1.46    13.163  -21.567 0   28.62  ? 838  LEU   A HD12 1 1 
ATOM   2173 H  HD13 . LEU   A 1 148 ? 2.723   11.901  -21.579 0   28.82  ? 838  LEU   A HD13 1 1 
ATOM   2174 H  HD21 . LEU   A 1 148 ? 3.215   12.093  -24.558 0   29.94  ? 838  LEU   A HD21 1 1 
ATOM   2175 H  HD22 . LEU   A 1 148 ? 3.105   10.592  -23.6   0   29.97  ? 838  LEU   A HD22 1 1 
ATOM   2176 H  HD23 . LEU   A 1 148 ? 2.068   10.807  -25.036 0   29.9   ? 838  LEU   A HD23 1 1 
ATOM   2177 N  N    . ALA   A 1 149 ? -1.431  13.518  -21.821 1   27.34  ? 839  ALA   A N    1 1 
ATOM   2178 C  CA   . ALA   A 1 149 ? -2.178  14.735  -22.177 1   27.49  ? 839  ALA   A CA   1 1 
ATOM   2179 C  C    . ALA   A 1 149 ? -1.53   15.94   -21.465 1   27.38  ? 839  ALA   A C    1 1 
ATOM   2180 O  O    . ALA   A 1 149 ? -0.773  15.736  -20.506 1   27.47  ? 839  ALA   A O    1 1 
ATOM   2181 C  CB   . ALA   A 1 149 ? -3.64   14.596  -21.757 1   27.72  ? 839  ALA   A CB   1 1 
ATOM   2182 H  H    . ALA   A 1 149 ? -0.858  13.637  -20.991 0   26.43  ? 839  ALA   A H    1 1 
ATOM   2183 H  HA   . ALA   A 1 149 ? -2.144  14.897  -23.254 0   26.65  ? 839  ALA   A HA   1 1 
ATOM   2184 H  HB1  . ALA   A 1 149 ? -4.175  15.518  -21.98  0   26.98  ? 839  ALA   A HB1  1 1 
ATOM   2185 H  HB2  . ALA   A 1 149 ? -4.082  13.765  -22.304 0   27.13  ? 839  ALA   A HB2  1 1 
ATOM   2186 H  HB3  . ALA   A 1 149 ? -3.671  14.384  -20.69  0   26.94  ? 839  ALA   A HB3  1 1 
ATOM   2187 N  N    . ALA   A 1 150 ? -1.816  17.179  -21.899 1   26.82  ? 840  ALA   A N    1 1 
ATOM   2188 C  CA   . ALA   A 1 150 ? -1.208  18.353  -21.267 1   27.3   ? 840  ALA   A CA   1 1 
ATOM   2189 C  C    . ALA   A 1 150 ? -1.555  18.447  -19.779 1   27.21  ? 840  ALA   A C    1 1 
ATOM   2190 O  O    . ALA   A 1 150 ? -0.734  18.939  -19.005 1   26.9   ? 840  ALA   A O    1 1 
ATOM   2191 C  CB   . ALA   A 1 150 ? -1.613  19.624  -21.994 1   27.71  ? 840  ALA   A CB   1 1 
ATOM   2192 H  H    . ALA   A 1 150 ? -2.449  17.394  -22.664 0   26.03  ? 840  ALA   A H    1 1 
ATOM   2193 H  HA   . ALA   A 1 150 ? -0.126  18.265  -21.347 0   26.3   ? 840  ALA   A HA   1 1 
ATOM   2194 H  HB1  . ALA   A 1 150 ? -1.149  20.477  -21.501 0   26.58  ? 840  ALA   A HB1  1 1 
ATOM   2195 H  HB2  . ALA   A 1 150 ? -1.279  19.562  -23.028 0   26.66  ? 840  ALA   A HB2  1 1 
ATOM   2196 H  HB3  . ALA   A 1 150 ? -2.698  19.714  -21.958 0   26.74  ? 840  ALA   A HB3  1 1 
ATOM   2197 N  N    . ARG   A 1 151 ? -2.766  17.964  -19.381 1   27.08  ? 841  ARG   A N    1 1 
ATOM   2198 C  CA   . ARG   A 1 151 ? -3.202  17.904  -17.978 1   27.3   ? 841  ARG   A CA   1 1 
ATOM   2199 C  C    . ARG   A 1 151 ? -2.299  16.992  -17.1   1   27.63  ? 841  ARG   A C    1 1 
ATOM   2200 O  O    . ARG   A 1 151 ? -2.268  17.176  -15.884 1   27.57  ? 841  ARG   A O    1 1 
ATOM   2201 C  CB   . ARG   A 1 151 ? -4.682  17.475  -17.867 1   28.53  ? 841  ARG   A CB   1 1 
ATOM   2202 C  CG   . ARG   A 1 151 ? -4.949  16.036  -18.295 1   30.98  ? 841  ARG   A CG   1 1 
ATOM   2203 C  CD   . ARG   A 1 151 ? -6.392  15.576  -18.184 1   32.48  ? 841  ARG   A CD   1 1 
ATOM   2204 N  NE   . ARG   A 1 151 ? -6.508  14.262  -18.816 1   32.66  ? 841  ARG   A NE   1 1 
ATOM   2205 C  CZ   . ARG   A 1 151 ? -6.761  14.028  -20.105 1   31.87  ? 841  ARG   A CZ   1 1 
ATOM   2206 N  NH1  . ARG   A 1 151 ? -7.003  15.034  -20.941 1   30.18  ? 841  ARG   A NH1  1 1 
ATOM   2207 N  NH2  . ARG   A 1 151 ? -6.786  12.784  -20.565 1   30.25  ? 841  ARG   A NH2  1 1 
ATOM   2208 H  H    . ARG   A 1 151 ? -3.479  17.657  -20.034 0   26.33  ? 841  ARG   A H    1 1 
ATOM   2209 H  HA   . ARG   A 1 151 ? -3.133  18.909  -17.564 0   26.37  ? 841  ARG   A HA   1 1 
ATOM   2210 H  HB2  . ARG   A 1 151 ? -5.002  17.584  -16.831 0   27.72  ? 841  ARG   A HB2  1 1 
ATOM   2211 H  HB3  . ARG   A 1 151 ? -5.281  18.123  -18.505 0   27.75  ? 841  ARG   A HB3  1 1 
ATOM   2212 H  HG2  . ARG   A 1 151 ? -4.668  15.943  -19.342 0   29.71  ? 841  ARG   A HG2  1 1 
ATOM   2213 H  HG3  . ARG   A 1 151 ? -4.359  15.351  -17.689 0   29.59  ? 841  ARG   A HG3  1 1 
ATOM   2214 H  HD2  . ARG   A 1 151 ? -6.624  15.445  -17.129 0   30.75  ? 841  ARG   A HD2  1 1 
ATOM   2215 H  HD3  . ARG   A 1 151 ? -7.077  16.305  -18.614 0   30.9   ? 841  ARG   A HD3  1 1 
ATOM   2216 H  HE   . ARG   A 1 151 ? -6.317  13.458  -18.228 0   30.94  ? 841  ARG   A HE   1 1 
ATOM   2217 H  HH11 . ARG   A 1 151 ? -6.964  16.014  -20.679 0   29.35  ? 841  ARG   A HH11 1 1 
ATOM   2218 H  HH12 . ARG   A 1 151 ? -7.182  14.813  -21.914 0   29.56  ? 841  ARG   A HH12 1 1 
ATOM   2219 H  HH21 . ARG   A 1 151 ? -6.628  12.007  -19.932 0   29.59  ? 841  ARG   A HH21 1 1 
ATOM   2220 H  HH22 . ARG   A 1 151 ? -7.008  12.6    -21.538 0   29.7   ? 841  ARG   A HH22 1 1 
ATOM   2221 N  N    . ASN   A 1 152 ? -1.585  16.013  -17.709 1   27.7   ? 842  ASN   A N    1 1 
ATOM   2222 C  CA   . ASN   A 1 152 ? -0.68   15.1    -17.007 1   28.13  ? 842  ASN   A CA   1 1 
ATOM   2223 C  C    . ASN   A 1 152 ? 0.806   15.347  -17.351 1   28.8   ? 842  ASN   A C    1 1 
ATOM   2224 O  O    . ASN   A 1 152 ? 1.599   14.411  -17.42  1   28.81  ? 842  ASN   A O    1 1 
ATOM   2225 C  CB   . ASN   A 1 152 ? -1.078  13.655  -17.278 1   28.3   ? 842  ASN   A CB   1 1 
ATOM   2226 C  CG   . ASN   A 1 152 ? -2.47   13.353  -16.799 1   30.02  ? 842  ASN   A CG   1 1 
ATOM   2227 O  OD1  . ASN   A 1 152 ? -2.883  13.783  -15.716 1   30.72  ? 842  ASN   A OD1  1 1 
ATOM   2228 N  ND2  . ASN   A 1 152 ? -3.24   12.616  -17.58  1   30.16  ? 842  ASN   A ND2  1 1 
ATOM   2229 H  H    . ASN   A 1 152 ? -1.626  15.812  -18.703 0   26.72  ? 842  ASN   A H    1 1 
ATOM   2230 H  HA   . ASN   A 1 152 ? -0.762  15.253  -15.932 0   27.05  ? 842  ASN   A HA   1 1 
ATOM   2231 H  HB2  . ASN   A 1 152 ? -1.014  13.47   -18.349 0   27.26  ? 842  ASN   A HB2  1 1 
ATOM   2232 H  HB3  . ASN   A 1 152 ? -0.406  12.987  -16.743 0   27.26  ? 842  ASN   A HB3  1 1 
ATOM   2233 H  HD21 . ASN   A 1 152 ? -4.185  12.394  -17.282 0   29.05  ? 842  ASN   A HD21 1 1 
ATOM   2234 H  HD22 . ASN   A 1 152 ? -2.9    12.267  -18.47  0   28.88  ? 842  ASN   A HD22 1 1 
ATOM   2235 N  N    . VAL   A 1 153 ? 1.166   16.608  -17.57  1   29.29  ? 843  VAL   A N    1 1 
ATOM   2236 C  CA   . VAL   A 1 153 ? 2.547   17.059  -17.79  1   30.32  ? 843  VAL   A CA   1 1 
ATOM   2237 C  C    . VAL   A 1 153 ? 2.683   18.252  -16.838 1   31.57  ? 843  VAL   A C    1 1 
ATOM   2238 O  O    . VAL   A 1 153 ? 1.835   19.148  -16.876 1   31.96  ? 843  VAL   A O    1 1 
ATOM   2239 C  CB   . VAL   A 1 153 ? 2.857   17.464  -19.254 1   30.7   ? 843  VAL   A CB   1 1 
ATOM   2240 C  CG1  . VAL   A 1 153 ? 4.304   17.938  -19.387 1   31.18  ? 843  VAL   A CG1  1 1 
ATOM   2241 C  CG2  . VAL   A 1 153 ? 2.592   16.317  -20.227 1   30.8   ? 843  VAL   A CG2  1 1 
ATOM   2242 H  H    . VAL   A 1 153 ? 0.503   17.375  -17.619 0   27.93  ? 843  VAL   A H    1 1 
ATOM   2243 H  HA   . VAL   A 1 153 ? 3.257   16.291  -17.488 0   28.98  ? 843  VAL   A HA   1 1 
ATOM   2244 H  HB   . VAL   A 1 153 ? 2.21    18.293  -19.536 0   29.11  ? 843  VAL   A HB   1 1 
ATOM   2245 H  HG11 . VAL   A 1 153 ? 4.494   18.188  -20.429 0   29.82  ? 843  VAL   A HG11 1 1 
ATOM   2246 H  HG12 . VAL   A 1 153 ? 4.445   18.827  -18.774 0   29.6   ? 843  VAL   A HG12 1 1 
ATOM   2247 H  HG13 . VAL   A 1 153 ? 4.975   17.143  -19.068 0   29.88  ? 843  VAL   A HG13 1 1 
ATOM   2248 H  HG21 . VAL   A 1 153 ? 2.837   16.651  -21.234 0   29.44  ? 843  VAL   A HG21 1 1 
ATOM   2249 H  HG22 . VAL   A 1 153 ? 3.219   15.469  -19.958 0   29.51  ? 843  VAL   A HG22 1 1 
ATOM   2250 H  HG23 . VAL   A 1 153 ? 1.54    16.036  -20.182 0   29.27  ? 843  VAL   A HG23 1 1 
ATOM   2251 N  N    . LEU   A 1 154 ? 3.687   18.234  -15.959 1   32.33  ? 844  LEU   A N    1 1 
ATOM   2252 C  CA   . LEU   A 1 154 ? 3.905   19.259  -14.94  1   33.5   ? 844  LEU   A CA   1 1 
ATOM   2253 C  C    . LEU   A 1 154 ? 5.112   20.126  -15.234 1   34.38  ? 844  LEU   A C    1 1 
ATOM   2254 O  O    . LEU   A 1 154 ? 6.001   19.719  -15.972 1   34.52  ? 844  LEU   A O    1 1 
ATOM   2255 C  CB   . LEU   A 1 154 ? 4.082   18.595  -13.574 1   34     ? 844  LEU   A CB   1 1 
ATOM   2256 C  CG   . LEU   A 1 154 ? 2.984   17.63   -13.127 1   35.62  ? 844  LEU   A CG   1 1 
ATOM   2257 C  CD1  . LEU   A 1 154 ? 3.443   16.824  -11.971 1   36.64  ? 844  LEU   A CD1  1 1 
ATOM   2258 C  CD2  . LEU   A 1 154 ? 1.702   18.344  -12.756 1   35.93  ? 844  LEU   A CD2  1 1 
ATOM   2259 H  H    . LEU   A 1 154 ? 4.394   17.506  -15.928 0   30.09  ? 844  LEU   A H    1 1 
ATOM   2260 H  HA   . LEU   A 1 154 ? 3.047   19.927  -14.885 0   31.54  ? 844  LEU   A HA   1 1 
ATOM   2261 H  HB2  . LEU   A 1 154 ? 5.026   18.052  -13.596 0   32.47  ? 844  LEU   A HB2  1 1 
ATOM   2262 H  HB3  . LEU   A 1 154 ? 4.142   19.385  -12.826 0   32.64  ? 844  LEU   A HB3  1 1 
ATOM   2263 H  HG   . LEU   A 1 154 ? 2.75    16.93   -13.928 0   33.37  ? 844  LEU   A HG   1 1 
ATOM   2264 H  HD11 . LEU   A 1 154 ? 2.658   16.119  -11.702 0   34.85  ? 844  LEU   A HD11 1 1 
ATOM   2265 H  HD12 . LEU   A 1 154 ? 4.347   16.282  -12.244 0   35.04  ? 844  LEU   A HD12 1 1 
ATOM   2266 H  HD13 . LEU   A 1 154 ? 3.637   17.486  -11.129 0   35.25  ? 844  LEU   A HD13 1 1 
ATOM   2267 H  HD21 . LEU   A 1 154 ? 0.984   17.609  -12.394 0   33.87  ? 844  LEU   A HD21 1 1 
ATOM   2268 H  HD22 . LEU   A 1 154 ? 1.908   19.078  -11.978 0   34.27  ? 844  LEU   A HD22 1 1 
ATOM   2269 H  HD23 . LEU   A 1 154 ? 1.291   18.828  -13.64  0   33.8   ? 844  LEU   A HD23 1 1 
ATOM   2270 N  N    . VAL   A 1 155 ? 5.149   21.323  -14.633 1   34.72  ? 845  VAL   A N    1 1 
ATOM   2271 C  CA   . VAL   A 1 155 ? 6.192   22.315  -14.866 1   35.39  ? 845  VAL   A CA   1 1 
ATOM   2272 C  C    . VAL   A 1 155 ? 7.045   22.491  -13.589 1   36.09  ? 845  VAL   A C    1 1 
ATOM   2273 O  O    . VAL   A 1 155 ? 6.588   23.103  -12.628 1   35.73  ? 845  VAL   A O    1 1 
ATOM   2274 C  CB   . VAL   A 1 155 ? 5.54    23.658  -15.334 1   35.88  ? 845  VAL   A CB   1 1 
ATOM   2275 C  CG1  . VAL   A 1 155 ? 6.598   24.667  -15.773 1   36.26  ? 845  VAL   A CG1  1 1 
ATOM   2276 C  CG2  . VAL   A 1 155 ? 4.551   23.44   -16.476 1   35.76  ? 845  VAL   A CG2  1 1 
ATOM   2277 H  H    . VAL   A 1 155 ? 4.451   21.631  -13.962 0   33.8   ? 845  VAL   A H    1 1 
ATOM   2278 H  HA   . VAL   A 1 155 ? 6.853   21.987  -15.666 0   35.12  ? 845  VAL   A HA   1 1 
ATOM   2279 H  HB   . VAL   A 1 155 ? 4.963   24.079  -14.514 0   36.02  ? 845  VAL   A HB   1 1 
ATOM   2280 H  HG11 . VAL   A 1 155 ? 6.102   25.586  -16.083 0   37.28  ? 845  VAL   A HG11 1 1 
ATOM   2281 H  HG12 . VAL   A 1 155 ? 7.292   24.879  -14.962 0   37.65  ? 845  VAL   A HG12 1 1 
ATOM   2282 H  HG13 . VAL   A 1 155 ? 7.143   24.243  -16.614 0   36.95  ? 845  VAL   A HG13 1 1 
ATOM   2283 H  HG21 . VAL   A 1 155 ? 4.164   24.408  -16.789 0   35.31  ? 845  VAL   A HG21 1 1 
ATOM   2284 H  HG22 . VAL   A 1 155 ? 5.081   22.97   -17.302 0   34.88  ? 845  VAL   A HG22 1 1 
ATOM   2285 H  HG23 . VAL   A 1 155 ? 3.727   22.807  -16.151 0   34.62  ? 845  VAL   A HG23 1 1 
ATOM   2286 N  N    . LYS   A 1 156 ? 8.262   21.909  -13.567 1   36.79  ? 846  LYS   A N    1 1 
ATOM   2287 C  CA   . LYS   A 1 156 ? 9.184   22.049  -12.437 1   38.1   ? 846  LYS   A CA   1 1 
ATOM   2288 C  C    . LYS   A 1 156 ? 9.72    23.484  -12.464 1   39.09  ? 846  LYS   A C    1 1 
ATOM   2289 O  O    . LYS   A 1 156 ? 9.711   24.175  -11.449 1   39.35  ? 846  LYS   A O    1 1 
ATOM   2290 C  CB   . LYS   A 1 156 ? 10.338  21.027  -12.546 1   40.16  ? 846  LYS   A CB   1 1 
ATOM   2291 C  CG   . LYS   A 1 156 ? 11.273  21.025  -11.348 1   43.61  ? 846  LYS   A CG   1 1 
ATOM   2292 C  CD   . LYS   A 1 156 ? 12.388  20.016  -11.529 1   47.67  ? 846  LYS   A CD   1 1 
ATOM   2293 C  CE   . LYS   A 1 156 ? 13.327  19.987  -10.345 1   51.42  ? 846  LYS   A CE   1 1 
ATOM   2294 N  NZ   . LYS   A 1 156 ? 14.265  21.148  -10.312 1   54.1   ? 846  LYS   A NZ   1 1 
ATOM   2295 H  H    . LYS   A 1 156 ? 8.632   21.33   -14.315 0   37.42  ? 846  LYS   A H    1 1 
ATOM   2296 H  HA   . LYS   A 1 156 ? 8.657   21.885  -11.498 0   39.59  ? 846  LYS   A HA   1 1 
ATOM   2297 H  HB2  . LYS   A 1 156 ? 9.913   20.028  -12.637 0   41.47  ? 846  LYS   A HB2  1 1 
ATOM   2298 H  HB3  . LYS   A 1 156 ? 10.931  21.252  -13.431 0   42.33  ? 846  LYS   A HB3  1 1 
ATOM   2299 H  HG2  . LYS   A 1 156 ? 11.738  22.003  -11.232 0   47.14  ? 846  LYS   A HG2  1 1 
ATOM   2300 H  HG3  . LYS   A 1 156 ? 10.713  20.762  -10.452 0   46.19  ? 846  LYS   A HG3  1 1 
ATOM   2301 H  HD2  . LYS   A 1 156 ? 11.957  19.022  -11.64  0   50.27  ? 846  LYS   A HD2  1 1 
ATOM   2302 H  HD3  . LYS   A 1 156 ? 12.966  20.274  -12.416 0   51.19  ? 846  LYS   A HD3  1 1 
ATOM   2303 H  HE2  . LYS   A 1 156 ? 12.748  19.988  -9.423  0   55.41  ? 846  LYS   A HE2  1 1 
ATOM   2304 H  HE3  . LYS   A 1 156 ? 13.931  19.083  -10.408 0   55.84  ? 846  LYS   A HE3  1 1 
ATOM   2305 H  HZ1  . LYS   A 1 156 ? 14.675  21.224  -9.387  0   60.14  ? 846  LYS   A HZ1  1 1 
ATOM   2306 H  HZ2  . LYS   A 1 156 ? 15.015  21.003  -10.981 0   59.98  ? 846  LYS   A HZ2  1 1 
ATOM   2307 H  HZ3  . LYS   A 1 156 ? 13.8    22.022  -10.532 0   59.36  ? 846  LYS   A HZ3  1 1 
ATOM   2308 N  N    . THR   A 1 157 ? 10.216  23.9    -13.632 1   39.48  ? 847  THR   A N    1 1 
ATOM   2309 C  CA   . THR   A 1 157 ? 10.671  25.253  -13.952 1   40.39  ? 847  THR   A CA   1 1 
ATOM   2310 C  C    . THR   A 1 157 ? 10.084  25.54   -15.366 1   40.58  ? 847  THR   A C    1 1 
ATOM   2311 O  O    . THR   A 1 157 ? 9.851   24.572  -16.098 1   40.86  ? 847  THR   A O    1 1 
ATOM   2312 C  CB   . THR   A 1 157 ? 12.228  25.334  -13.968 1   42.08  ? 847  THR   A CB   1 1 
ATOM   2313 O  OG1  . THR   A 1 157 ? 12.733  24.593  -15.081 1   43.42  ? 847  THR   A OG1  1 1 
ATOM   2314 C  CG2  . THR   A 1 157 ? 12.88   24.825  -12.671 1   42.41  ? 847  THR   A CG2  1 1 
ATOM   2315 H  H    . THR   A 1 157 ? 10.352  23.277  -14.422 0   41.89  ? 847  THR   A H    1 1 
ATOM   2316 H  HA   . THR   A 1 157 ? 10.276  25.965  -13.229 0   44.56  ? 847  THR   A HA   1 1 
ATOM   2317 H  HB   . THR   A 1 157 ? 12.523  26.375  -14.094 0   47.87  ? 847  THR   A HB   1 1 
ATOM   2318 H  HG1  . THR   A 1 157 ? 13.726  24.581  -15.071 0   48.9   ? 847  THR   A HG1  1 1 
ATOM   2319 H  HG21 . THR   A 1 157 ? 13.964  24.893  -12.744 0   48.82  ? 847  THR   A HG21 1 1 
ATOM   2320 H  HG22 . THR   A 1 157 ? 12.543  25.426  -11.827 0   48.15  ? 847  THR   A HG22 1 1 
ATOM   2321 H  HG23 . THR   A 1 157 ? 12.623  23.781  -12.498 0   47.13  ? 847  THR   A HG23 1 1 
ATOM   2322 N  N    . PRO   A 1 158 ? 9.891   26.796  -15.825 1   40.37  ? 848  PRO   A N    1 1 
ATOM   2323 C  CA   . PRO   A 1 158 ? 9.387   27      -17.199 1   40.55  ? 848  PRO   A CA   1 1 
ATOM   2324 C  C    . PRO   A 1 158 ? 10.144  26.226  -18.293 1   40.78  ? 848  PRO   A C    1 1 
ATOM   2325 O  O    . PRO   A 1 158 ? 9.529   25.853  -19.286 1   41.06  ? 848  PRO   A O    1 1 
ATOM   2326 C  CB   . PRO   A 1 158 ? 9.521   28.506  -17.396 1   41.14  ? 848  PRO   A CB   1 1 
ATOM   2327 C  CG   . PRO   A 1 158 ? 9.392   29.065  -16.037 1   41.47  ? 848  PRO   A CG   1 1 
ATOM   2328 C  CD   . PRO   A 1 158 ? 10.093  28.088  -15.142 1   39.87  ? 848  PRO   A CD   1 1 
ATOM   2329 H  HA   . PRO   A 1 158 ? 8.332   26.735  -17.255 0   43.05  ? 848  PRO   A HA   1 1 
ATOM   2330 H  HB2  . PRO   A 1 158 ? 10.499  28.736  -17.818 0   46.36  ? 848  PRO   A HB2  1 1 
ATOM   2331 H  HB3  . PRO   A 1 158 ? 8.723   28.859  -18.047 0   45.3   ? 848  PRO   A HB3  1 1 
ATOM   2332 H  HG2  . PRO   A 1 158 ? 9.877   30.04   -15.999 0   47.65  ? 848  PRO   A HG2  1 1 
ATOM   2333 H  HG3  . PRO   A 1 158 ? 8.339   29.139  -15.771 0   46.06  ? 848  PRO   A HG3  1 1 
ATOM   2334 H  HD2  . PRO   A 1 158 ? 11.153  28.328  -15.08  0   45.79  ? 848  PRO   A HD2  1 1 
ATOM   2335 H  HD3  . PRO   A 1 158 ? 9.623   28.089  -14.159 0   44.79  ? 848  PRO   A HD3  1 1 
ATOM   2336 N  N    . GLN   A 1 159 ? 11.445  25.928  -18.081 1   40.43  ? 849  GLN   A N    1 1 
ATOM   2337 C  CA   . GLN   A 1 159 ? 12.292  25.193  -19.029 1   40.58  ? 849  GLN   A CA   1 1 
ATOM   2338 C  C    . GLN   A 1 159 ? 12.363  23.661  -18.766 1   40.3   ? 849  GLN   A C    1 1 
ATOM   2339 O  O    . GLN   A 1 159 ? 13.101  22.986  -19.477 1   40.98  ? 849  GLN   A O    1 1 
ATOM   2340 C  CB   . GLN   A 1 159 ? 13.736  25.747  -18.991 1   41.97  ? 849  GLN   A CB   1 1 
ATOM   2341 C  CG   . GLN   A 1 159 ? 13.863  27.254  -19.211 1   45.6   ? 849  GLN   A CG   1 1 
ATOM   2342 C  CD   . GLN   A 1 159 ? 13.476  28.088  -18.004 1   50.27  ? 849  GLN   A CD   1 1 
ATOM   2343 O  OE1  . GLN   A 1 159 ? 13.647  27.68   -16.85  1   52.35  ? 849  GLN   A OE1  1 1 
ATOM   2344 N  NE2  . GLN   A 1 159 ? 12.953  29.285  -18.235 1   50.34  ? 849  GLN   A NE2  1 1 
ATOM   2345 H  H    . GLN   A 1 159 ? 11.947  26.172  -17.233 0   45.03  ? 849  GLN   A H    1 1 
ATOM   2346 H  HA   . GLN   A 1 159 ? 11.926  25.344  -20.043 0   44.12  ? 849  GLN   A HA   1 1 
ATOM   2347 H  HB2  . GLN   A 1 159 ? 14.189  25.491  -18.035 0   47.85  ? 849  GLN   A HB2  1 1 
ATOM   2348 H  HB3  . GLN   A 1 159 ? 14.307  25.274  -19.789 0   47.55  ? 849  GLN   A HB3  1 1 
ATOM   2349 H  HG2  . GLN   A 1 159 ? 14.902  27.48   -19.448 0   53.22  ? 849  GLN   A HG2  1 1 
ATOM   2350 H  HG3  . GLN   A 1 159 ? 13.229  27.533  -20.051 0   51.69  ? 849  GLN   A HG3  1 1 
ATOM   2351 H  HE21 . GLN   A 1 159 ? 12.831  29.624  -19.184 0   57.79  ? 849  GLN   A HE21 1 1 
ATOM   2352 H  HE22 . GLN   A 1 159 ? 12.685  29.874  -17.453 0   58.21  ? 849  GLN   A HE22 1 1 
ATOM   2353 N  N    . HIS   A 1 160 ? 11.678  23.119  -17.742 1   39.06  ? 850  HIS   A N    1 1 
ATOM   2354 C  CA   . HIS   A 1 160 ? 11.765  21.691  -17.42  1   38.41  ? 850  HIS   A CA   1 1 
ATOM   2355 C  C    . HIS   A 1 160 ? 10.385  21.132  -17.084 1   37.71  ? 850  HIS   A C    1 1 
ATOM   2356 O  O    . HIS   A 1 160 ? 9.787   21.548  -16.092 1   37.95  ? 850  HIS   A O    1 1 
ATOM   2357 C  CB   . HIS   A 1 160 ? 12.727  21.477  -16.232 1   38.93  ? 850  HIS   A CB   1 1 
ATOM   2358 C  CG   . HIS   A 1 160 ? 13.162  20.056  -16.05  1   40.56  ? 850  HIS   A CG   1 1 
ATOM   2359 N  ND1  . HIS   A 1 160 ? 14.491  19.697  -16.141 1   42.04  ? 850  HIS   A ND1  1 1 
ATOM   2360 C  CD2  . HIS   A 1 160 ? 12.425  18.946  -15.813 1   41.53  ? 850  HIS   A CD2  1 1 
ATOM   2361 C  CE1  . HIS   A 1 160 ? 14.524  18.39   -15.953 1   42.56  ? 850  HIS   A CE1  1 1 
ATOM   2362 N  NE2  . HIS   A 1 160 ? 13.301  17.897  -15.757 1   42.49  ? 850  HIS   A NE2  1 1 
ATOM   2363 H  H    . HIS   A 1 160 ? 11.056  23.624  -17.119 0   41.62  ? 850  HIS   A H    1 1 
ATOM   2364 H  HA   . HIS   A 1 160 ? 12.155  21.139  -18.273 0   40.52  ? 850  HIS   A HA   1 1 
ATOM   2365 H  HB2  . HIS   A 1 160 ? 13.622  22.074  -16.4   0   42.87  ? 850  HIS   A HB2  1 1 
ATOM   2366 H  HB3  . HIS   A 1 160 ? 12.246  21.799  -15.31  0   41.87  ? 850  HIS   A HB3  1 1 
ATOM   2367 H  HD2  . HIS   A 1 160 ? 11.356  18.899  -15.689 0   42.85  ? 850  HIS   A HD2  1 1 
ATOM   2368 H  HE1  . HIS   A 1 160 ? 15.425  17.8    -15.959 0   46.84  ? 850  HIS   A HE1  1 1 
ATOM   2369 H  HE2  . HIS   A 1 160 ? 13.062  16.925  -15.592 0   44.71  ? 850  HIS   A HE2  1 1 
ATOM   2370 N  N    . VAL   A 1 161 ? 9.905   20.154  -17.89  1   36.72  ? 851  VAL   A N    1 1 
ATOM   2371 C  CA   . VAL   A 1 161 ? 8.595   19.514  -17.714 1   36.25  ? 851  VAL   A CA   1 1 
ATOM   2372 C  C    . VAL   A 1 161 ? 8.723   18.009  -17.403 1   35.54  ? 851  VAL   A C    1 1 
ATOM   2373 O  O    . VAL   A 1 161 ? 9.708   17.382  -17.785 1   35.75  ? 851  VAL   A O    1 1 
ATOM   2374 C  CB   . VAL   A 1 161 ? 7.618   19.772  -18.895 1   37.01  ? 851  VAL   A CB   1 1 
ATOM   2375 C  CG1  . VAL   A 1 161 ? 7.333   21.267  -19.067 1   37.49  ? 851  VAL   A CG1  1 1 
ATOM   2376 C  CG2  . VAL   A 1 161 ? 8.101   19.143  -20.204 1   37.37  ? 851  VAL   A CG2  1 1 
ATOM   2377 H  H    . VAL   A 1 161 ? 10.437  19.765  -18.661 0   37.15  ? 851  VAL   A H    1 1 
ATOM   2378 H  HA   . VAL   A 1 161 ? 8.112   19.953  -16.843 0   35.73  ? 851  VAL   A HA   1 1 
ATOM   2379 H  HB   . VAL   A 1 161 ? 6.673   19.295  -18.643 0   35.36  ? 851  VAL   A HB   1 1 
ATOM   2380 H  HG11 . VAL   A 1 161 ? 6.651   21.403  -19.905 0   36.21  ? 851  VAL   A HG11 1 1 
ATOM   2381 H  HG12 . VAL   A 1 161 ? 6.88    21.646  -18.152 0   36.67  ? 851  VAL   A HG12 1 1 
ATOM   2382 H  HG13 . VAL   A 1 161 ? 8.264   21.795  -19.266 0   37.21  ? 851  VAL   A HG13 1 1 
ATOM   2383 H  HG21 . VAL   A 1 161 ? 7.381   19.379  -20.986 0   35.71  ? 851  VAL   A HG21 1 1 
ATOM   2384 H  HG22 . VAL   A 1 161 ? 9.072   19.561  -20.464 0   36.68  ? 851  VAL   A HG22 1 1 
ATOM   2385 H  HG23 . VAL   A 1 161 ? 8.177   18.062  -20.097 0   35.98  ? 851  VAL   A HG23 1 1 
ATOM   2386 N  N    . LYS   A 1 162 ? 7.729   17.446  -16.693 1   34.46  ? 852  LYS   A N    1 1 
ATOM   2387 C  CA   . LYS   A 1 162 ? 7.73    16.035  -16.29  1   34.12  ? 852  LYS   A CA   1 1 
ATOM   2388 C  C    . LYS   A 1 162 ? 6.369   15.382  -16.518 1   33.25  ? 852  LYS   A C    1 1 
ATOM   2389 O  O    . LYS   A 1 162 ? 5.354   15.958  -16.141 1   33.13  ? 852  LYS   A O    1 1 
ATOM   2390 C  CB   . LYS   A 1 162 ? 8.053   15.911  -14.796 1   35.92  ? 852  LYS   A CB   1 1 
ATOM   2391 C  CG   . LYS   A 1 162 ? 9.514   16.102  -14.434 1   39.93  ? 852  LYS   A CG   1 1 
ATOM   2392 C  CD   . LYS   A 1 162 ? 9.665   16.309  -12.934 1   44.43  ? 852  LYS   A CD   1 1 
ATOM   2393 C  CE   . LYS   A 1 162 ? 11.067  16.127  -12.395 1   48.24  ? 852  LYS   A CE   1 1 
ATOM   2394 N  NZ   . LYS   A 1 162 ? 11.347  14.749  -11.903 1   51.18  ? 852  LYS   A NZ   1 1 
ATOM   2395 H  H    . LYS   A 1 162 ? 6.906   17.95   -16.38  0   33.04  ? 852  LYS   A H    1 1 
ATOM   2396 H  HA   . LYS   A 1 162 ? 8.476   15.478  -16.854 0   33.13  ? 852  LYS   A HA   1 1 
ATOM   2397 H  HB2  . LYS   A 1 162 ? 7.471   16.657  -14.256 0   34.99  ? 852  LYS   A HB2  1 1 
ATOM   2398 H  HB3  . LYS   A 1 162 ? 7.762   14.916  -14.464 0   35.01  ? 852  LYS   A HB3  1 1 
ATOM   2399 H  HG2  . LYS   A 1 162 ? 10.074  15.211  -14.714 0   40.17  ? 852  LYS   A HG2  1 1 
ATOM   2400 H  HG3  . LYS   A 1 162 ? 9.91    16.976  -14.948 0   40.14  ? 852  LYS   A HG3  1 1 
ATOM   2401 H  HD2  . LYS   A 1 162 ? 9.383   17.337  -12.715 0   44.83  ? 852  LYS   A HD2  1 1 
ATOM   2402 H  HD3  . LYS   A 1 162 ? 8.989   15.637  -12.408 0   44.56  ? 852  LYS   A HD3  1 1 
ATOM   2403 H  HE2  . LYS   A 1 162 ? 11.782  16.339  -13.189 0   49.93  ? 852  LYS   A HE2  1 1 
ATOM   2404 H  HE3  . LYS   A 1 162 ? 11.217  16.812  -11.561 0   49.96  ? 852  LYS   A HE3  1 1 
ATOM   2405 H  HZ1  . LYS   A 1 162 ? 11.952  14.796  -11.089 0   53.33  ? 852  LYS   A HZ1  1 1 
ATOM   2406 H  HZ2  . LYS   A 1 162 ? 10.501  14.251  -11.645 0   52.25  ? 852  LYS   A HZ2  1 1 
ATOM   2407 H  HZ3  . LYS   A 1 162 ? 11.828  14.218  -12.622 0   52.94  ? 852  LYS   A HZ3  1 1 
ATOM   2408 N  N    . ILE   A 1 163 ? 6.358   14.148  -17.032 1   32.3   ? 853  ILE   A N    1 1 
ATOM   2409 C  CA   . ILE   A 1 163 ? 5.13    13.385  -17.254 1   32.24  ? 853  ILE   A CA   1 1 
ATOM   2410 C  C    . ILE   A 1 163 ? 4.688   12.848  -15.899 1   32.4   ? 853  ILE   A C    1 1 
ATOM   2411 O  O    . ILE   A 1 163 ? 5.514   12.319  -15.155 1   32.72  ? 853  ILE   A O    1 1 
ATOM   2412 C  CB   . ILE   A 1 163 ? 5.357   12.216  -18.258 1   32.64  ? 853  ILE   A CB   1 1 
ATOM   2413 C  CG1  . ILE   A 1 163 ? 5.806   12.753  -19.651 1   33.44  ? 853  ILE   A CG1  1 1 
ATOM   2414 C  CG2  . ILE   A 1 163 ? 4.071   11.363  -18.409 1   32.99  ? 853  ILE   A CG2  1 1 
ATOM   2415 C  CD1  . ILE   A 1 163 ? 6.577   11.821  -20.442 1   34.54  ? 853  ILE   A CD1  1 1 
ATOM   2416 H  H    . ILE   A 1 163 ? 7.201   13.634  -17.267 0   30.93  ? 853  ILE   A H    1 1 
ATOM   2417 H  HA   . ILE   A 1 163 ? 4.357   14.039  -17.655 0   30.19  ? 853  ILE   A HA   1 1 
ATOM   2418 H  HB   . ILE   A 1 163 ? 6.135   11.578  -17.837 0   30.94  ? 853  ILE   A HB   1 1 
ATOM   2419 H  HG12 . ILE   A 1 163 ? 4.92    13.016  -20.229 0   31.26  ? 853  ILE   A HG12 1 1 
ATOM   2420 H  HG13 . ILE   A 1 163 ? 6.426   13.639  -19.524 0   31.64  ? 853  ILE   A HG13 1 1 
ATOM   2421 H  HG21 . ILE   A 1 163 ? 4.246   10.567  -19.131 0   30.85  ? 853  ILE   A HG21 1 1 
ATOM   2422 H  HG22 . ILE   A 1 163 ? 3.798   10.914  -17.455 0   30.89  ? 853  ILE   A HG22 1 1 
ATOM   2423 H  HG23 . ILE   A 1 163 ? 3.265   12.005  -18.762 0   30.51  ? 853  ILE   A HG23 1 1 
ATOM   2424 H  HD11 . ILE   A 1 163 ? 6.897   12.311  -21.36  0   32.51  ? 853  ILE   A HD11 1 1 
ATOM   2425 H  HD12 . ILE   A 1 163 ? 7.436   11.519  -19.847 0   33.07  ? 853  ILE   A HD12 1 1 
ATOM   2426 H  HD13 . ILE   A 1 163 ? 5.973   10.947  -20.679 0   32.59  ? 853  ILE   A HD13 1 1 
ATOM   2427 N  N    . THR   A 1 164 ? 3.396   12.95   -15.594 1   32.3   ? 854  THR   A N    1 1 
ATOM   2428 C  CA   . THR   A 1 164 ? 2.832   12.487  -14.32  1   32.94  ? 854  THR   A CA   1 1 
ATOM   2429 C  C    . THR   A 1 164 ? 1.589   11.564  -14.554 1   33.58  ? 854  THR   A C    1 1 
ATOM   2430 O  O    . THR   A 1 164 ? 1.257   11.252  -15.703 1   33.36  ? 854  THR   A O    1 1 
ATOM   2431 C  CB   . THR   A 1 164 ? 2.507   13.732  -13.424 1   33.7   ? 854  THR   A CB   1 1 
ATOM   2432 O  OG1  . THR   A 1 164 ? 2.244   13.26   -12.097 1   34.44  ? 854  THR   A OG1  1 1 
ATOM   2433 C  CG2  . THR   A 1 164 ? 1.263   14.508  -13.901 1   33.84  ? 854  THR   A CG2  1 1 
ATOM   2434 H  H    . THR   A 1 164 ? 2.699   13.325  -16.23  0   29.83  ? 854  THR   A H    1 1 
ATOM   2435 H  HA   . THR   A 1 164 ? 3.577   11.878  -13.811 0   31.21  ? 854  THR   A HA   1 1 
ATOM   2436 H  HB   . THR   A 1 164 ? 3.352   14.421  -13.424 0   31.65  ? 854  THR   A HB   1 1 
ATOM   2437 H  HG1  . THR   A 1 164 ? 2.702   13.803  -11.403 0   32.79  ? 854  THR   A HG1  1 1 
ATOM   2438 H  HG21 . THR   A 1 164 ? 1.103   15.376  -13.263 0   31.53  ? 854  THR   A HG21 1 1 
ATOM   2439 H  HG22 . THR   A 1 164 ? 1.41    14.852  -14.923 0   31.24  ? 854  THR   A HG22 1 1 
ATOM   2440 H  HG23 . THR   A 1 164 ? 0.369   13.887  -13.858 0   31.49  ? 854  THR   A HG23 1 1 
ATOM   2441 N  N    . ASP   A 1 165 ? 0.94    11.107  -13.453 1   34.2   ? 855  ASP   A N    1 1 
ATOM   2442 C  CA   . ASP   A 1 165 ? -0.29   10.328  -13.452 1   34.91  ? 855  ASP   A CA   1 1 
ATOM   2443 C  C    . ASP   A 1 165 ? -0.116  8.981   -14.1   1   35.64  ? 855  ASP   A C    1 1 
ATOM   2444 O  O    . ASP   A 1 165 ? -0.155  8.871   -15.321 1   35.96  ? 855  ASP   A O    1 1 
ATOM   2445 C  CB   . ASP   A 1 165 ? -1.435  11.117  -14.111 1   36.47  ? 855  ASP   A CB   1 1 
ATOM   2446 C  CG   . ASP   A 1 165 ? -2.824  10.738  -13.627 1   40.44  ? 855  ASP   A CG   1 1 
ATOM   2447 O  OD1  . ASP   A 1 165 ? -3.089  9.524   -13.456 1   40.36  ? 855  ASP   A OD1  1 1 
ATOM   2448 O  OD2  . ASP   A 1 165 ? -3.642  11.655  -13.409 1   43.16  ? 855  ASP   A OD2  1 1 
ATOM   2449 H  H    . ASP   A 1 165 ? 1.286   11.248  -12.509 0   32.62  ? 855  ASP   A H    1 1 
ATOM   2450 H  HA   . ASP   A 1 165 ? -0.561  10.158  -12.411 0   33.72  ? 855  ASP   A HA   1 1 
ATOM   2451 H  HB2  . ASP   A 1 165 ? -1.293  12.171  -13.876 0   34.48  ? 855  ASP   A HB2  1 1 
ATOM   2452 H  HB3  . ASP   A 1 165 ? -1.41   10.992  -15.193 0   34.55  ? 855  ASP   A HB3  1 1 
ATOM   2453 N  N    . PHE   A 1 166 ? 0.079   7.954   -13.276 1   35.84  ? 856  PHE   A N    1 1 
ATOM   2454 C  CA   . PHE   A 1 166 ? 0.215   6.58    -13.736 1   36.69  ? 856  PHE   A CA   1 1 
ATOM   2455 C  C    . PHE   A 1 166 ? -0.994  5.746   -13.226 1   37.52  ? 856  PHE   A C    1 1 
ATOM   2456 O  O    . PHE   A 1 166 ? -0.843  4.593   -12.821 1   37.93  ? 856  PHE   A O    1 1 
ATOM   2457 C  CB   . PHE   A 1 166 ? 1.59    6.034   -13.302 1   36.56  ? 856  PHE   A CB   1 1 
ATOM   2458 C  CG   . PHE   A 1 166 ? 2.725   6.774   -13.98  1   37.07  ? 856  PHE   A CG   1 1 
ATOM   2459 C  CD1  . PHE   A 1 166 ? 3.169   7.995   -13.495 1   37.72  ? 856  PHE   A CD1  1 1 
ATOM   2460 C  CD2  . PHE   A 1 166 ? 3.295   6.287   -15.142 1   37.82  ? 856  PHE   A CD2  1 1 
ATOM   2461 C  CE1  . PHE   A 1 166 ? 4.175   8.7     -14.149 1   38.26  ? 856  PHE   A CE1  1 1 
ATOM   2462 C  CE2  . PHE   A 1 166 ? 4.317   6.985   -15.78  1   38.59  ? 856  PHE   A CE2  1 1 
ATOM   2463 C  CZ   . PHE   A 1 166 ? 4.746   8.189   -15.282 1   38.04  ? 856  PHE   A CZ   1 1 
ATOM   2464 H  H    . PHE   A 1 166 ? 0.157   8.038   -12.267 0   35.43  ? 856  PHE   A H    1 1 
ATOM   2465 H  HA   . PHE   A 1 166 ? 0.184   6.539   -14.823 0   36.54  ? 856  PHE   A HA   1 1 
ATOM   2466 H  HB2  . PHE   A 1 166 ? 1.711   6.16    -12.228 0   37.07  ? 856  PHE   A HB2  1 1 
ATOM   2467 H  HB3  . PHE   A 1 166 ? 1.673   4.981   -13.566 0   37.47  ? 856  PHE   A HB3  1 1 
ATOM   2468 H  HD1  . PHE   A 1 166 ? 2.724   8.408   -12.606 0   37.17  ? 856  PHE   A HD1  1 1 
ATOM   2469 H  HD2  . PHE   A 1 166 ? 2.96    5.346   -15.544 0   38.24  ? 856  PHE   A HD2  1 1 
ATOM   2470 H  HE1  . PHE   A 1 166 ? 4.523   9.637   -13.747 0   37.31  ? 856  PHE   A HE1  1 1 
ATOM   2471 H  HE2  . PHE   A 1 166 ? 4.758   6.586   -16.678 0   38.47  ? 856  PHE   A HE2  1 1 
ATOM   2472 H  HZ   . PHE   A 1 166 ? 5.536   8.727   -15.778 0   37.3   ? 856  PHE   A HZ   1 1 
ATOM   2473 N  N    . GLY   A 1 167 ? -2.187  6.341   -13.289 1   37.62  ? 857  GLY   A N    1 1 
ATOM   2474 C  CA   . GLY   A 1 167 ? -3.424  5.706   -12.849 1   38.09  ? 857  GLY   A CA   1 1 
ATOM   2475 C  C    . GLY   A 1 167 ? -3.913  4.678   -13.845 1   38.38  ? 857  GLY   A C    1 1 
ATOM   2476 O  O    . GLY   A 1 167 ? -4.44   3.634   -13.45  1   38.72  ? 857  GLY   A O    1 1 
ATOM   2477 H  H    . GLY   A 1 167 ? -2.343  7.271   -13.665 0   37.61  ? 857  GLY   A H    1 1 
ATOM   2478 H  HA2  . GLY   A 1 167 ? -3.268  5.218   -11.888 0   39.8   ? 857  GLY   A HA2  1 1 
ATOM   2479 H  HA3  . GLY   A 1 167 ? -4.196  6.464   -12.725 0   39.18  ? 857  GLY   A HA3  1 1 
ATOM   2480 N  N    . LEU   A 1 168 ? -3.757  4.978   -15.145 1   38.2   ? 858  LEU   A N    1 1 
ATOM   2481 C  CA   . LEU   A 1 168 ? -4.115  4.073   -16.238 1   38.83  ? 858  LEU   A CA   1 1 
ATOM   2482 C  C    . LEU   A 1 168 ? -2.887  3.387   -16.868 1   39.64  ? 858  LEU   A C    1 1 
ATOM   2483 O  O    . LEU   A 1 168 ? -3.052  2.622   -17.806 1   39.45  ? 858  LEU   A O    1 1 
ATOM   2484 C  CB   . LEU   A 1 168 ? -4.871  4.852   -17.332 1   39.19  ? 858  LEU   A CB   1 1 
ATOM   2485 C  CG   . LEU   A 1 168 ? -6.216  5.498   -16.951 1   40.65  ? 858  LEU   A CG   1 1 
ATOM   2486 C  CD1  . LEU   A 1 168 ? -6.681  6.439   -18.034 1   41.12  ? 858  LEU   A CD1  1 1 
ATOM   2487 C  CD2  . LEU   A 1 168 ? -7.299  4.456   -16.743 1   41.26  ? 858  LEU   A CD2  1 1 
ATOM   2488 H  H    . LEU   A 1 168 ? -3.397  5.865   -15.482 0   38.88  ? 858  LEU   A H    1 1 
ATOM   2489 H  HA   . LEU   A 1 168 ? -4.759  3.277   -15.871 0   41.6   ? 858  LEU   A HA   1 1 
ATOM   2490 H  HB2  . LEU   A 1 168 ? -4.218  5.646   -17.691 0   39.91  ? 858  LEU   A HB2  1 1 
ATOM   2491 H  HB3  . LEU   A 1 168 ? -5.082  4.169   -18.154 0   41.1   ? 858  LEU   A HB3  1 1 
ATOM   2492 H  HG   . LEU   A 1 168 ? -6.106  6.067   -16.029 0   42.08  ? 858  LEU   A HG   1 1 
ATOM   2493 H  HD11 . LEU   A 1 168 ? -7.642  6.862   -17.743 0   42.52  ? 858  LEU   A HD11 1 1 
ATOM   2494 H  HD12 . LEU   A 1 168 ? -5.953  7.238   -18.156 0   41.49  ? 858  LEU   A HD12 1 1 
ATOM   2495 H  HD13 . LEU   A 1 168 ? -6.788  5.884   -18.965 0   42.53  ? 858  LEU   A HD13 1 1 
ATOM   2496 H  HD21 . LEU   A 1 168 ? -8.232  4.961   -16.499 0   44.39  ? 858  LEU   A HD21 1 1 
ATOM   2497 H  HD22 . LEU   A 1 168 ? -7.42   3.883   -17.661 0   44.52  ? 858  LEU   A HD22 1 1 
ATOM   2498 H  HD23 . LEU   A 1 168 ? -7.029  3.79    -15.925 0   44.64  ? 858  LEU   A HD23 1 1 
ATOM   2499 N  N    . ALA   A 1 169 ? -1.67   3.648   -16.37  1   40.46  ? 859  ALA   A N    1 1 
ATOM   2500 C  CA   . ALA   A 1 169 ? -0.456  3.069   -16.927 1   41.98  ? 859  ALA   A CA   1 1 
ATOM   2501 C  C    . ALA   A 1 169 ? -0.329  1.574   -16.607 1   43.77  ? 859  ALA   A C    1 1 
ATOM   2502 O  O    . ALA   A 1 169 ? -0.693  1.145   -15.513 1   44.02  ? 859  ALA   A O    1 1 
ATOM   2503 C  CB   . ALA   A 1 169 ? 0.746   3.813   -16.399 1   41.99  ? 859  ALA   A CB   1 1 
ATOM   2504 H  H    . ALA   A 1 169 ? -1.5    4.247   -15.569 0   41.71  ? 859  ALA   A H    1 1 
ATOM   2505 H  HA   . ALA   A 1 169 ? -0.469  3.196   -18.008 0   43.51  ? 859  ALA   A HA   1 1 
ATOM   2506 H  HB1  . ALA   A 1 169 ? 1.634   3.319   -16.788 0   43.42  ? 859  ALA   A HB1  1 1 
ATOM   2507 H  HB2  . ALA   A 1 169 ? 0.702   4.846   -16.738 0   42.47  ? 859  ALA   A HB2  1 1 
ATOM   2508 H  HB3  . ALA   A 1 169 ? 0.724   3.77    -15.312 0   43.41  ? 859  ALA   A HB3  1 1 
ATOM   2509 N  N    . LYS   A 1 170 ? 0.176   0.778   -17.568 1   44.71  ? 860  LYS   A N    1 1 
ATOM   2510 C  CA   . LYS   A 1 170 ? 0.313   -0.667  -17.396 1   46.06  ? 860  LYS   A CA   1 1 
ATOM   2511 C  C    . LYS   A 1 170 ? 1.656   -1.173  -17.88  1   47.57  ? 860  LYS   A C    1 1 
ATOM   2512 O  O    . LYS   A 1 170 ? 2.092   -0.818  -18.977 1   47.85  ? 860  LYS   A O    1 1 
ATOM   2513 C  CB   . LYS   A 1 170 ? -0.795  -1.412  -18.165 1   47.62  ? 860  LYS   A CB   1 1 
ATOM   2514 C  CG   . LYS   A 1 170 ? -2.226  -0.988  -17.836 1   51.64  ? 860  LYS   A CG   1 1 
ATOM   2515 C  CD   . LYS   A 1 170 ? -2.722  -1.494  -16.471 1   55.7   ? 860  LYS   A CD   1 1 
ATOM   2516 C  CE   . LYS   A 1 170 ? -3.895  -0.684  -15.967 1   59.07  ? 860  LYS   A CE   1 1 
ATOM   2517 N  NZ   . LYS   A 1 170 ? -4.27   -1.033  -14.569 1   61.15  ? 860  LYS   A NZ   1 1 
ATOM   2518 H  H    . LYS   A 1 170 ? 0.501   1.111   -18.471 0   47.69  ? 860  LYS   A H    1 1 
ATOM   2519 H  HA   . LYS   A 1 170 ? 0.236   -0.928  -16.342 0   51.1   ? 860  LYS   A HA   1 1 
ATOM   2520 H  HB2  . LYS   A 1 170 ? -0.643  -1.247  -19.231 0   52.81  ? 860  LYS   A HB2  1 1 
ATOM   2521 H  HB3  . LYS   A 1 170 ? -0.709  -2.476  -17.947 0   54.18  ? 860  LYS   A HB3  1 1 
ATOM   2522 H  HG2  . LYS   A 1 170 ? -2.31   0.098   -17.861 0   56.02  ? 860  LYS   A HG2  1 1 
ATOM   2523 H  HG3  . LYS   A 1 170 ? -2.882  -1.414  -18.593 0   57.49  ? 860  LYS   A HG3  1 1 
ATOM   2524 H  HD2  . LYS   A 1 170 ? -3.052  -2.527  -16.578 0   63.03  ? 860  LYS   A HD2  1 1 
ATOM   2525 H  HD3  . LYS   A 1 170 ? -1.933  -1.435  -15.724 0   61.71  ? 860  LYS   A HD3  1 1 
ATOM   2526 H  HE2  . LYS   A 1 170 ? -3.646  0.377   -15.99  0   63.83  ? 860  LYS   A HE2  1 1 
ATOM   2527 H  HE3  . LYS   A 1 170 ? -4.759  -0.88   -16.6   0   65.29  ? 860  LYS   A HE3  1 1 
ATOM   2528 H  HZ1  . LYS   A 1 170 ? -4.736  -0.241  -14.138 0   67.1   ? 860  LYS   A HZ1  1 1 
ATOM   2529 H  HZ2  . LYS   A 1 170 ? -4.912  -1.819  -14.569 0   68.7   ? 860  LYS   A HZ2  1 1 
ATOM   2530 H  HZ3  . LYS   A 1 170 ? -3.456  -1.274  -14.013 0   67.7   ? 860  LYS   A HZ3  1 1 
ATOM   2531 N  N    . LEU   A 1 171 ? 2.307   -2.022  -17.072 1   48.32  ? 861  LEU   A N    1 1 
ATOM   2532 C  CA   . LEU   A 1 171 ? 3.573   -2.634  -17.451 1   49.51  ? 861  LEU   A CA   1 1 
ATOM   2533 C  C    . LEU   A 1 171 ? 3.225   -3.818  -18.337 1   50.62  ? 861  LEU   A C    1 1 
ATOM   2534 O  O    . LEU   A 1 171 ? 2.371   -4.622  -17.961 1   50.87  ? 861  LEU   A O    1 1 
ATOM   2535 C  CB   . LEU   A 1 171 ? 4.342   -3.137  -16.214 1   49.98  ? 861  LEU   A CB   1 1 
ATOM   2536 C  CG   . LEU   A 1 171 ? 4.918   -2.074  -15.258 1   51.93  ? 861  LEU   A CG   1 1 
ATOM   2537 C  CD1  . LEU   A 1 171 ? 5.13    -2.646  -13.864 1   52.52  ? 861  LEU   A CD1  1 1 
ATOM   2538 C  CD2  . LEU   A 1 171 ? 6.246   -1.523  -15.765 1   52.87  ? 861  LEU   A CD2  1 1 
ATOM   2539 H  H    . LEU   A 1 171 ? 1.971   -2.311  -16.159 0   54.68  ? 861  LEU   A H    1 1 
ATOM   2540 H  HA   . LEU   A 1 171 ? 4.197   -1.928  -17.998 0   55.4   ? 861  LEU   A HA   1 1 
ATOM   2541 H  HB2  . LEU   A 1 171 ? 3.666   -3.775  -15.645 0   58.01  ? 861  LEU   A HB2  1 1 
ATOM   2542 H  HB3  . LEU   A 1 171 ? 5.174   -3.744  -16.568 0   58.06  ? 861  LEU   A HB3  1 1 
ATOM   2543 H  HG   . LEU   A 1 171 ? 4.216   -1.246  -15.174 0   57.54  ? 861  LEU   A HG   1 1 
ATOM   2544 H  HD11 . LEU   A 1 171 ? 5.539   -1.868  -13.221 0   59.23  ? 861  LEU   A HD11 1 1 
ATOM   2545 H  HD12 . LEU   A 1 171 ? 4.173   -2.986  -13.472 0   60.08  ? 861  LEU   A HD12 1 1 
ATOM   2546 H  HD13 . LEU   A 1 171 ? 5.826   -3.482  -13.923 0   60.79  ? 861  LEU   A HD13 1 1 
ATOM   2547 H  HD21 . LEU   A 1 171 ? 6.613   -0.777  -15.062 0   58.55  ? 861  LEU   A HD21 1 1 
ATOM   2548 H  HD22 . LEU   A 1 171 ? 6.961   -2.341  -15.84  0   60     ? 861  LEU   A HD22 1 1 
ATOM   2549 H  HD23 . LEU   A 1 171 ? 6.102   -1.071  -16.745 0   58.46  ? 861  LEU   A HD23 1 1 
ATOM   2550 N  N    . LEU   A 1 172 ? 3.868   -3.941  -19.499 1   51.3   ? 862  LEU   A N    1 1 
ATOM   2551 C  CA   . LEU   A 1 172 ? 3.617   -5.064  -20.398 1   52.78  ? 862  LEU   A CA   1 1 
ATOM   2552 C  C    . LEU   A 1 172 ? 4.49    -6.237  -19.985 1   54.45  ? 862  LEU   A C    1 1 
ATOM   2553 O  O    . LEU   A 1 172 ? 5.641   -6.042  -19.59  1   54.54  ? 862  LEU   A O    1 1 
ATOM   2554 C  CB   . LEU   A 1 172 ? 3.947   -4.704  -21.859 1   52.86  ? 862  LEU   A CB   1 1 
ATOM   2555 C  CG   . LEU   A 1 172 ? 3.161   -3.562  -22.505 1   54.02  ? 862  LEU   A CG   1 1 
ATOM   2556 C  CD1  . LEU   A 1 172 ? 3.821   -3.122  -23.798 1   54.51  ? 862  LEU   A CD1  1 1 
ATOM   2557 C  CD2  . LEU   A 1 172 ? 1.718   -3.953  -22.79  1   54.42  ? 862  LEU   A CD2  1 1 
ATOM   2558 H  H    . LEU   A 1 172 ? 4.577   -3.295  -19.831 0   58.46  ? 862  LEU   A H    1 1 
ATOM   2559 H  HA   . LEU   A 1 172 ? 2.573   -5.369  -20.342 0   62.03  ? 862  LEU   A HA   1 1 
ATOM   2560 H  HB2  . LEU   A 1 172 ? 5.004   -4.444  -21.903 0   61.23  ? 862  LEU   A HB2  1 1 
ATOM   2561 H  HB3  . LEU   A 1 172 ? 3.773   -5.59   -22.467 0   62.38  ? 862  LEU   A HB3  1 1 
ATOM   2562 H  HG   . LEU   A 1 172 ? 3.154   -2.717  -21.818 0   60.32  ? 862  LEU   A HG   1 1 
ATOM   2563 H  HD11 . LEU   A 1 172 ? 3.24    -2.31   -24.234 0   60.26  ? 862  LEU   A HD11 1 1 
ATOM   2564 H  HD12 . LEU   A 1 172 ? 4.832   -2.781  -23.581 0   60.96  ? 862  LEU   A HD12 1 1 
ATOM   2565 H  HD13 . LEU   A 1 172 ? 3.852   -3.966  -24.485 0   62.07  ? 862  LEU   A HD13 1 1 
ATOM   2566 H  HD21 . LEU   A 1 172 ? 1.215   -3.112  -23.265 0   61.02  ? 862  LEU   A HD21 1 1 
ATOM   2567 H  HD22 . LEU   A 1 172 ? 1.708   -4.813  -23.458 0   62.9   ? 862  LEU   A HD22 1 1 
ATOM   2568 H  HD23 . LEU   A 1 172 ? 1.208   -4.199  -21.86  0   62.32  ? 862  LEU   A HD23 1 1 
ATOM   2569 N  N    . GLY   A 1 173 ? 3.959   -7.444  -20.121 1   55.57  ? 863  GLY   A N    1 1 
ATOM   2570 C  CA   . GLY   A 1 173 ? 4.715   -8.651  -19.821 1   57.11  ? 863  GLY   A CA   1 1 
ATOM   2571 C  C    . GLY   A 1 173 ? 5.859   -8.85   -20.798 1   58.57  ? 863  GLY   A C    1 1 
ATOM   2572 O  O    . GLY   A 1 173 ? 5.854   -8.268  -21.885 1   58.63  ? 863  GLY   A O    1 1 
ATOM   2573 H  H    . GLY   A 1 173 ? 3.011   -7.625  -20.434 0   67.68  ? 863  GLY   A H    1 1 
ATOM   2574 H  HA2  . GLY   A 1 173 ? 5.12    -8.588  -18.812 0   70.8   ? 863  GLY   A HA2  1 1 
ATOM   2575 H  HA3  . GLY   A 1 173 ? 4.055   -9.516  -19.872 0   71.88  ? 863  GLY   A HA3  1 1 
ATOM   2576 N  N    . ALA   A 1 174 ? 6.843   -9.679  -20.429 1   59.51  ? 864  ALA   A N    1 1 
ATOM   2577 C  CA   . ALA   A 1 174 ? 8.015   -9.944  -21.266 1   60.84  ? 864  ALA   A CA   1 1 
ATOM   2578 C  C    . ALA   A 1 174 ? 7.665   -10.355 -22.705 1   61.89  ? 864  ALA   A C    1 1 
ATOM   2579 O  O    . ALA   A 1 174 ? 8.3     -9.876  -23.645 1   61.98  ? 864  ALA   A O    1 1 
ATOM   2580 C  CB   . ALA   A 1 174 ? 8.875   -11.019 -20.62  1   61.15  ? 864  ALA   A CB   1 1 
ATOM   2581 H  H    . ALA   A 1 174 ? 6.851   -10.184 -19.548 0   75.66  ? 864  ALA   A H    1 1 
ATOM   2582 H  HA   . ALA   A 1 174 ? 8.616   -9.037  -21.32  0   75.78  ? 864  ALA   A HA   1 1 
ATOM   2583 H  HB1  . ALA   A 1 174 ? 9.741   -11.204 -21.253 0   79.64  ? 864  ALA   A HB1  1 1 
ATOM   2584 H  HB2  . ALA   A 1 174 ? 9.198   -10.671 -19.64  0   78.74  ? 864  ALA   A HB2  1 1 
ATOM   2585 H  HB3  . ALA   A 1 174 ? 8.289   -11.931 -20.516 0   80.23  ? 864  ALA   A HB3  1 1 
ATOM   2586 N  N    . GLU   A 1 175 ? 6.652   -11.225 -22.874 1   62.46  ? 865  GLU   A N    1 1 
ATOM   2587 C  CA   . GLU   A 1 175 ? 6.22    -11.712 -24.189 1   63.45  ? 865  GLU   A CA   1 1 
ATOM   2588 C  C    . GLU   A 1 175 ? 5.157   -10.807 -24.838 1   63.94  ? 865  GLU   A C    1 1 
ATOM   2589 O  O    . GLU   A 1 175 ? 5.057   -10.77  -26.063 1   64.23  ? 865  GLU   A O    1 1 
ATOM   2590 C  CB   . GLU   A 1 175 ? 5.651   -13.141 -24.069 1   66     ? 865  GLU   A CB   1 1 
ATOM   2591 C  CG   . GLU   A 1 175 ? 6.627   -14.194 -23.559 1   71     ? 865  GLU   A CG   1 1 
ATOM   2592 C  CD   . GLU   A 1 175 ? 7.445   -14.895 -24.627 1   77.83  ? 865  GLU   A CD   1 1 
ATOM   2593 O  OE1  . GLU   A 1 175 ? 7.583   -16.137 -24.543 1   79.42  ? 865  GLU   A OE1  1 1 
ATOM   2594 O  OE2  . GLU   A 1 175 ? 7.946   -14.209 -25.548 1   79.89  ? 865  GLU   A OE2  1 1 
ATOM   2595 H  H    . GLU   A 1 175 ? 6.104   -11.604 -22.109 0   80.45  ? 865  GLU   A H    1 1 
ATOM   2596 H  HA   . GLU   A 1 175 ? 7.076   -11.766 -24.86  0   81.77  ? 865  GLU   A HA   1 1 
ATOM   2597 H  HB2  . GLU   A 1 175 ? 4.801   -13.119 -23.389 0   86.13  ? 865  GLU   A HB2  1 1 
ATOM   2598 H  HB3  . GLU   A 1 175 ? 5.317   -13.457 -25.055 0   86.73  ? 865  GLU   A HB3  1 1 
ATOM   2599 H  HG2  . GLU   A 1 175 ? 7.326   -13.744 -22.857 0   92.56  ? 865  GLU   A HG2  1 1 
ATOM   2600 H  HG3  . GLU   A 1 175 ? 6.05    -14.959 -23.042 0   94.34  ? 865  GLU   A HG3  1 1 
ATOM   2601 N  N    . GLU   A 1 176 ? 4.361   -10.095 -24.023 1   63.83  ? 866  GLU   A N    1 1 
ATOM   2602 C  CA   . GLU   A 1 176 ? 3.265   -9.242  -24.496 1   64.25  ? 866  GLU   A CA   1 1 
ATOM   2603 C  C    . GLU   A 1 176 ? 3.717   -7.961  -25.205 1   63.98  ? 866  GLU   A C    1 1 
ATOM   2604 O  O    . GLU   A 1 176 ? 4.564   -7.238  -24.685 1   64.22  ? 866  GLU   A O    1 1 
ATOM   2605 C  CB   . GLU   A 1 176 ? 2.362   -8.836  -23.316 1   66.96  ? 866  GLU   A CB   1 1 
ATOM   2606 C  CG   . GLU   A 1 176 ? 1.557   -9.978  -22.713 1   72.02  ? 866  GLU   A CG   1 1 
ATOM   2607 C  CD   . GLU   A 1 176 ? 0.777   -9.622  -21.46  1   78.53  ? 866  GLU   A CD   1 1 
ATOM   2608 O  OE1  . GLU   A 1 176 ? 0.921   -8.481  -20.964 1   79.98  ? 866  GLU   A OE1  1 1 
ATOM   2609 O  OE2  . GLU   A 1 176 ? 0.021   -10.492 -20.97  1   80.82  ? 866  GLU   A OE2  1 1 
ATOM   2610 H  H    . GLU   A 1 176 ? 4.466   -10.079 -23.013 0   79.32  ? 866  GLU   A H    1 1 
ATOM   2611 H  HA   . GLU   A 1 176 ? 2.657   -9.823  -25.187 0   79.26  ? 866  GLU   A HA   1 1 
ATOM   2612 H  HB2  . GLU   A 1 176 ? 2.985   -8.402  -22.535 0   79.99  ? 866  GLU   A HB2  1 1 
ATOM   2613 H  HB3  . GLU   A 1 176 ? 1.656   -8.086  -23.669 0   79.53  ? 866  GLU   A HB3  1 1 
ATOM   2614 H  HG2  . GLU   A 1 176 ? 0.846   -10.329 -23.459 0   87.9   ? 866  GLU   A HG2  1 1 
ATOM   2615 H  HG3  . GLU   A 1 176 ? 2.236   -10.789 -22.453 0   88.48  ? 866  GLU   A HG3  1 1 
ATOM   2616 N  N    . LYS   A 1 177 ? 3.079   -7.642  -26.349 1   63.31  ? 867  LYS   A N    1 1 
ATOM   2617 C  CA   . LYS   A 1 177 ? 3.319   -6.413  -27.122 1   63.14  ? 867  LYS   A CA   1 1 
ATOM   2618 C  C    . LYS   A 1 177 ? 2.149   -5.399  -26.987 1   62.7   ? 867  LYS   A C    1 1 
ATOM   2619 O  O    . LYS   A 1 177 ? 2.251   -4.297  -27.526 1   62.95  ? 867  LYS   A O    1 1 
ATOM   2620 C  CB   . LYS   A 1 177 ? 3.519   -6.746  -28.622 1   64.99  ? 867  LYS   A CB   1 1 
ATOM   2621 C  CG   . LYS   A 1 177 ? 4.961   -7.005  -29.05  1   69.25  ? 867  LYS   A CG   1 1 
ATOM   2622 C  CD   . LYS   A 1 177 ? 5.097   -6.944  -30.566 1   73.89  ? 867  LYS   A CD   1 1 
ATOM   2623 C  CE   . LYS   A 1 177 ? 6.497   -7.255  -31.042 1   77.71  ? 867  LYS   A CE   1 1 
ATOM   2624 N  NZ   . LYS   A 1 177 ? 6.625   -7.203  -32.531 1   79.88  ? 867  LYS   A NZ   1 1 
ATOM   2625 H  H    . LYS   A 1 177 ? 2.359   -8.228  -26.761 0   76.08  ? 867  LYS   A H    1 1 
ATOM   2626 H  HA   . LYS   A 1 177 ? 4.208   -5.906  -26.751 0   73.04  ? 867  LYS   A HA   1 1 
ATOM   2627 H  HB2  . LYS   A 1 177 ? 2.947   -7.639  -28.869 0   76.98  ? 867  LYS   A HB2  1 1 
ATOM   2628 H  HB3  . LYS   A 1 177 ? 3.149   -5.917  -29.223 0   74.81  ? 867  LYS   A HB3  1 1 
ATOM   2629 H  HG2  . LYS   A 1 177 ? 5.614   -6.247  -28.619 0   79.8   ? 867  LYS   A HG2  1 1 
ATOM   2630 H  HG3  . LYS   A 1 177 ? 5.266   -7.997  -28.718 0   81.95  ? 867  LYS   A HG3  1 1 
ATOM   2631 H  HD2  . LYS   A 1 177 ? 4.421   -7.674  -31.012 0   86.15  ? 867  LYS   A HD2  1 1 
ATOM   2632 H  HD3  . LYS   A 1 177 ? 4.839   -5.943  -30.908 0   84.02  ? 867  LYS   A HD3  1 1 
ATOM   2633 H  HE2  . LYS   A 1 177 ? 7.186   -6.521  -30.627 0   89.07  ? 867  LYS   A HE2  1 1 
ATOM   2634 H  HE3  . LYS   A 1 177 ? 6.773   -8.257  -30.717 0   91.17  ? 867  LYS   A HE3  1 1 
ATOM   2635 H  HZ1  . LYS   A 1 177 ? 7.278   -7.916  -32.841 0   93.27  ? 867  LYS   A HZ1  1 1 
ATOM   2636 H  HZ2  . LYS   A 1 177 ? 5.733   -7.359  -32.991 0   92.07  ? 867  LYS   A HZ2  1 1 
ATOM   2637 H  HZ3  . LYS   A 1 177 ? 6.983   -6.297  -32.816 0   91.03  ? 867  LYS   A HZ3  1 1 
ATOM   2638 N  N    . GLU   A 1 178 ? 1.048   -5.755  -26.289 1   61.91  ? 868  GLU   A N    1 1 
ATOM   2639 C  CA   . GLU   A 1 178 ? -0.105  -4.875  -26.161 1   61.68  ? 868  GLU   A CA   1 1 
ATOM   2640 C  C    . GLU   A 1 178 ? -0.938  -5.177  -24.912 1   61.25  ? 868  GLU   A C    1 1 
ATOM   2641 O  O    . GLU   A 1 178 ? -0.888  -6.286  -24.377 1   61.52  ? 868  GLU   A O    1 1 
ATOM   2642 C  CB   . GLU   A 1 178 ? -0.973  -4.986  -27.426 1   63.77  ? 868  GLU   A CB   1 1 
ATOM   2643 C  CG   . GLU   A 1 178 ? -1.625  -6.338  -27.655 1   68.06  ? 868  GLU   A CG   1 1 
ATOM   2644 C  CD   . GLU   A 1 178 ? -2.156  -6.569  -29.059 1   73.87  ? 868  GLU   A CD   1 1 
ATOM   2645 O  OE1  . GLU   A 1 178 ? -1.987  -5.68   -29.925 1   74.51  ? 868  GLU   A OE1  1 1 
ATOM   2646 O  OE2  . GLU   A 1 178 ? -2.749  -7.647  -29.291 1   76.45  ? 868  GLU   A OE2  1 1 
ATOM   2647 H  H    . GLU   A 1 178 ? 0.919   -6.635  -25.801 0   72.63  ? 868  GLU   A H    1 1 
ATOM   2648 H  HA   . GLU   A 1 178 ? 0.233   -3.843  -26.077 0   69.1   ? 868  GLU   A HA   1 1 
ATOM   2649 H  HB2  . GLU   A 1 178 ? -1.751  -4.228  -27.37  0   71.94  ? 868  GLU   A HB2  1 1 
ATOM   2650 H  HB3  . GLU   A 1 178 ? -0.331  -4.796  -28.285 0   72.3   ? 868  GLU   A HB3  1 1 
ATOM   2651 H  HG2  . GLU   A 1 178 ? -0.903  -7.127  -27.453 0   79.65  ? 868  GLU   A HG2  1 1 
ATOM   2652 H  HG3  . GLU   A 1 178 ? -2.466  -6.439  -26.97  0   79.14  ? 868  GLU   A HG3  1 1 
ATOM   2653 N  N    . TYR   A 1 179 ? -1.691  -4.175  -24.443 1   60.48  ? 869  TYR   A N    1 1 
ATOM   2654 C  CA   . TYR   A 1 179 ? -2.556  -4.298  -23.272 1   60.29  ? 869  TYR   A CA   1 1 
ATOM   2655 C  C    . TYR   A 1 179 ? -4.021  -4.216  -23.706 1   59.83  ? 869  TYR   A C    1 1 
ATOM   2656 O  O    . TYR   A 1 179 ? -4.406  -3.253  -24.365 1   59.85  ? 869  TYR   A O    1 1 
ATOM   2657 C  CB   . TYR   A 1 179 ? -2.242  -3.189  -22.253 1   60.32  ? 869  TYR   A CB   1 1 
ATOM   2658 C  CG   . TYR   A 1 179 ? -3.177  -3.182  -21.062 1   61.21  ? 869  TYR   A CG   1 1 
ATOM   2659 C  CD1  . TYR   A 1 179 ? -3.086  -4.154  -20.076 1   62.28  ? 869  TYR   A CD1  1 1 
ATOM   2660 C  CD2  . TYR   A 1 179 ? -4.146  -2.2    -20.918 1   62.1   ? 869  TYR   A CD2  1 1 
ATOM   2661 C  CE1  . TYR   A 1 179 ? -3.945  -4.158  -18.985 1   63.17  ? 869  TYR   A CE1  1 1 
ATOM   2662 C  CE2  . TYR   A 1 179 ? -5.01   -2.193  -19.831 1   63.03  ? 869  TYR   A CE2  1 1 
ATOM   2663 C  CZ   . TYR   A 1 179 ? -4.904  -3.173  -18.862 1   64.03  ? 869  TYR   A CZ   1 1 
ATOM   2664 O  OH   . TYR   A 1 179 ? -5.747  -3.174  -17.777 1   65.6   ? 869  TYR   A OH   1 1 
ATOM   2665 H  H    . TYR   A 1 179 ? -1.723  -3.252  -24.863 0   67.57  ? 869  TYR   A H    1 1 
ATOM   2666 H  HA   . TYR   A 1 179 ? -2.394  -5.253  -22.773 0   69.96  ? 869  TYR   A HA   1 1 
ATOM   2667 H  HB2  . TYR   A 1 179 ? -1.23   -3.335  -21.879 0   67.51  ? 869  TYR   A HB2  1 1 
ATOM   2668 H  HB3  . TYR   A 1 179 ? -2.313  -2.223  -22.749 0   66.53  ? 869  TYR   A HB3  1 1 
ATOM   2669 H  HD1  . TYR   A 1 179 ? -2.339  -4.925  -20.164 0   71.7   ? 869  TYR   A HD1  1 1 
ATOM   2670 H  HD2  . TYR   A 1 179 ? -4.244  -1.438  -21.672 0   68.16  ? 869  TYR   A HD2  1 1 
ATOM   2671 H  HE1  . TYR   A 1 179 ? -3.853  -4.921  -18.23  0   73.26  ? 869  TYR   A HE1  1 1 
ATOM   2672 H  HE2  . TYR   A 1 179 ? -5.759  -1.423  -19.75  0   69.88  ? 869  TYR   A HE2  1 1 
ATOM   2673 H  HH   . TYR   A 1 179 ? -6.114  -2.265  -17.62  0   73.7   ? 869  TYR   A HH   1 1 
ATOM   2674 N  N    . HIS   A 1 180 ? -4.832  -5.212  -23.322 1   59.31  ? 870  HIS   A N    1 1 
ATOM   2675 C  CA   . HIS   A 1 180 ? -6.263  -5.251  -23.629 1   59.26  ? 870  HIS   A CA   1 1 
ATOM   2676 C  C    . HIS   A 1 180 ? -7.005  -4.792  -22.373 1   58.45  ? 870  HIS   A C    1 1 
ATOM   2677 O  O    . HIS   A 1 180 ? -7.003  -5.49   -21.361 1   58.51  ? 870  HIS   A O    1 1 
ATOM   2678 C  CB   . HIS   A 1 180 ? -6.693  -6.668  -24.047 1   60.52  ? 870  HIS   A CB   1 1 
ATOM   2679 C  CG   . HIS   A 1 180 ? -6.289  -7.031  -25.445 1   63.5   ? 870  HIS   A CG   1 1 
ATOM   2680 N  ND1  . HIS   A 1 180 ? -5.141  -6.521  -26.022 1   65.54  ? 870  HIS   A ND1  1 1 
ATOM   2681 C  CD2  . HIS   A 1 180 ? -6.906  -7.836  -26.34  1   64.85  ? 870  HIS   A CD2  1 1 
ATOM   2682 C  CE1  . HIS   A 1 180 ? -5.101  -7.023  -27.247 1   66.07  ? 870  HIS   A CE1  1 1 
ATOM   2683 N  NE2  . HIS   A 1 180 ? -6.134  -7.831  -27.475 1   66     ? 870  HIS   A NE2  1 1 
ATOM   2684 H  H    . HIS   A 1 180 ? -4.522  -6.01   -22.776 0   70.64  ? 870  HIS   A H    1 1 
ATOM   2685 H  HA   . HIS   A 1 180 ? -6.5    -4.573  -24.446 0   69.66  ? 870  HIS   A HA   1 1 
ATOM   2686 H  HB2  . HIS   A 1 180 ? -6.253  -7.399  -23.371 0   74.44  ? 870  HIS   A HB2  1 1 
ATOM   2687 H  HB3  . HIS   A 1 180 ? -7.779  -6.73   -23.993 0   74.4   ? 870  HIS   A HB3  1 1 
ATOM   2688 H  HD2  . HIS   A 1 180 ? -7.824  -8.378  -26.188 0   80.97  ? 870  HIS   A HD2  1 1 
ATOM   2689 H  HE1  . HIS   A 1 180 ? -4.347  -6.791  -27.975 0   78.24  ? 870  HIS   A HE1  1 1 
ATOM   2690 H  HE2  . HIS   A 1 180 ? -6.318  -8.348  -28.329 0   81.24  ? 870  HIS   A HE2  1 1 
ATOM   2691 N  N    . ALA   A 1 181 ? -7.602  -3.599  -22.43  1   57.56  ? 871  ALA   A N    1 1 
ATOM   2692 C  CA   . ALA   A 1 181 ? -8.279  -2.98   -21.295 1   57.36  ? 871  ALA   A CA   1 1 
ATOM   2693 C  C    . ALA   A 1 181 ? -9.713  -3.481  -21.042 1   56.83  ? 871  ALA   A C    1 1 
ATOM   2694 O  O    . ALA   A 1 181 ? -10.345 -4.033  -21.942 1   56.6   ? 871  ALA   A O    1 1 
ATOM   2695 C  CB   . ALA   A 1 181 ? -8.289  -1.472  -21.497 1   57.6   ? 871  ALA   A CB   1 1 
ATOM   2696 H  H    . ALA   A 1 181 ? -7.63   -3.025  -23.266 0   66.79  ? 871  ALA   A H    1 1 
ATOM   2697 H  HA   . ALA   A 1 181 ? -7.7    -3.169  -20.392 0   67.1   ? 871  ALA   A HA   1 1 
ATOM   2698 H  HB1  . ALA   A 1 181 ? -8.783  -1.01   -20.643 0   65.53  ? 871  ALA   A HB1  1 1 
ATOM   2699 H  HB2  . ALA   A 1 181 ? -7.262  -1.119  -21.569 0   64.68  ? 871  ALA   A HB2  1 1 
ATOM   2700 H  HB3  . ALA   A 1 181 ? -8.833  -1.23   -22.408 0   65.66  ? 871  ALA   A HB3  1 1 
ATOM   2701 N  N    . GLU   A 1 182 ? -10.214 -3.271  -19.801 1   56.55  ? 872  GLU   A N    1 1 
ATOM   2702 C  CA   . GLU   A 1 182 ? -11.587 -3.578  -19.379 1   56.89  ? 872  GLU   A CA   1 1 
ATOM   2703 C  C    . GLU   A 1 182 ? -12.492 -2.352  -19.731 1   56.42  ? 872  GLU   A C    1 1 
ATOM   2704 O  O    . GLU   A 1 182 ? -12.001 -1.35   -20.253 1   56.94  ? 872  GLU   A O    1 1 
ATOM   2705 C  CB   . GLU   A 1 182 ? -11.614 -3.887  -17.857 1   59.63  ? 872  GLU   A CB   1 1 
ATOM   2706 C  CG   . GLU   A 1 182 ? -11.058 -5.253  -17.486 1   65.25  ? 872  GLU   A CG   1 1 
ATOM   2707 C  CD   . GLU   A 1 182 ? -11.986 -6.423  -17.754 1   72.55  ? 872  GLU   A CD   1 1 
ATOM   2708 O  OE1  . GLU   A 1 182 ? -13.16  -6.372  -17.319 1   73.38  ? 872  GLU   A OE1  1 1 
ATOM   2709 O  OE2  . GLU   A 1 182 ? -11.533 -7.404  -18.388 1   75.38  ? 872  GLU   A OE2  1 1 
ATOM   2710 H  H    . GLU   A 1 182 ? -9.655  -2.864  -19.058 0   67.21  ? 872  GLU   A H    1 1 
ATOM   2711 H  HA   . GLU   A 1 182 ? -11.961 -4.45   -19.914 0   71.11  ? 872  GLU   A HA   1 1 
ATOM   2712 H  HB2  . GLU   A 1 182 ? -11.028 -3.138  -17.326 0   71.82  ? 872  GLU   A HB2  1 1 
ATOM   2713 H  HB3  . GLU   A 1 182 ? -12.642 -3.842  -17.502 0   73.93  ? 872  GLU   A HB3  1 1 
ATOM   2714 H  HG2  . GLU   A 1 182 ? -10.14  -5.42   -18.048 0   79.42  ? 872  GLU   A HG2  1 1 
ATOM   2715 H  HG3  . GLU   A 1 182 ? -10.831 -5.249  -16.421 0   79.93  ? 872  GLU   A HG3  1 1 
ATOM   2716 N  N    . GLY   A 1 183 ? -13.786 -2.418  -19.432 1   55.45  ? 873  GLY   A N    1 1 
ATOM   2717 C  CA   . GLY   A 1 183 ? -14.712 -1.327  -19.719 1   54.81  ? 873  GLY   A CA   1 1 
ATOM   2718 C  C    . GLY   A 1 183 ? -14.623 -0.088  -18.841 1   53.73  ? 873  GLY   A C    1 1 
ATOM   2719 O  O    . GLY   A 1 183 ? -15.6   0.66    -18.753 1   53.94  ? 873  GLY   A O    1 1 
ATOM   2720 H  H    . GLY   A 1 183 ? -14.238 -3.219  -19.003 0   70.34  ? 873  GLY   A H    1 1 
ATOM   2721 H  HA2  . GLY   A 1 183 ? -14.58  -1.013  -20.754 0   67.39  ? 873  GLY   A HA2  1 1 
ATOM   2722 H  HA3  . GLY   A 1 183 ? -15.725 -1.714  -19.623 0   69.43  ? 873  GLY   A HA3  1 1 
ATOM   2723 N  N    . GLY   A 1 184 ? -13.48  0.151   -18.2   1   52.44  ? 874  GLY   A N    1 1 
ATOM   2724 C  CA   . GLY   A 1 184 ? -13.292 1.328   -17.359 1   51.7   ? 874  GLY   A CA   1 1 
ATOM   2725 C  C    . GLY   A 1 184 ? -13.171 2.604   -18.17  1   50.46  ? 874  GLY   A C    1 1 
ATOM   2726 O  O    . GLY   A 1 184 ? -12.816 2.553   -19.349 1   50.88  ? 874  GLY   A O    1 1 
ATOM   2727 H  H    . GLY   A 1 184 ? -12.654 -0.437  -18.227 0   62.99  ? 874  GLY   A H    1 1 
ATOM   2728 H  HA2  . GLY   A 1 184 ? -14.131 1.429   -16.671 0   61.97  ? 874  GLY   A HA2  1 1 
ATOM   2729 H  HA3  . GLY   A 1 184 ? -12.384 1.208   -16.77  0   60.63  ? 874  GLY   A HA3  1 1 
ATOM   2730 N  N    . LYS   A 1 185 ? -13.45  3.761   -17.542 1   48.77  ? 875  LYS   A N    1 1 
ATOM   2731 C  CA   . LYS   A 1 185 ? -13.401 5.065   -18.218 1   47.59  ? 875  LYS   A CA   1 1 
ATOM   2732 C  C    . LYS   A 1 185 ? -11.999 5.407   -18.741 1   45.6   ? 875  LYS   A C    1 1 
ATOM   2733 O  O    . LYS   A 1 185 ? -11.02  5.241   -18.018 1   45.57  ? 875  LYS   A O    1 1 
ATOM   2734 C  CB   . LYS   A 1 185 ? -13.877 6.194   -17.288 1   49.79  ? 875  LYS   A CB   1 1 
ATOM   2735 C  CG   . LYS   A 1 185 ? -15.382 6.208   -17.038 1   54.85  ? 875  LYS   A CG   1 1 
ATOM   2736 C  CD   . LYS   A 1 185 ? -15.802 7.137   -15.903 1   59.72  ? 875  LYS   A CD   1 1 
ATOM   2737 C  CE   . LYS   A 1 185 ? -15.748 8.605   -16.279 1   64.05  ? 875  LYS   A CE   1 1 
ATOM   2738 N  NZ   . LYS   A 1 185 ? -16.428 9.495   -15.288 1   66.8   ? 875  LYS   A NZ   1 1 
ATOM   2739 H  H    . LYS   A 1 185 ? -13.698 3.807   -16.559 0   56.66  ? 875  LYS   A H    1 1 
ATOM   2740 H  HA   . LYS   A 1 185 ? -14.073 5.023   -19.073 0   54.57  ? 875  LYS   A HA   1 1 
ATOM   2741 H  HB2  . LYS   A 1 185 ? -13.367 6.109   -16.33  0   55.8   ? 875  LYS   A HB2  1 1 
ATOM   2742 H  HB3  . LYS   A 1 185 ? -13.61  7.138   -17.759 0   55.12  ? 875  LYS   A HB3  1 1 
ATOM   2743 H  HG2  . LYS   A 1 185 ? -15.89  6.523   -17.948 0   62.69  ? 875  LYS   A HG2  1 1 
ATOM   2744 H  HG3  . LYS   A 1 185 ? -15.702 5.204   -16.767 0   63.58  ? 875  LYS   A HG3  1 1 
ATOM   2745 H  HD2  . LYS   A 1 185 ? -16.829 6.894   -15.633 0   68.67  ? 875  LYS   A HD2  1 1 
ATOM   2746 H  HD3  . LYS   A 1 185 ? -15.145 6.983   -15.048 0   67.07  ? 875  LYS   A HD3  1 1 
ATOM   2747 H  HE2  . LYS   A 1 185 ? -14.708 8.925   -16.331 0   69.63  ? 875  LYS   A HE2  1 1 
ATOM   2748 H  HE3  . LYS   A 1 185 ? -16.232 8.752   -17.243 0   70.99  ? 875  LYS   A HE3  1 1 
ATOM   2749 H  HZ1  . LYS   A 1 185 ? -16.928 10.23   -15.778 0   74.08  ? 875  LYS   A HZ1  1 1 
ATOM   2750 H  HZ2  . LYS   A 1 185 ? -17.083 8.987   -14.702 0   75.02  ? 875  LYS   A HZ2  1 1 
ATOM   2751 H  HZ3  . LYS   A 1 185 ? -15.73  9.929   -14.692 0   73.16  ? 875  LYS   A HZ3  1 1 
ATOM   2752 N  N    . VAL   A 1 186 ? -11.925 5.932   -19.98  1   43.73  ? 876  VAL   A N    1 1 
ATOM   2753 C  CA   . VAL   A 1 186 ? -10.671 6.28    -20.655 1   42.31  ? 876  VAL   A CA   1 1 
ATOM   2754 C  C    . VAL   A 1 186 ? -10.818 7.599   -21.488 1   40.22  ? 876  VAL   A C    1 1 
ATOM   2755 O  O    . VAL   A 1 186 ? -11.925 7.932   -21.908 1   39.77  ? 876  VAL   A O    1 1 
ATOM   2756 C  CB   . VAL   A 1 186 ? -10.144 5.093   -21.531 1   43.11  ? 876  VAL   A CB   1 1 
ATOM   2757 C  CG1  . VAL   A 1 186 ? -9.426  4.034   -20.696 1   43.53  ? 876  VAL   A CG1  1 1 
ATOM   2758 C  CG2  . VAL   A 1 186 ? -11.256 4.463   -22.376 1   43.77  ? 876  VAL   A CG2  1 1 
ATOM   2759 H  H    . VAL   A 1 186 ? -12.745 6.172   -20.528 0   48.59  ? 876  VAL   A H    1 1 
ATOM   2760 H  HA   . VAL   A 1 186 ? -9.942  6.494   -19.875 0   44.98  ? 876  VAL   A HA   1 1 
ATOM   2761 H  HB   . VAL   A 1 186 ? -9.407  5.489   -22.229 0   45.8   ? 876  VAL   A HB   1 1 
ATOM   2762 H  HG11 . VAL   A 1 186 ? -9.08   3.239   -21.355 0   47.76  ? 876  VAL   A HG11 1 1 
ATOM   2763 H  HG12 . VAL   A 1 186 ? -8.578  4.495   -20.192 0   46.65  ? 876  VAL   A HG12 1 1 
ATOM   2764 H  HG13 . VAL   A 1 186 ? -10.121 3.631   -19.961 0   48.28  ? 876  VAL   A HG13 1 1 
ATOM   2765 H  HG21 . VAL   A 1 186 ? -10.82  3.668   -22.979 0   48.7   ? 876  VAL   A HG21 1 1 
ATOM   2766 H  HG22 . VAL   A 1 186 ? -12.03  4.043   -21.735 0   49.37  ? 876  VAL   A HG22 1 1 
ATOM   2767 H  HG23 . VAL   A 1 186 ? -11.678 5.227   -23.027 0   48.14  ? 876  VAL   A HG23 1 1 
ATOM   2768 N  N    . PRO   A 1 187 ? -9.719  8.359   -21.739 1   38.63  ? 877  PRO   A N    1 1 
ATOM   2769 C  CA   . PRO   A 1 187 ? -9.858  9.635   -22.483 1   37.66  ? 877  PRO   A CA   1 1 
ATOM   2770 C  C    . PRO   A 1 187 ? -9.904  9.516   -24.011 1   36.26  ? 877  PRO   A C    1 1 
ATOM   2771 O  O    . PRO   A 1 187 ? -8.871  9.654   -24.662 1   36.02  ? 877  PRO   A O    1 1 
ATOM   2772 C  CB   . PRO   A 1 187 ? -8.63   10.425  -22.029 1   38.56  ? 877  PRO   A CB   1 1 
ATOM   2773 C  CG   . PRO   A 1 187 ? -7.593  9.375   -21.764 1   39.23  ? 877  PRO   A CG   1 1 
ATOM   2774 C  CD   . PRO   A 1 187 ? -8.317  8.137   -21.305 1   38     ? 877  PRO   A CD   1 1 
ATOM   2775 H  HA   . PRO   A 1 187 ? -10.737 10.184  -22.149 0   38.77  ? 877  PRO   A HA   1 1 
ATOM   2776 H  HB2  . PRO   A 1 187 ? -8.3    11.125  -22.795 0   37.72  ? 877  PRO   A HB2  1 1 
ATOM   2777 H  HB3  . PRO   A 1 187 ? -8.873  10.954  -21.109 0   38.24  ? 877  PRO   A HB3  1 1 
ATOM   2778 H  HG2  . PRO   A 1 187 ? -7.04   9.174   -22.68  0   38.56  ? 877  PRO   A HG2  1 1 
ATOM   2779 H  HG3  . PRO   A 1 187 ? -6.924  9.733   -20.982 0   38.45  ? 877  PRO   A HG3  1 1 
ATOM   2780 H  HD2  . PRO   A 1 187 ? -7.904  7.256   -21.793 0   38.82  ? 877  PRO   A HD2  1 1 
ATOM   2781 H  HD3  . PRO   A 1 187 ? -8.253  8.06    -20.22  0   38.77  ? 877  PRO   A HD3  1 1 
ATOM   2782 N  N    . ILE   A 1 188 ? -11.119 9.358   -24.577 1   34.92  ? 878  ILE   A N    1 1 
ATOM   2783 C  CA   . ILE   A 1 188 ? -11.353 9.156   -26.019 1   34.49  ? 878  ILE   A CA   1 1 
ATOM   2784 C  C    . ILE   A 1 188 ? -10.637 10.178  -26.931 1   33.08  ? 878  ILE   A C    1 1 
ATOM   2785 O  O    . ILE   A 1 188 ? -9.951  9.783   -27.877 1   33.18  ? 878  ILE   A O    1 1 
ATOM   2786 C  CB   . ILE   A 1 188 ? -12.892 9.111   -26.336 1   35.62  ? 878  ILE   A CB   1 1 
ATOM   2787 C  CG1  . ILE   A 1 188 ? -13.647 7.932   -25.624 1   37.14  ? 878  ILE   A CG1  1 1 
ATOM   2788 C  CG2  . ILE   A 1 188 ? -13.171 9.09    -27.849 1   36.3   ? 878  ILE   A CG2  1 1 
ATOM   2789 C  CD1  . ILE   A 1 188 ? -13.222 6.446   -25.944 1   38.7   ? 878  ILE   A CD1  1 1 
ATOM   2790 H  H    . ILE   A 1 188 ? -11.969 9.416   -24.026 0   37     ? 878  ILE   A H    1 1 
ATOM   2791 H  HA   . ILE   A 1 188 ? -10.942 8.178   -26.268 0   36.25  ? 878  ILE   A HA   1 1 
ATOM   2792 H  HB   . ILE   A 1 188 ? -13.316 10.037  -25.951 0   38.27  ? 878  ILE   A HB   1 1 
ATOM   2793 H  HG12 . ILE   A 1 188 ? -13.549 8.06    -24.548 0   41.1   ? 878  ILE   A HG12 1 1 
ATOM   2794 H  HG13 . ILE   A 1 188 ? -14.701 8.011   -25.888 0   42.05  ? 878  ILE   A HG13 1 1 
ATOM   2795 H  HG21 . ILE   A 1 188 ? -14.247 9.005   -27.995 0   40.11  ? 878  ILE   A HG21 1 1 
ATOM   2796 H  HG22 . ILE   A 1 188 ? -12.827 10.012  -28.316 0   38.41  ? 878  ILE   A HG22 1 1 
ATOM   2797 H  HG23 . ILE   A 1 188 ? -12.671 8.236   -28.304 0   39.27  ? 878  ILE   A HG23 1 1 
ATOM   2798 H  HD11 . ILE   A 1 188 ? -13.854 5.777   -25.363 0   44.3   ? 878  ILE   A HD11 1 1 
ATOM   2799 H  HD12 . ILE   A 1 188 ? -13.361 6.247   -27.006 0   43.46  ? 878  ILE   A HD12 1 1 
ATOM   2800 H  HD13 . ILE   A 1 188 ? -12.18  6.292   -25.667 0   42.54  ? 878  ILE   A HD13 1 1 
ATOM   2801 N  N    . LYS   A 1 189 ? -10.797 11.478  -26.659 1   32     ? 879  LYS   A N    1 1 
ATOM   2802 C  CA   . LYS   A 1 189 ? -10.214 12.543  -27.496 1   31.63  ? 879  LYS   A CA   1 1 
ATOM   2803 C  C    . LYS   A 1 189 ? -8.662  12.57   -27.537 1   31.64  ? 879  LYS   A C    1 1 
ATOM   2804 O  O    . LYS   A 1 189 ? -8.091  13.245  -28.396 1   31.59  ? 879  LYS   A O    1 1 
ATOM   2805 C  CB   . LYS   A 1 189 ? -10.771 13.914  -27.082 1   32.03  ? 879  LYS   A CB   1 1 
ATOM   2806 C  CG   . LYS   A 1 189 ? -12.275 14.048  -27.386 1   33.25  ? 879  LYS   A CG   1 1 
ATOM   2807 C  CD   . LYS   A 1 189 ? -12.866 15.352  -26.913 1   34.81  ? 879  LYS   A CD   1 1 
ATOM   2808 C  CE   . LYS   A 1 189 ? -14.352 15.392  -27.213 1   36.61  ? 879  LYS   A CE   1 1 
ATOM   2809 N  NZ   . LYS   A 1 189 ? -14.957 16.742  -27.028 1   37.13  ? 879  LYS   A NZ   1 1 
ATOM   2810 H  H    . LYS   A 1 189 ? -11.306 11.811  -25.847 0   32.6   ? 879  LYS   A H    1 1 
ATOM   2811 H  HA   . LYS   A 1 189 ? -10.529 12.359  -28.522 0   32.08  ? 879  LYS   A HA   1 1 
ATOM   2812 H  HB2  . LYS   A 1 189 ? -10.627 14.054  -26.011 0   32.02  ? 879  LYS   A HB2  1 1 
ATOM   2813 H  HB3  . LYS   A 1 189 ? -10.239 14.694  -27.624 0   31.78  ? 879  LYS   A HB3  1 1 
ATOM   2814 H  HG2  . LYS   A 1 189 ? -12.426 13.981  -28.463 0   33.84  ? 879  LYS   A HG2  1 1 
ATOM   2815 H  HG3  . LYS   A 1 189 ? -12.818 13.246  -26.89  0   34.29  ? 879  LYS   A HG3  1 1 
ATOM   2816 H  HD2  . LYS   A 1 189 ? -12.728 15.448  -25.837 0   35.39  ? 879  LYS   A HD2  1 1 
ATOM   2817 H  HD3  . LYS   A 1 189 ? -12.379 16.175  -27.435 0   34.94  ? 879  LYS   A HD3  1 1 
ATOM   2818 H  HE2  . LYS   A 1 189 ? -14.519 15.093  -28.247 0   38.53  ? 879  LYS   A HE2  1 1 
ATOM   2819 H  HE3  . LYS   A 1 189 ? -14.868 14.706  -26.542 0   39.02  ? 879  LYS   A HE3  1 1 
ATOM   2820 H  HZ1  . LYS   A 1 189 ? -15.733 16.859  -27.673 0   39.9   ? 879  LYS   A HZ1  1 1 
ATOM   2821 H  HZ2  . LYS   A 1 189 ? -15.312 16.836  -26.082 0   39.68  ? 879  LYS   A HZ2  1 1 
ATOM   2822 H  HZ3  . LYS   A 1 189 ? -14.28  17.479  -27.198 0   38.6   ? 879  LYS   A HZ3  1 1 
ATOM   2823 N  N    . TRP   A 1 190 ? -7.993  11.838  -26.635 1   31.38  ? 880  TRP   A N    1 1 
ATOM   2824 C  CA   . TRP   A 1 190 ? -6.532  11.696  -26.633 1   31.74  ? 880  TRP   A CA   1 1 
ATOM   2825 C  C    . TRP   A 1 190 ? -6.094  10.302  -27.143 1   31.84  ? 880  TRP   A C    1 1 
ATOM   2826 O  O    . TRP   A 1 190 ? -4.946  10.133  -27.536 1   32.06  ? 880  TRP   A O    1 1 
ATOM   2827 C  CB   . TRP   A 1 190 ? -5.966  11.951  -25.225 1   31.75  ? 880  TRP   A CB   1 1 
ATOM   2828 C  CG   . TRP   A 1 190 ? -5.89   13.405  -24.856 1   32.39  ? 880  TRP   A CG   1 1 
ATOM   2829 C  CD1  . TRP   A 1 190 ? -4.809  14.219  -24.986 1   33.32  ? 880  TRP   A CD1  1 1 
ATOM   2830 C  CD2  . TRP   A 1 190 ? -6.957  14.229  -24.355 1   32.49  ? 880  TRP   A CD2  1 1 
ATOM   2831 N  NE1  . TRP   A 1 190 ? -5.124  15.494  -24.583 1   33.66  ? 880  TRP   A NE1  1 1 
ATOM   2832 C  CE2  . TRP   A 1 190 ? -6.436  15.528  -24.187 1   33.41  ? 880  TRP   A CE2  1 1 
ATOM   2833 C  CE3  . TRP   A 1 190 ? -8.285  13.985  -23.989 1   32.82  ? 880  TRP   A CE3  1 1 
ATOM   2834 C  CZ2  . TRP   A 1 190 ? -7.199  16.579  -23.683 1   33.98  ? 880  TRP   A CZ2  1 1 
ATOM   2835 C  CZ3  . TRP   A 1 190 ? -9.051  15.035  -23.518 1   33.73  ? 880  TRP   A CZ3  1 1 
ATOM   2836 C  CH2  . TRP   A 1 190 ? -8.508  16.312  -23.366 1   33.96  ? 880  TRP   A CH2  1 1 
ATOM   2837 H  H    . TRP   A 1 190 ? -8.432  11.331  -25.874 0   31.35  ? 880  TRP   A H    1 1 
ATOM   2838 H  HA   . TRP   A 1 190 ? -6.085  12.43   -27.3   0   30.88  ? 880  TRP   A HA   1 1 
ATOM   2839 H  HB2  . TRP   A 1 190 ? -6.591  11.449  -24.487 0   31.23  ? 880  TRP   A HB2  1 1 
ATOM   2840 H  HB3  . TRP   A 1 190 ? -4.956  11.547  -25.181 0   30.69  ? 880  TRP   A HB3  1 1 
ATOM   2841 H  HD1  . TRP   A 1 190 ? -3.849  13.909  -25.363 0   31.84  ? 880  TRP   A HD1  1 1 
ATOM   2842 H  HE1  . TRP   A 1 190 ? -4.463  16.291  -24.571 0   32.06  ? 880  TRP   A HE1  1 1 
ATOM   2843 H  HE3  . TRP   A 1 190 ? -8.722  13.011  -24.128 0   32.57  ? 880  TRP   A HE3  1 1 
ATOM   2844 H  HZ2  . TRP   A 1 190 ? -6.785  17.565  -23.57  0   32.56  ? 880  TRP   A HZ2  1 1 
ATOM   2845 H  HZ3  . TRP   A 1 190 ? -10.078 14.861  -23.246 0   33.64  ? 880  TRP   A HZ3  1 1 
ATOM   2846 H  HH2  . TRP   A 1 190 ? -9.126  17.104  -22.977 0   33.26  ? 880  TRP   A HH2  1 1 
ATOM   2847 N  N    . MET   A 1 191 ? -7.012  9.323   -27.172 1   31.59  ? 881  MET   A N    1 1 
ATOM   2848 C  CA   . MET   A 1 191 ? -6.738  7.943   -27.567 1   31.7   ? 881  MET   A CA   1 1 
ATOM   2849 C  C    . MET   A 1 191 ? -6.6    7.676   -29.054 1   31.73  ? 881  MET   A C    1 1 
ATOM   2850 O  O    . MET   A 1 191 ? -7.287  8.29    -29.869 1   31.72  ? 881  MET   A O    1 1 
ATOM   2851 C  CB   . MET   A 1 191 ? -7.889  7.043   -27.073 1   32.07  ? 881  MET   A CB   1 1 
ATOM   2852 C  CG   . MET   A 1 191 ? -7.796  6.671   -25.62  1   34.44  ? 881  MET   A CG   1 1 
ATOM   2853 S  SD   . MET   A 1 191 ? -9.388  6.263   -24.9   1   39.27  ? 881  MET   A SD   1 1 
ATOM   2854 C  CE   . MET   A 1 191 ? -9.836  4.825   -25.838 1   38.12  ? 881  MET   A CE   1 1 
ATOM   2855 H  H    . MET   A 1 191 ? -7.982  9.478   -26.919 0   31.65  ? 881  MET   A H    1 1 
ATOM   2856 H  HA   . MET   A 1 191 ? -5.809  7.636   -27.088 0   30.93  ? 881  MET   A HA   1 1 
ATOM   2857 H  HB2  . MET   A 1 191 ? -8.845  7.531   -27.259 0   32.85  ? 881  MET   A HB2  1 1 
ATOM   2858 H  HB3  . MET   A 1 191 ? -7.854  6.122   -27.652 0   33.17  ? 881  MET   A HB3  1 1 
ATOM   2859 H  HG2  . MET   A 1 191 ? -7.15   5.8     -25.523 0   35.45  ? 881  MET   A HG2  1 1 
ATOM   2860 H  HG3  . MET   A 1 191 ? -7.379  7.506   -25.059 0   34.58  ? 881  MET   A HG3  1 1 
ATOM   2861 H  HE1  . MET   A 1 191 ? -10.777 4.44    -25.45  0   42.23  ? 881  MET   A HE1  1 1 
ATOM   2862 H  HE2  . MET   A 1 191 ? -9.959  5.083   -26.889 0   41.09  ? 881  MET   A HE2  1 1 
ATOM   2863 H  HE3  . MET   A 1 191 ? -9.058  4.071   -25.727 0   41.41  ? 881  MET   A HE3  1 1 
ATOM   2864 N  N    . ALA   A 1 192 ? -5.806  6.65    -29.391 1   31.8   ? 882  ALA   A N    1 1 
ATOM   2865 C  CA   . ALA   A 1 192 ? -5.675  6.18    -30.763 1   32.32  ? 882  ALA   A CA   1 1 
ATOM   2866 C  C    . ALA   A 1 192 ? -6.963  5.461   -31.194 1   33.2   ? 882  ALA   A C    1 1 
ATOM   2867 O  O    . ALA   A 1 192 ? -7.725  4.983   -30.348 1   33.25  ? 882  ALA   A O    1 1 
ATOM   2868 C  CB   . ALA   A 1 192 ? -4.495  5.238   -30.877 1   31.86  ? 882  ALA   A CB   1 1 
ATOM   2869 H  H    . ALA   A 1 192 ? -5.241  6.125   -28.731 0   31.71  ? 882  ALA   A H    1 1 
ATOM   2870 H  HA   . ALA   A 1 192 ? -5.51   7.024   -31.431 0   31.76  ? 882  ALA   A HA   1 1 
ATOM   2871 H  HB1  . ALA   A 1 192 ? -4.408  4.902   -31.909 0   32.31  ? 882  ALA   A HB1  1 1 
ATOM   2872 H  HB2  . ALA   A 1 192 ? -3.594  5.775   -30.585 0   31.47  ? 882  ALA   A HB2  1 1 
ATOM   2873 H  HB3  . ALA   A 1 192 ? -4.65   4.385   -30.218 0   32.73  ? 882  ALA   A HB3  1 1 
ATOM   2874 N  N    . LEU   A 1 193 ? -7.208  5.389   -32.508 1   33.83  ? 883  LEU   A N    1 1 
ATOM   2875 C  CA   . LEU   A 1 193 ? -8.414  4.75    -33.022 1   35.01  ? 883  LEU   A CA   1 1 
ATOM   2876 C  C    . LEU   A 1 193 ? -8.545  3.269   -32.606 1   36.03  ? 883  LEU   A C    1 1 
ATOM   2877 O  O    . LEU   A 1 193 ? -9.647  2.855   -32.26  1   36.44  ? 883  LEU   A O    1 1 
ATOM   2878 C  CB   . LEU   A 1 193 ? -8.506  4.903   -34.554 1   35.39  ? 883  LEU   A CB   1 1 
ATOM   2879 C  CG   . LEU   A 1 193 ? -9.718  4.241   -35.248 1   37.29  ? 883  LEU   A CG   1 1 
ATOM   2880 C  CD1  . LEU   A 1 193 ? -11.029 4.89    -34.843 1   37.57  ? 883  LEU   A CD1  1 1 
ATOM   2881 C  CD2  . LEU   A 1 193 ? -9.576  4.303   -36.744 1   38.44  ? 883  LEU   A CD2  1 1 
ATOM   2882 H  H    . LEU   A 1 193 ? -6.591  5.756   -33.226 0   34.56  ? 883  LEU   A H    1 1 
ATOM   2883 H  HA   . LEU   A 1 193 ? -9.254  5.283   -32.582 0   37.44  ? 883  LEU   A HA   1 1 
ATOM   2884 H  HB2  . LEU   A 1 193 ? -8.546  5.967   -34.783 0   37.01  ? 883  LEU   A HB2  1 1 
ATOM   2885 H  HB3  . LEU   A 1 193 ? -7.607  4.472   -34.992 0   37.58  ? 883  LEU   A HB3  1 1 
ATOM   2886 H  HG   . LEU   A 1 193 ? -9.775  3.186   -34.985 0   41.72  ? 883  LEU   A HG   1 1 
ATOM   2887 H  HD11 . LEU   A 1 193 ? -11.841 4.418   -35.394 0   42.52  ? 883  LEU   A HD11 1 1 
ATOM   2888 H  HD12 . LEU   A 1 193 ? -11.201 4.764   -33.776 0   41.63  ? 883  LEU   A HD12 1 1 
ATOM   2889 H  HD13 . LEU   A 1 193 ? -10.987 5.95    -35.087 0   40.76  ? 883  LEU   A HD13 1 1 
ATOM   2890 H  HD21 . LEU   A 1 193 ? -10.442 3.829   -37.203 0   42.96  ? 883  LEU   A HD21 1 1 
ATOM   2891 H  HD22 . LEU   A 1 193 ? -9.509  5.344   -37.055 0   41.21  ? 883  LEU   A HD22 1 1 
ATOM   2892 H  HD23 . LEU   A 1 193 ? -8.669  3.77    -37.028 0   41.9   ? 883  LEU   A HD23 1 1 
ATOM   2893 N  N    . GLU   A 1 194 ? -7.448  2.479   -32.609 1   36.36  ? 884  GLU   A N    1 1 
ATOM   2894 C  CA   . GLU   A 1 194 ? -7.536  1.065   -32.189 1   36.88  ? 884  GLU   A CA   1 1 
ATOM   2895 C  C    . GLU   A 1 194 ? -7.884  0.924   -30.706 1   37.79  ? 884  GLU   A C    1 1 
ATOM   2896 O  O    . GLU   A 1 194 ? -8.511  -0.063  -30.331 1   38.21  ? 884  GLU   A O    1 1 
ATOM   2897 C  CB   . GLU   A 1 194 ? -6.285  0.245   -32.558 1   37.96  ? 884  GLU   A CB   1 1 
ATOM   2898 C  CG   . GLU   A 1 194 ? -5.001  0.596   -31.82  1   40.5   ? 884  GLU   A CG   1 1 
ATOM   2899 C  CD   . GLU   A 1 194 ? -4.263  1.834   -32.296 1   43.07  ? 884  GLU   A CD   1 1 
ATOM   2900 O  OE1  . GLU   A 1 194 ? -3.191  2.133   -31.72  1   43.22  ? 884  GLU   A OE1  1 1 
ATOM   2901 O  OE2  . GLU   A 1 194 ? -4.736  2.492   -33.252 1   43.73  ? 884  GLU   A OE2  1 1 
ATOM   2902 H  H    . GLU   A 1 194 ? -6.529  2.782   -32.913 0   39.27  ? 884  GLU   A H    1 1 
ATOM   2903 H  HA   . GLU   A 1 194 ? -8.358  0.61    -32.739 0   42.65  ? 884  GLU   A HA   1 1 
ATOM   2904 H  HB2  . GLU   A 1 194 ? -6.498  -0.8    -32.34  0   44.17  ? 884  GLU   A HB2  1 1 
ATOM   2905 H  HB3  . GLU   A 1 194 ? -6.103  0.349   -33.627 0   42.91  ? 884  GLU   A HB3  1 1 
ATOM   2906 H  HG2  . GLU   A 1 194 ? -5.209  0.733   -30.76  0   44.6   ? 884  GLU   A HG2  1 1 
ATOM   2907 H  HG3  . GLU   A 1 194 ? -4.317  -0.243  -31.936 0   45.23  ? 884  GLU   A HG3  1 1 
ATOM   2908 N  N    . SER   A 1 195 ? -7.511  1.906   -29.867 1   37.79  ? 885  SER   A N    1 1 
ATOM   2909 C  CA   . SER   A 1 195 ? -7.889  1.896   -28.452 1   38.06  ? 885  SER   A CA   1 1 
ATOM   2910 C  C    . SER   A 1 195 ? -9.395  2.203   -28.285 1   38.3   ? 885  SER   A C    1 1 
ATOM   2911 O  O    . SER   A 1 195 ? -10.015 1.705   -27.347 1   38.05  ? 885  SER   A O    1 1 
ATOM   2912 C  CB   . SER   A 1 195 ? -7.067  2.915   -27.677 1   39.01  ? 885  SER   A CB   1 1 
ATOM   2913 O  OG   . SER   A 1 195 ? -5.679  2.714   -27.896 1   41.15  ? 885  SER   A OG   1 1 
ATOM   2914 H  H    . SER   A 1 195 ? -6.936  2.703   -30.121 0   40.89  ? 885  SER   A H    1 1 
ATOM   2915 H  HA   . SER   A 1 195 ? -7.689  0.913   -28.028 0   43.13  ? 885  SER   A HA   1 1 
ATOM   2916 H  HB2  . SER   A 1 195 ? -7.333  3.907   -28.037 0   41.35  ? 885  SER   A HB2  1 1 
ATOM   2917 H  HB3  . SER   A 1 195 ? -7.317  2.833   -26.621 0   42.21  ? 885  SER   A HB3  1 1 
ATOM   2918 H  HG   . SER   A 1 195 ? -5.191  2.477   -27.063 0   43.73  ? 885  SER   A HG   1 1 
ATOM   2919 N  N    . ILE   A 1 196 ? -9.984  3.008   -29.181 1   38.52  ? 886  ILE   A N    1 1 
ATOM   2920 C  CA   . ILE   A 1 196 ? -11.405 3.345   -29.104 1   39.31  ? 886  ILE   A CA   1 1 
ATOM   2921 C  C    . ILE   A 1 196 ? -12.249 2.144   -29.573 1   40.25  ? 886  ILE   A C    1 1 
ATOM   2922 O  O    . ILE   A 1 196 ? -13.212 1.767   -28.903 1   40.72  ? 886  ILE   A O    1 1 
ATOM   2923 C  CB   . ILE   A 1 196 ? -11.737 4.627   -29.936 1   39.42  ? 886  ILE   A CB   1 1 
ATOM   2924 C  CG1  . ILE   A 1 196 ? -10.991 5.879   -29.378 1   39.83  ? 886  ILE   A CG1  1 1 
ATOM   2925 C  CG2  . ILE   A 1 196 ? -13.266 4.873   -29.948 1   39.57  ? 886  ILE   A CG2  1 1 
ATOM   2926 C  CD1  . ILE   A 1 196 ? -10.906 7.105   -30.323 1   40.57  ? 886  ILE   A CD1  1 1 
ATOM   2927 H  H    . ILE   A 1 196 ? -9.512  3.428   -29.976 0   42.44  ? 886  ILE   A H    1 1 
ATOM   2928 H  HA   . ILE   A 1 196 ? -11.672 3.556   -28.07  0   44.63  ? 886  ILE   A HA   1 1 
ATOM   2929 H  HB   . ILE   A 1 196 ? -11.412 4.461   -30.962 0   43.82  ? 886  ILE   A HB   1 1 
ATOM   2930 H  HG12 . ILE   A 1 196 ? -11.495 6.203   -28.468 0   43.1   ? 886  ILE   A HG12 1 1 
ATOM   2931 H  HG13 . ILE   A 1 196 ? -9.962  5.609   -29.149 0   42.46  ? 886  ILE   A HG13 1 1 
ATOM   2932 H  HG21 . ILE   A 1 196 ? -13.488 5.81    -30.455 0   44.69  ? 886  ILE   A HG21 1 1 
ATOM   2933 H  HG22 . ILE   A 1 196 ? -13.778 4.068   -30.474 0   46.24  ? 886  ILE   A HG22 1 1 
ATOM   2934 H  HG23 . ILE   A 1 196 ? -13.617 4.928   -28.919 0   45.38  ? 886  ILE   A HG23 1 1 
ATOM   2935 H  HD11 . ILE   A 1 196 ? -10.345 7.889   -29.816 0   41.98  ? 886  ILE   A HD11 1 1 
ATOM   2936 H  HD12 . ILE   A 1 196 ? -10.388 6.811   -31.234 0   42.63  ? 886  ILE   A HD12 1 1 
ATOM   2937 H  HD13 . ILE   A 1 196 ? -11.9   7.477   -30.566 0   43.32  ? 886  ILE   A HD13 1 1 
ATOM   2938 N  N    . LEU   A 1 197 ? -11.885 1.541   -30.714 1   40.46  ? 887  LEU   A N    1 1 
ATOM   2939 C  CA   . LEU   A 1 197 ? -12.665 0.44    -31.285 1   41.41  ? 887  LEU   A CA   1 1 
ATOM   2940 C  C    . LEU   A 1 197 ? -12.415 -0.917  -30.61  1   42.04  ? 887  LEU   A C    1 1 
ATOM   2941 O  O    . LEU   A 1 197 ? -13.369 -1.619  -30.277 1   42.42  ? 887  LEU   A O    1 1 
ATOM   2942 C  CB   . LEU   A 1 197 ? -12.361 0.301   -32.797 1   41.78  ? 887  LEU   A CB   1 1 
ATOM   2943 C  CG   . LEU   A 1 197 ? -12.577 1.516   -33.718 1   42.89  ? 887  LEU   A CG   1 1 
ATOM   2944 C  CD1  . LEU   A 1 197 ? -11.958 1.257   -35.074 1   43.26  ? 887  LEU   A CD1  1 1 
ATOM   2945 C  CD2  . LEU   A 1 197 ? -14.059 1.838   -33.892 1   43.12  ? 887  LEU   A CD2  1 1 
ATOM   2946 H  H    . LEU   A 1 197 ? -11.051 1.776   -31.242 0   46.86  ? 887  LEU   A H    1 1 
ATOM   2947 H  HA   . LEU   A 1 197 ? -13.725 0.665   -31.179 0   50.99  ? 887  LEU   A HA   1 1 
ATOM   2948 H  HB2  . LEU   A 1 197 ? -11.318 0.001   -32.893 0   50.15  ? 887  LEU   A HB2  1 1 
ATOM   2949 H  HB3  . LEU   A 1 197 ? -12.993 -0.497  -33.182 0   52.02  ? 887  LEU   A HB3  1 1 
ATOM   2950 H  HG   . LEU   A 1 197 ? -12.091 2.392   -33.29  0   49.61  ? 887  LEU   A HG   1 1 
ATOM   2951 H  HD11 . LEU   A 1 197 ? -12.135 2.12    -35.714 0   50.34  ? 887  LEU   A HD11 1 1 
ATOM   2952 H  HD12 . LEU   A 1 197 ? -10.889 1.094   -34.951 0   50.34  ? 887  LEU   A HD12 1 1 
ATOM   2953 H  HD13 . LEU   A 1 197 ? -12.422 0.373   -35.51  0   52.24  ? 887  LEU   A HD13 1 1 
ATOM   2954 H  HD21 . LEU   A 1 197 ? -14.159 2.666   -34.591 0   51.35  ? 887  LEU   A HD21 1 1 
ATOM   2955 H  HD22 . LEU   A 1 197 ? -14.566 0.96    -34.291 0   53.32  ? 887  LEU   A HD22 1 1 
ATOM   2956 H  HD23 . LEU   A 1 197 ? -14.498 2.114   -32.934 0   52.15  ? 887  LEU   A HD23 1 1 
ATOM   2957 N  N    . HIS   A 1 198 ? -11.137 -1.299  -30.446 1   42.12  ? 888  HIS   A N    1 1 
ATOM   2958 C  CA   . HIS   A 1 198 ? -10.743 -2.607  -29.93  1   42.35  ? 888  HIS   A CA   1 1 
ATOM   2959 C  C    . HIS   A 1 198 ? -10.109 -2.594  -28.522 1   42.16  ? 888  HIS   A C    1 1 
ATOM   2960 O  O    . HIS   A 1 198 ? -9.651  -3.642  -28.077 1   42.42  ? 888  HIS   A O    1 1 
ATOM   2961 C  CB   . HIS   A 1 198 ? -9.764  -3.243  -30.932 1   43.37  ? 888  HIS   A CB   1 1 
ATOM   2962 C  CG   . HIS   A 1 198 ? -10.25  -3.23   -32.352 1   46.03  ? 888  HIS   A CG   1 1 
ATOM   2963 N  ND1  . HIS   A 1 198 ? -11.43  -3.861  -32.723 1   47.93  ? 888  HIS   A ND1  1 1 
ATOM   2964 C  CD2  . HIS   A 1 198 ? -9.692  -2.667  -33.449 1   47.32  ? 888  HIS   A CD2  1 1 
ATOM   2965 C  CE1  . HIS   A 1 198 ? -11.554 -3.66   -34.027 1   48.57  ? 888  HIS   A CE1  1 1 
ATOM   2966 N  NE2  . HIS   A 1 198 ? -10.531 -2.949  -34.509 1   48.62  ? 888  HIS   A NE2  1 1 
ATOM   2967 H  H    . HIS   A 1 198 ? -10.341 -0.711  -30.669 0   50.43  ? 888  HIS   A H    1 1 
ATOM   2968 H  HA   . HIS   A 1 198 ? -11.607 -3.268  -29.888 0   54.39  ? 888  HIS   A HA   1 1 
ATOM   2969 H  HB2  . HIS   A 1 198 ? -8.828  -2.688  -30.898 0   52.85  ? 888  HIS   A HB2  1 1 
ATOM   2970 H  HB3  . HIS   A 1 198 ? -9.593  -4.281  -30.653 0   55.19  ? 888  HIS   A HB3  1 1 
ATOM   2971 H  HD2  . HIS   A 1 198 ? -8.771  -2.11   -33.484 0   56.21  ? 888  HIS   A HD2  1 1 
ATOM   2972 H  HE1  . HIS   A 1 198 ? -12.374 -4.025  -34.623 0   62.42  ? 888  HIS   A HE1  1 1 
ATOM   2973 H  HE2  . HIS   A 1 198 ? -10.392 -2.668  -35.474 0   59.37  ? 888  HIS   A HE2  1 1 
ATOM   2974 N  N    . ARG   A 1 199 ? -10.057 -1.434  -27.839 1   41.66  ? 889  ARG   A N    1 1 
ATOM   2975 C  CA   . ARG   A 1 199 ? -9.481  -1.29   -26.49  1   41.67  ? 889  ARG   A CA   1 1 
ATOM   2976 C  C    . ARG   A 1 199 ? -8.028  -1.793  -26.377 1   41.11  ? 889  ARG   A C    1 1 
ATOM   2977 O  O    . ARG   A 1 199 ? -7.624  -2.265  -25.314 1   41.23  ? 889  ARG   A O    1 1 
ATOM   2978 C  CB   . ARG   A 1 199 ? -10.395 -1.957  -25.445 1   43.35  ? 889  ARG   A CB   1 1 
ATOM   2979 C  CG   . ARG   A 1 199 ? -11.821 -1.424  -25.497 1   46.4   ? 889  ARG   A CG   1 1 
ATOM   2980 C  CD   . ARG   A 1 199 ? -12.686 -1.983  -24.396 1   49.8   ? 889  ARG   A CD   1 1 
ATOM   2981 N  NE   . ARG   A 1 199 ? -14.064 -1.502  -24.518 1   52.61  ? 889  ARG   A NE   1 1 
ATOM   2982 C  CZ   . ARG   A 1 199 ? -15.105 -1.982  -23.84  1   55.18  ? 889  ARG   A CZ   1 1 
ATOM   2983 N  NH1  . ARG   A 1 199 ? -16.318 -1.477  -24.03  1   55     ? 889  ARG   A NH1  1 1 
ATOM   2984 N  NH2  . ARG   A 1 199 ? -14.943 -2.972  -22.966 1   55.29  ? 889  ARG   A NH2  1 1 
ATOM   2985 H  H    . ARG   A 1 199 ? -10.414 -0.55   -28.187 0   49.86  ? 889  ARG   A H    1 1 
ATOM   2986 H  HA   . ARG   A 1 199 ? -9.462  -0.228  -26.252 0   48.89  ? 889  ARG   A HA   1 1 
ATOM   2987 H  HB2  . ARG   A 1 199 ? -10.426 -3.031  -25.625 0   54.29  ? 889  ARG   A HB2  1 1 
ATOM   2988 H  HB3  . ARG   A 1 199 ? -10.01  -1.757  -24.446 0   52.65  ? 889  ARG   A HB3  1 1 
ATOM   2989 H  HG2  . ARG   A 1 199 ? -11.8   -0.34   -25.396 0   55.48  ? 889  ARG   A HG2  1 1 
ATOM   2990 H  HG3  . ARG   A 1 199 ? -12.284 -1.698  -26.444 0   57.23  ? 889  ARG   A HG3  1 1 
ATOM   2991 H  HD2  . ARG   A 1 199 ? -12.687 -3.07   -24.464 0   62.64  ? 889  ARG   A HD2  1 1 
ATOM   2992 H  HD3  . ARG   A 1 199 ? -12.296 -1.667  -23.43  0   60.81  ? 889  ARG   A HD3  1 1 
ATOM   2993 H  HE   . ARG   A 1 199 ? -14.231 -0.754  -25.183 0   64.22  ? 889  ARG   A HE   1 1 
ATOM   2994 H  HH11 . ARG   A 1 199 ? -16.459 -0.723  -24.695 0   68.84  ? 889  ARG   A HH11 1 1 
ATOM   2995 H  HH12 . ARG   A 1 199 ? -17.111 -1.838  -23.511 0   70.87  ? 889  ARG   A HH12 1 1 
ATOM   2996 H  HH21 . ARG   A 1 199 ? -14.041 -3.397  -22.779 0   69.8   ? 889  ARG   A HH21 1 1 
ATOM   2997 H  HH22 . ARG   A 1 199 ? -15.751 -3.316  -22.457 0   71.5   ? 889  ARG   A HH22 1 1 
ATOM   2998 N  N    . ILE   A 1 200 ? -7.242  -1.654  -27.465 1   40.18  ? 890  ILE   A N    1 1 
ATOM   2999 C  CA   . ILE   A 1 200 ? -5.855  -2.11   -27.534 1   39.72  ? 890  ILE   A CA   1 1 
ATOM   3000 C  C    . ILE   A 1 200 ? -4.938  -0.923  -27.284 1   38.67  ? 890  ILE   A C    1 1 
ATOM   3001 O  O    . ILE   A 1 200 ? -5.058  0.082   -27.979 1   38.66  ? 890  ILE   A O    1 1 
ATOM   3002 C  CB   . ILE   A 1 200 ? -5.575  -2.795  -28.907 1   40.4   ? 890  ILE   A CB   1 1 
ATOM   3003 C  CG1  . ILE   A 1 200 ? -6.4    -4.114  -29.021 1   41.56  ? 890  ILE   A CG1  1 1 
ATOM   3004 C  CG2  . ILE   A 1 200 ? -4.078  -3.077  -29.07  1   40.83  ? 890  ILE   A CG2  1 1 
ATOM   3005 C  CD1  . ILE   A 1 200 ? -6.507  -4.754  -30.437 1   43.03  ? 890  ILE   A CD1  1 1 
ATOM   3006 H  H    . ILE   A 1 200 ? -7.543  -1.213  -28.329 0   47.26  ? 890  ILE   A H    1 1 
ATOM   3007 H  HA   . ILE   A 1 200 ? -5.674  -2.859  -26.764 0   47.65  ? 890  ILE   A HA   1 1 
ATOM   3008 H  HB   . ILE   A 1 200 ? -5.885  -2.121  -29.705 0   47.61  ? 890  ILE   A HB   1 1 
ATOM   3009 H  HG12 . ILE   A 1 200 ? -5.946  -4.856  -28.366 0   51.97  ? 890  ILE   A HG12 1 1 
ATOM   3010 H  HG13 . ILE   A 1 200 ? -7.422  -3.926  -28.697 0   51.57  ? 890  ILE   A HG13 1 1 
ATOM   3011 H  HG21 . ILE   A 1 200 ? -3.892  -3.558  -30.029 0   48.9   ? 890  ILE   A HG21 1 1 
ATOM   3012 H  HG22 . ILE   A 1 200 ? -3.499  -2.156  -29.025 0   47.18  ? 890  ILE   A HG22 1 1 
ATOM   3013 H  HG23 . ILE   A 1 200 ? -3.782  -3.745  -28.264 0   49.03  ? 890  ILE   A HG23 1 1 
ATOM   3014 H  HD11 . ILE   A 1 200 ? -7.141  -5.638  -30.371 0   55.08  ? 890  ILE   A HD11 1 1 
ATOM   3015 H  HD12 . ILE   A 1 200 ? -6.951  -4.034  -31.121 0   53.02  ? 890  ILE   A HD12 1 1 
ATOM   3016 H  HD13 . ILE   A 1 200 ? -5.52   -5.043  -30.794 0   53.47  ? 890  ILE   A HD13 1 1 
ATOM   3017 N  N    . TYR   A 1 201 ? -4.014  -1.048  -26.304 1   37.67  ? 891  TYR   A N    1 1 
ATOM   3018 C  CA   . TYR   A 1 201 ? -3.076  0.006   -25.929 1   37.02  ? 891  TYR   A CA   1 1 
ATOM   3019 C  C    . TYR   A 1 201 ? -1.645  -0.479  -26.06  1   36.52  ? 891  TYR   A C    1 1 
ATOM   3020 O  O    . TYR   A 1 201 ? -1.281  -1.5    -25.487 1   36.52  ? 891  TYR   A O    1 1 
ATOM   3021 C  CB   . TYR   A 1 201 ? -3.328  0.463   -24.491 1   36.92  ? 891  TYR   A CB   1 1 
ATOM   3022 C  CG   . TYR   A 1 201 ? -4.678  1.114   -24.294 1   37.29  ? 891  TYR   A CG   1 1 
ATOM   3023 C  CD1  . TYR   A 1 201 ? -5.801  0.354   -23.998 1   38.12  ? 891  TYR   A CD1  1 1 
ATOM   3024 C  CD2  . TYR   A 1 201 ? -4.821  2.494   -24.346 1   37.81  ? 891  TYR   A CD2  1 1 
ATOM   3025 C  CE1  . TYR   A 1 201 ? -7.042  0.943   -23.811 1   38.88  ? 891  TYR   A CE1  1 1 
ATOM   3026 C  CE2  . TYR   A 1 201 ? -6.055  3.1     -24.136 1   38.64  ? 891  TYR   A CE2  1 1 
ATOM   3027 C  CZ   . TYR   A 1 201 ? -7.167  2.316   -23.875 1   39.53  ? 891  TYR   A CZ   1 1 
ATOM   3028 O  OH   . TYR   A 1 201 ? -8.402  2.867   -23.658 1   40.48  ? 891  TYR   A OH   1 1 
ATOM   3029 H  H    . TYR   A 1 201 ? -3.894  -1.887  -25.745 0   43.87  ? 891  TYR   A H    1 1 
ATOM   3030 H  HA   . TYR   A 1 201 ? -3.213  0.873   -26.572 0   40.32  ? 891  TYR   A HA   1 1 
ATOM   3031 H  HB2  . TYR   A 1 201 ? -3.271  -0.399  -23.828 0   41.48  ? 891  TYR   A HB2  1 1 
ATOM   3032 H  HB3  . TYR   A 1 201 ? -2.559  1.185   -24.224 0   39.85  ? 891  TYR   A HB3  1 1 
ATOM   3033 H  HD1  . TYR   A 1 201 ? -5.715  -0.718  -23.955 0   43.89  ? 891  TYR   A HD1  1 1 
ATOM   3034 H  HD2  . TYR   A 1 201 ? -3.96   3.106   -24.555 0   39.52  ? 891  TYR   A HD2  1 1 
ATOM   3035 H  HE1  . TYR   A 1 201 ? -7.902  0.333   -23.594 0   44.76  ? 891  TYR   A HE1  1 1 
ATOM   3036 H  HE2  . TYR   A 1 201 ? -6.141  4.171   -24.199 0   40.39  ? 891  TYR   A HE2  1 1 
ATOM   3037 H  HH   . TYR   A 1 201 ? -8.354  3.858   -23.676 0   43.6   ? 891  TYR   A HH   1 1 
ATOM   3038 N  N    . THR   A 1 202 ? -0.842  0.251   -26.838 1   35.75  ? 892  THR   A N    1 1 
ATOM   3039 C  CA   . THR   A 1 202 ? 0.561   -0.047  -27.11  1   35.29  ? 892  THR   A CA   1 1 
ATOM   3040 C  C    . THR   A 1 202 ? 1.377   1.261   -26.981 1   34.28  ? 892  THR   A C    1 1 
ATOM   3041 O  O    . THR   A 1 202 ? 0.795   2.344   -26.852 1   34.49  ? 892  THR   A O    1 1 
ATOM   3042 C  CB   . THR   A 1 202 ? 0.677   -0.605  -28.551 1   36.73  ? 892  THR   A CB   1 1 
ATOM   3043 O  OG1  . THR   A 1 202 ? 0.285   0.406   -29.479 1   37.73  ? 892  THR   A OG1  1 1 
ATOM   3044 C  CG2  . THR   A 1 202 ? -0.126  -1.868  -28.764 1   36.96  ? 892  THR   A CG2  1 1 
ATOM   3045 H  H    . THR   A 1 202 ? -1.141  1.094   -27.319 0   38.38  ? 892  THR   A H    1 1 
ATOM   3046 H  HA   . THR   A 1 202 ? 0.96    -0.782  -26.412 0   39.44  ? 892  THR   A HA   1 1 
ATOM   3047 H  HB   . THR   A 1 202 ? 1.721   -0.851  -28.74  0   40.94  ? 892  THR   A HB   1 1 
ATOM   3048 H  HG1  . THR   A 1 202 ? 0.294   0.043   -30.403 0   41.17  ? 892  THR   A HG1  1 1 
ATOM   3049 H  HG21 . THR   A 1 202 ? 0.016   -2.241  -29.777 0   42.64  ? 892  THR   A HG21 1 1 
ATOM   3050 H  HG22 . THR   A 1 202 ? 0.231   -2.615  -28.058 0   43.04  ? 892  THR   A HG22 1 1 
ATOM   3051 H  HG23 . THR   A 1 202 ? -1.188  -1.696  -28.597 0   42.22  ? 892  THR   A HG23 1 1 
ATOM   3052 N  N    . HIS   A 1 203 ? 2.715   1.183   -27.079 1   32.99  ? 893  HIS   A N    1 1 
ATOM   3053 C  CA   . HIS   A 1 203 ? 3.55    2.389   -27.075 1   32.37  ? 893  HIS   A CA   1 1 
ATOM   3054 C  C    . HIS   A 1 203 ? 3.19    3.303   -28.264 1   31.51  ? 893  HIS   A C    1 1 
ATOM   3055 O  O    . HIS   A 1 203 ? 3.271   4.52    -28.132 1   31.47  ? 893  HIS   A O    1 1 
ATOM   3056 C  CB   . HIS   A 1 203 ? 5.032   2.017   -27.134 1   32.86  ? 893  HIS   A CB   1 1 
ATOM   3057 C  CG   . HIS   A 1 203 ? 5.457   1.118   -26.018 1   34.33  ? 893  HIS   A CG   1 1 
ATOM   3058 N  ND1  . HIS   A 1 203 ? 5.364   1.513   -24.697 1   35.91  ? 893  HIS   A ND1  1 1 
ATOM   3059 C  CD2  . HIS   A 1 203 ? 5.939   -0.141  -26.065 1   34.95  ? 893  HIS   A CD2  1 1 
ATOM   3060 C  CE1  . HIS   A 1 203 ? 5.809   0.495   -23.986 1   36.13  ? 893  HIS   A CE1  1 1 
ATOM   3061 N  NE2  . HIS   A 1 203 ? 6.167   -0.522  -24.769 1   36     ? 893  HIS   A NE2  1 1 
ATOM   3062 H  H    . HIS   A 1 203 ? 3.224   0.312   -27.182 0   36.18  ? 893  HIS   A H    1 1 
ATOM   3063 H  HA   . HIS   A 1 203 ? 3.374   2.943   -26.154 0   33.47  ? 893  HIS   A HA   1 1 
ATOM   3064 H  HB2  . HIS   A 1 203 ? 5.231   1.505   -28.074 0   35.34  ? 893  HIS   A HB2  1 1 
ATOM   3065 H  HB3  . HIS   A 1 203 ? 5.625   2.928   -27.074 0   34.37  ? 893  HIS   A HB3  1 1 
ATOM   3066 H  HD2  . HIS   A 1 203 ? 6.112   -0.73   -26.95  0   39.6   ? 893  HIS   A HD2  1 1 
ATOM   3067 H  HE1  . HIS   A 1 203 ? 5.873   0.487   -22.91  0   39.75  ? 893  HIS   A HE1  1 1 
ATOM   3068 H  HE2  . HIS   A 1 203 ? 6.542   -1.414  -24.463 0   41.45  ? 893  HIS   A HE2  1 1 
ATOM   3069 N  N    . GLN   A 1 204 ? 2.732   2.721   -29.39  1   30.81  ? 894  GLN   A N    1 1 
ATOM   3070 C  CA   . GLN   A 1 204 ? 2.331   3.482   -30.564 1   31.07  ? 894  GLN   A CA   1 1 
ATOM   3071 C  C    . GLN   A 1 204 ? 0.987   4.172   -30.351 1   31.16  ? 894  GLN   A C    1 1 
ATOM   3072 O  O    . GLN   A 1 204 ? 0.782   5.249   -30.919 1   31.38  ? 894  GLN   A O    1 1 
ATOM   3073 C  CB   . GLN   A 1 204 ? 2.345   2.598   -31.82  1   32.92  ? 894  GLN   A CB   1 1 
ATOM   3074 C  CG   . GLN   A 1 204 ? 3.751   2.064   -32.192 1   35.61  ? 894  GLN   A CG   1 1 
ATOM   3075 C  CD   . GLN   A 1 204 ? 4.809   3.148   -32.341 1   39.85  ? 894  GLN   A CD   1 1 
ATOM   3076 O  OE1  . GLN   A 1 204 ? 5.644   3.368   -31.447 1   41.9   ? 894  GLN   A OE1  1 1 
ATOM   3077 N  NE2  . GLN   A 1 204 ? 4.802   3.856   -33.466 1   39.94  ? 894  GLN   A NE2  1 1 
ATOM   3078 H  H    . GLN   A 1 204 ? 2.624   1.718   -29.507 0   32.76  ? 894  GLN   A H    1 1 
ATOM   3079 H  HA   . GLN   A 1 204 ? 3.057   4.28    -30.711 0   31.17  ? 894  GLN   A HA   1 1 
ATOM   3080 H  HB2  . GLN   A 1 204 ? 1.709   1.733   -31.638 0   34.86  ? 894  GLN   A HB2  1 1 
ATOM   3081 H  HB3  . GLN   A 1 204 ? 1.965   3.172   -32.664 0   33.79  ? 894  GLN   A HB3  1 1 
ATOM   3082 H  HG2  . GLN   A 1 204 ? 4.086   1.377   -31.416 0   38.08  ? 894  GLN   A HG2  1 1 
ATOM   3083 H  HG3  . GLN   A 1 204 ? 3.678   1.539   -33.143 0   37.98  ? 894  GLN   A HG3  1 1 
ATOM   3084 H  HE21 . GLN   A 1 204 ? 4.112   3.666   -34.186 0   40.79  ? 894  GLN   A HE21 1 1 
ATOM   3085 H  HE22 . GLN   A 1 204 ? 5.492   4.586   -33.607 0   40.42  ? 894  GLN   A HE22 1 1 
ATOM   3086 N  N    . SER   A 1 205 ? 0.09    3.622   -29.496 1   30.72  ? 895  SER   A N    1 1 
ATOM   3087 C  CA   . SER   A 1 205 ? -1.141  4.333   -29.146 1   30.71  ? 895  SER   A CA   1 1 
ATOM   3088 C  C    . SER   A 1 205 ? -0.739  5.576   -28.303 1   30.22  ? 895  SER   A C    1 1 
ATOM   3089 O  O    . SER   A 1 205 ? -1.292  6.648   -28.51  1   30.72  ? 895  SER   A O    1 1 
ATOM   3090 C  CB   . SER   A 1 205 ? -2.136  3.431   -28.41  1   32.33  ? 895  SER   A CB   1 1 
ATOM   3091 O  OG   . SER   A 1 205 ? -1.839  3.275   -27.033 1   35.13  ? 895  SER   A OG   1 1 
ATOM   3092 H  H    . SER   A 1 205 ? 0.179   2.71    -29.059 0   31.86  ? 895  SER   A H    1 1 
ATOM   3093 H  HA   . SER   A 1 205 ? -1.625  4.678   -30.058 0   30.65  ? 895  SER   A HA   1 1 
ATOM   3094 H  HB2  . SER   A 1 205 ? -3.129  3.868   -28.5   0   33.14  ? 895  SER   A HB2  1 1 
ATOM   3095 H  HB3  . SER   A 1 205 ? -2.136  2.447   -28.878 0   33.99  ? 895  SER   A HB3  1 1 
ATOM   3096 H  HG   . SER   A 1 205 ? -2.643  2.957   -26.544 0   36.54  ? 895  SER   A HG   1 1 
ATOM   3097 N  N    . ASP   A 1 206 ? 0.278   5.454   -27.421 1   29.37  ? 896  ASP   A N    1 1 
ATOM   3098 C  CA   . ASP   A 1 206 ? 0.831   6.587   -26.666 1   28.63  ? 896  ASP   A CA   1 1 
ATOM   3099 C  C    . ASP   A 1 206 ? 1.402   7.664   -27.595 1   27.96  ? 896  ASP   A C    1 1 
ATOM   3100 O  O    . ASP   A 1 206 ? 1.396   8.834   -27.233 1   28.27  ? 896  ASP   A O    1 1 
ATOM   3101 C  CB   . ASP   A 1 206 ? 1.955   6.128   -25.729 1   29.78  ? 896  ASP   A CB   1 1 
ATOM   3102 C  CG   . ASP   A 1 206 ? 1.508   5.567   -24.402 1   33.9   ? 896  ASP   A CG   1 1 
ATOM   3103 O  OD1  . ASP   A 1 206 ? 0.285   5.566   -24.135 1   34.24  ? 896  ASP   A OD1  1 1 
ATOM   3104 O  OD2  . ASP   A 1 206 ? 2.381   5.135   -23.619 1   35.53  ? 896  ASP   A OD2  1 1 
ATOM   3105 H  H    . ASP   A 1 206 ? 0.714   4.568   -27.186 0   29.16  ? 896  ASP   A H    1 1 
ATOM   3106 H  HA   . ASP   A 1 206 ? 0.04    7.057   -26.084 0   27.88  ? 896  ASP   A HA   1 1 
ATOM   3107 H  HB2  . ASP   A 1 206 ? 2.555   5.368   -26.226 0   29.13  ? 896  ASP   A HB2  1 1 
ATOM   3108 H  HB3  . ASP   A 1 206 ? 2.584   6.992   -25.527 0   28.52  ? 896  ASP   A HB3  1 1 
ATOM   3109 N  N    . VAL   A 1 207 ? 1.933   7.277   -28.76  1   27.09  ? 897  VAL   A N    1 1 
ATOM   3110 C  CA   . VAL   A 1 207 ? 2.454   8.235   -29.742 1   26.16  ? 897  VAL   A CA   1 1 
ATOM   3111 C  C    . VAL   A 1 207 ? 1.289   9.103   -30.256 1   24.91  ? 897  VAL   A C    1 1 
ATOM   3112 O  O    . VAL   A 1 207 ? 1.468   10.305  -30.443 1   25.02  ? 897  VAL   A O    1 1 
ATOM   3113 C  CB   . VAL   A 1 207 ? 3.198   7.521   -30.897 1   26.61  ? 897  VAL   A CB   1 1 
ATOM   3114 C  CG1  . VAL   A 1 207 ? 3.519   8.491   -32.03  1   27.1   ? 897  VAL   A CG1  1 1 
ATOM   3115 C  CG2  . VAL   A 1 207 ? 4.486   6.873   -30.388 1   27.25  ? 897  VAL   A CG2  1 1 
ATOM   3116 H  H    . VAL   A 1 207 ? 2.005   6.309   -29.056 0   26.77  ? 897  VAL   A H    1 1 
ATOM   3117 H  HA   . VAL   A 1 207 ? 3.158   8.9     -29.244 0   25.89  ? 897  VAL   A HA   1 1 
ATOM   3118 H  HB   . VAL   A 1 207 ? 2.562   6.735   -31.302 0   26.37  ? 897  VAL   A HB   1 1 
ATOM   3119 H  HG11 . VAL   A 1 207 ? 4.134   7.969   -32.761 0   27.01  ? 897  VAL   A HG11 1 1 
ATOM   3120 H  HG12 . VAL   A 1 207 ? 2.609   8.84    -32.513 0   26.66  ? 897  VAL   A HG12 1 1 
ATOM   3121 H  HG13 . VAL   A 1 207 ? 4.074   9.332   -31.619 0   26.83  ? 897  VAL   A HG13 1 1 
ATOM   3122 H  HG21 . VAL   A 1 207 ? 4.986   6.391   -31.227 0   27.3   ? 897  VAL   A HG21 1 1 
ATOM   3123 H  HG22 . VAL   A 1 207 ? 5.127   7.646   -29.968 0   27.12  ? 897  VAL   A HG22 1 1 
ATOM   3124 H  HG23 . VAL   A 1 207 ? 4.245   6.134   -29.626 0   27.02  ? 897  VAL   A HG23 1 1 
ATOM   3125 N  N    . TRP   A 1 208 ? 0.088   8.509   -30.437 1   23.78  ? 898  TRP   A N    1 1 
ATOM   3126 C  CA   . TRP   A 1 208 ? -1.111  9.233   -30.843 1   23.05  ? 898  TRP   A CA   1 1 
ATOM   3127 C  C    . TRP   A 1 208 ? -1.43   10.283  -29.777 1   22.15  ? 898  TRP   A C    1 1 
ATOM   3128 O  O    . TRP   A 1 208 ? -1.558  11.458  -30.106 1   22.03  ? 898  TRP   A O    1 1 
ATOM   3129 C  CB   . TRP   A 1 208 ? -2.3    8.259   -31.039 1   23.32  ? 898  TRP   A CB   1 1 
ATOM   3130 C  CG   . TRP   A 1 208 ? -3.535  8.923   -31.564 1   24.12  ? 898  TRP   A CG   1 1 
ATOM   3131 C  CD1  . TRP   A 1 208 ? -4.258  9.908   -30.955 1   25.03  ? 898  TRP   A CD1  1 1 
ATOM   3132 C  CD2  . TRP   A 1 208 ? -4.202  8.642   -32.799 1   24.94  ? 898  TRP   A CD2  1 1 
ATOM   3133 N  NE1  . TRP   A 1 208 ? -5.307  10.287  -31.753 1   25.56  ? 898  TRP   A NE1  1 1 
ATOM   3134 C  CE2  . TRP   A 1 208 ? -5.332  9.485   -32.863 1   25.61  ? 898  TRP   A CE2  1 1 
ATOM   3135 C  CE3  . TRP   A 1 208 ? -4.053  7.649   -33.778 1   25.85  ? 898  TRP   A CE3  1 1 
ATOM   3136 C  CZ2  . TRP   A 1 208 ? -6.216  9.463   -33.932 1   26.56  ? 898  TRP   A CZ2  1 1 
ATOM   3137 C  CZ3  . TRP   A 1 208 ? -4.944  7.618   -34.831 1   26.82  ? 898  TRP   A CZ3  1 1 
ATOM   3138 C  CH2  . TRP   A 1 208 ? -6.034  8.492   -34.879 1   27.12  ? 898  TRP   A CH2  1 1 
ATOM   3139 H  H    . TRP   A 1 208 ? -0.08   7.514   -30.325 0   23.92  ? 898  TRP   A H    1 1 
ATOM   3140 H  HA   . TRP   A 1 208 ? -0.929  9.744   -31.786 0   23.27  ? 898  TRP   A HA   1 1 
ATOM   3141 H  HB2  . TRP   A 1 208 ? -2.003  7.477   -31.737 0   23.72  ? 898  TRP   A HB2  1 1 
ATOM   3142 H  HB3  . TRP   A 1 208 ? -2.546  7.811   -30.076 0   23.68  ? 898  TRP   A HB3  1 1 
ATOM   3143 H  HD1  . TRP   A 1 208 ? -3.947  10.429  -30.065 0   25.06  ? 898  TRP   A HD1  1 1 
ATOM   3144 H  HE1  . TRP   A 1 208 ? -5.993  11.039  -31.533 0   25.91  ? 898  TRP   A HE1  1 1 
ATOM   3145 H  HE3  . TRP   A 1 208 ? -3.213  6.975   -33.755 0   26.04  ? 898  TRP   A HE3  1 1 
ATOM   3146 H  HZ2  . TRP   A 1 208 ? -7.071  10.111  -33.948 0   27.17  ? 898  TRP   A HZ2  1 1 
ATOM   3147 H  HZ3  . TRP   A 1 208 ? -4.8    6.906   -35.626 0   27.28  ? 898  TRP   A HZ3  1 1 
ATOM   3148 H  HH2  . TRP   A 1 208 ? -6.686  8.47    -35.735 0   27.91  ? 898  TRP   A HH2  1 1 
ATOM   3149 N  N    . SER   A 1 209 ? -1.481  9.869   -28.5   1   21.75  ? 899  SER   A N    1 1 
ATOM   3150 C  CA   . SER   A 1 209 ? -1.745  10.771  -27.38  1   22.05  ? 899  SER   A CA   1 1 
ATOM   3151 C  C    . SER   A 1 209 ? -0.682  11.841  -27.233 1   20.92  ? 899  SER   A C    1 1 
ATOM   3152 O  O    . SER   A 1 209 ? -0.999  12.949  -26.803 1   20.46  ? 899  SER   A O    1 1 
ATOM   3153 C  CB   . SER   A 1 209 ? -1.837  9.989   -26.08  1   24.74  ? 899  SER   A CB   1 1 
ATOM   3154 O  OG   . SER   A 1 209 ? -2.749  8.907   -26.174 1   28.89  ? 899  SER   A OG   1 1 
ATOM   3155 H  H    . SER   A 1 209 ? -1.344  8.904   -28.215 0   22.15  ? 899  SER   A H    1 1 
ATOM   3156 H  HA   . SER   A 1 209 ? -2.7    11.269  -27.541 0   22.39  ? 899  SER   A HA   1 1 
ATOM   3157 H  HB2  . SER   A 1 209 ? -0.851  9.592   -25.84  0   24.49  ? 899  SER   A HB2  1 1 
ATOM   3158 H  HB3  . SER   A 1 209 ? -2.168  10.661  -25.289 0   24.52  ? 899  SER   A HB3  1 1 
ATOM   3159 H  HG   . SER   A 1 209 ? -3.608  9.185   -26.59  0   28.47  ? 899  SER   A HG   1 1 
ATOM   3160 N  N    . TYR   A 1 210 ? 0.583   11.521  -27.572 1   20.27  ? 900  TYR   A N    1 1 
ATOM   3161 C  CA   . TYR   A 1 210 ? 1.677   12.484  -27.549 1   20.18  ? 900  TYR   A CA   1 1 
ATOM   3162 C  C    . TYR   A 1 210 ? 1.388   13.587  -28.563 1   18.63  ? 900  TYR   A C    1 1 
ATOM   3163 O  O    . TYR   A 1 210 ? 1.54    14.755  -28.225 1   18.4   ? 900  TYR   A O    1 1 
ATOM   3164 C  CB   . TYR   A 1 210 ? 3.041   11.788  -27.827 1   20.99  ? 900  TYR   A CB   1 1 
ATOM   3165 C  CG   . TYR   A 1 210 ? 4.172   12.754  -28.073 1   22.82  ? 900  TYR   A CG   1 1 
ATOM   3166 C  CD1  . TYR   A 1 210 ? 4.922   13.262  -27.02  1   24.07  ? 900  TYR   A CD1  1 1 
ATOM   3167 C  CD2  . TYR   A 1 210 ? 4.463   13.201  -29.356 1   23.93  ? 900  TYR   A CD2  1 1 
ATOM   3168 C  CE1  . TYR   A 1 210 ? 5.924   14.201  -27.236 1   25.03  ? 900  TYR   A CE1  1 1 
ATOM   3169 C  CE2  . TYR   A 1 210 ? 5.48    14.115  -29.586 1   24.77  ? 900  TYR   A CE2  1 1 
ATOM   3170 C  CZ   . TYR   A 1 210 ? 6.208   14.612  -28.524 1   25.61  ? 900  TYR   A CZ   1 1 
ATOM   3171 O  OH   . TYR   A 1 210 ? 7.166   15.55   -28.758 1   26.65  ? 900  TYR   A OH   1 1 
ATOM   3172 H  H    . TYR   A 1 210 ? 0.886   10.59   -27.841 0   20.77  ? 900  TYR   A H    1 1 
ATOM   3173 H  HA   . TYR   A 1 210 ? 1.728   12.929  -26.556 0   20.52  ? 900  TYR   A HA   1 1 
ATOM   3174 H  HB2  . TYR   A 1 210 ? 3.3     11.176  -26.965 0   21.4   ? 900  TYR   A HB2  1 1 
ATOM   3175 H  HB3  . TYR   A 1 210 ? 2.951   11.163  -28.714 0   21.45  ? 900  TYR   A HB3  1 1 
ATOM   3176 H  HD1  . TYR   A 1 210 ? 4.695   12.943  -26.019 0   24.03  ? 900  TYR   A HD1  1 1 
ATOM   3177 H  HD2  . TYR   A 1 210 ? 3.893   12.823  -30.187 0   23.97  ? 900  TYR   A HD2  1 1 
ATOM   3178 H  HE1  . TYR   A 1 210 ? 6.495   14.581  -26.407 0   25.22  ? 900  TYR   A HE1  1 1 
ATOM   3179 H  HE2  . TYR   A 1 210 ? 5.677   14.455  -30.589 0   25     ? 900  TYR   A HE2  1 1 
ATOM   3180 H  HH   . TYR   A 1 210 ? 7.596   15.39   -29.639 0   26.93  ? 900  TYR   A HH   1 1 
ATOM   3181 N  N    . GLY   A 1 211 ? 0.935   13.215  -29.764 1   17.88  ? 901  GLY   A N    1 1 
ATOM   3182 C  CA   . GLY   A 1 211 ? 0.552   14.175  -30.797 1   17.98  ? 901  GLY   A CA   1 1 
ATOM   3183 C  C    . GLY   A 1 211 ? -0.583  15.098  -30.384 1   18.06  ? 901  GLY   A C    1 1 
ATOM   3184 O  O    . GLY   A 1 211 ? -0.576  16.286  -30.738 1   17.59  ? 901  GLY   A O    1 1 
ATOM   3185 H  H    . GLY   A 1 211 ? 0.842   12.25   -30.068 0   18.72  ? 901  GLY   A H    1 1 
ATOM   3186 H  HA2  . GLY   A 1 211 ? 1.416   14.786  -31.056 0   18.75  ? 901  GLY   A HA2  1 1 
ATOM   3187 H  HA3  . GLY   A 1 211 ? 0.241   13.633  -31.689 0   18.81  ? 901  GLY   A HA3  1 1 
ATOM   3188 N  N    . VAL   A 1 212 ? -1.578  14.567  -29.624 1   18.06  ? 902  VAL   A N    1 1 
ATOM   3189 C  CA   . VAL   A 1 212 ? -2.693  15.388  -29.134 1   18.66  ? 902  VAL   A CA   1 1 
ATOM   3190 C  C    . VAL   A 1 212 ? -2.137  16.361  -28.067 1   19.73  ? 902  VAL   A C    1 1 
ATOM   3191 O  O    . VAL   A 1 212 ? -2.46   17.549  -28.095 1   20.38  ? 902  VAL   A O    1 1 
ATOM   3192 C  CB   . VAL   A 1 212 ? -3.907  14.557  -28.608 1   18.73  ? 902  VAL   A CB   1 1 
ATOM   3193 C  CG1  . VAL   A 1 212 ? -5.017  15.482  -28.108 1   19.23  ? 902  VAL   A CG1  1 1 
ATOM   3194 C  CG2  . VAL   A 1 212 ? -4.458  13.624  -29.691 1   18.47  ? 902  VAL   A CG2  1 1 
ATOM   3195 H  H    . VAL   A 1 212 ? -1.61   13.598  -29.326 0   18.8   ? 902  VAL   A H    1 1 
ATOM   3196 H  HA   . VAL   A 1 212 ? -3.06   15.995  -29.96  0   19.32  ? 902  VAL   A HA   1 1 
ATOM   3197 H  HB   . VAL   A 1 212 ? -3.579  13.943  -27.769 0   19.37  ? 902  VAL   A HB   1 1 
ATOM   3198 H  HG11 . VAL   A 1 212 ? -5.857  14.866  -27.788 0   20.2   ? 902  VAL   A HG11 1 1 
ATOM   3199 H  HG12 . VAL   A 1 212 ? -4.669  16.076  -27.265 0   19.73  ? 902  VAL   A HG12 1 1 
ATOM   3200 H  HG13 . VAL   A 1 212 ? -5.33   16.133  -28.922 0   19.99  ? 902  VAL   A HG13 1 1 
ATOM   3201 H  HG21 . VAL   A 1 212 ? -5.35   13.121  -29.325 0   19.6   ? 902  VAL   A HG21 1 1 
ATOM   3202 H  HG22 . VAL   A 1 212 ? -4.714  14.214  -30.569 0   19.4   ? 902  VAL   A HG22 1 1 
ATOM   3203 H  HG23 . VAL   A 1 212 ? -3.704  12.879  -29.94  0   19.25  ? 902  VAL   A HG23 1 1 
ATOM   3204 N  N    . THR   A 1 213 ? -1.26   15.883  -27.183 1   20.21  ? 903  THR   A N    1 1 
ATOM   3205 C  CA   . THR   A 1 213 ? -0.587  16.727  -26.179 1   21.13  ? 903  THR   A CA   1 1 
ATOM   3206 C  C    . THR   A 1 213 ? 0.191   17.869  -26.857 1   21.95  ? 903  THR   A C    1 1 
ATOM   3207 O  O    . THR   A 1 213 ? 0.136   19.004  -26.39  1   22.25  ? 903  THR   A O    1 1 
ATOM   3208 C  CB   . THR   A 1 213 ? 0.365   15.881  -25.322 1   22.15  ? 903  THR   A CB   1 1 
ATOM   3209 O  OG1  . THR   A 1 213 ? -0.325  14.687  -24.913 1   23     ? 903  THR   A OG1  1 1 
ATOM   3210 C  CG2  . THR   A 1 213 ? 0.95    16.676  -24.13  1   22.58  ? 903  THR   A CG2  1 1 
ATOM   3211 H  H    . THR   A 1 213 ? -1      14.904  -27.116 0   20.48  ? 903  THR   A H    1 1 
ATOM   3212 H  HA   . THR   A 1 213 ? -1.337  17.169  -25.524 0   21.12  ? 903  THR   A HA   1 1 
ATOM   3213 H  HB   . THR   A 1 213 ? 1.205   15.583  -25.947 0   22.11  ? 903  THR   A HB   1 1 
ATOM   3214 H  HG1  . THR   A 1 213 ? -0.177  14.413  -23.97  0   22.74  ? 903  THR   A HG1  1 1 
ATOM   3215 H  HG21 . THR   A 1 213 ? 1.596   16.035  -23.533 0   22.42  ? 903  THR   A HG21 1 1 
ATOM   3216 H  HG22 . THR   A 1 213 ? 1.536   17.526  -24.469 0   22.39  ? 903  THR   A HG22 1 1 
ATOM   3217 H  HG23 . THR   A 1 213 ? 0.151   17.033  -23.484 0   22.29  ? 903  THR   A HG23 1 1 
ATOM   3218 N  N    . VAL   A 1 214 ? 0.893   17.573  -27.966 1   21.99  ? 904  VAL   A N    1 1 
ATOM   3219 C  CA   . VAL   A 1 214 ? 1.642   18.588  -28.707 1   22.75  ? 904  VAL   A CA   1 1 
ATOM   3220 C  C    . VAL   A 1 214 ? 0.654   19.604  -29.284 1   22.66  ? 904  VAL   A C    1 1 
ATOM   3221 O  O    . VAL   A 1 214 ? 0.87    20.808  -29.146 1   22.66  ? 904  VAL   A O    1 1 
ATOM   3222 C  CB   . VAL   A 1 214 ? 2.542   17.955  -29.802 1   24.27  ? 904  VAL   A CB   1 1 
ATOM   3223 C  CG1  . VAL   A 1 214 ? 3.086   19.016  -30.757 1   25.22  ? 904  VAL   A CG1  1 1 
ATOM   3224 C  CG2  . VAL   A 1 214 ? 3.71    17.188  -29.174 1   24.88  ? 904  VAL   A CG2  1 1 
ATOM   3225 H  H    . VAL   A 1 214 ? 0.949   16.643  -28.368 0   22.01  ? 904  VAL   A H    1 1 
ATOM   3226 H  HA   . VAL   A 1 214 ? 2.284   19.119  -28.005 0   22.68  ? 904  VAL   A HA   1 1 
ATOM   3227 H  HB   . VAL   A 1 214 ? 1.955   17.252  -30.39  0   24     ? 904  VAL   A HB   1 1 
ATOM   3228 H  HG11 . VAL   A 1 214 ? 3.713   18.53   -31.503 0   25.1   ? 904  VAL   A HG11 1 1 
ATOM   3229 H  HG12 . VAL   A 1 214 ? 2.252   19.513  -31.245 0   24.77  ? 904  VAL   A HG12 1 1 
ATOM   3230 H  HG13 . VAL   A 1 214 ? 3.673   19.738  -30.192 0   25     ? 904  VAL   A HG13 1 1 
ATOM   3231 H  HG21 . VAL   A 1 214 ? 4.318   16.764  -29.972 0   24.83  ? 904  VAL   A HG21 1 1 
ATOM   3232 H  HG22 . VAL   A 1 214 ? 4.308   17.875  -28.576 0   24.73  ? 904  VAL   A HG22 1 1 
ATOM   3233 H  HG23 . VAL   A 1 214 ? 3.316   16.393  -28.543 0   24.53  ? 904  VAL   A HG23 1 1 
ATOM   3234 N  N    . TRP   A 1 215 ? -0.461  19.126  -29.869 1   22.34  ? 905  TRP   A N    1 1 
ATOM   3235 C  CA   . TRP   A 1 215 ? -1.5    20      -30.411 1   22.32  ? 905  TRP   A CA   1 1 
ATOM   3236 C  C    . TRP   A 1 215 ? -2.047  20.945  -29.318 1   21.87  ? 905  TRP   A C    1 1 
ATOM   3237 O  O    . TRP   A 1 215 ? -2.223  22.13   -29.569 1   21.84  ? 905  TRP   A O    1 1 
ATOM   3238 C  CB   . TRP   A 1 215 ? -2.616  19.161  -31.056 1   22.52  ? 905  TRP   A CB   1 1 
ATOM   3239 C  CG   . TRP   A 1 215 ? -3.652  19.996  -31.742 1   23.28  ? 905  TRP   A CG   1 1 
ATOM   3240 C  CD1  . TRP   A 1 215 ? -3.607  20.485  -33.014 1   24.08  ? 905  TRP   A CD1  1 1 
ATOM   3241 C  CD2  . TRP   A 1 215 ? -4.841  20.521  -31.15  1   23.83  ? 905  TRP   A CD2  1 1 
ATOM   3242 N  NE1  . TRP   A 1 215 ? -4.723  21.25   -33.265 1   24.82  ? 905  TRP   A NE1  1 1 
ATOM   3243 C  CE2  . TRP   A 1 215 ? -5.48   21.318  -32.123 1   24.72  ? 905  TRP   A CE2  1 1 
ATOM   3244 C  CE3  . TRP   A 1 215 ? -5.429  20.398  -29.885 1   24.36  ? 905  TRP   A CE3  1 1 
ATOM   3245 C  CZ2  . TRP   A 1 215 ? -6.685  21.968  -31.876 1   25.13  ? 905  TRP   A CZ2  1 1 
ATOM   3246 C  CZ3  . TRP   A 1 215 ? -6.593  21.09   -29.627 1   25.16  ? 905  TRP   A CZ3  1 1 
ATOM   3247 C  CH2  . TRP   A 1 215 ? -7.222  21.844  -30.621 1   25.31  ? 905  TRP   A CH2  1 1 
ATOM   3248 H  H    . TRP   A 1 215 ? -0.662  18.139  -29.996 0   22.34  ? 905  TRP   A H    1 1 
ATOM   3249 H  HA   . TRP   A 1 215 ? -1.06   20.62   -31.192 0   22.28  ? 905  TRP   A HA   1 1 
ATOM   3250 H  HB2  . TRP   A 1 215 ? -2.175  18.501  -31.802 0   22.58  ? 905  TRP   A HB2  1 1 
ATOM   3251 H  HB3  . TRP   A 1 215 ? -3.108  18.569  -30.286 0   22.58  ? 905  TRP   A HB3  1 1 
ATOM   3252 H  HD1  . TRP   A 1 215 ? -2.841  20.254  -33.736 0   23.94  ? 905  TRP   A HD1  1 1 
ATOM   3253 H  HE1  . TRP   A 1 215 ? -4.936  21.733  -34.161 0   24.8   ? 905  TRP   A HE1  1 1 
ATOM   3254 H  HE3  . TRP   A 1 215 ? -4.934  19.848  -29.102 0   24.17  ? 905  TRP   A HE3  1 1 
ATOM   3255 H  HZ2  . TRP   A 1 215 ? -7.172  22.553  -32.637 0   25.38  ? 905  TRP   A HZ2  1 1 
ATOM   3256 H  HZ3  . TRP   A 1 215 ? -7.065  20.987  -28.665 0   25.23  ? 905  TRP   A HZ3  1 1 
ATOM   3257 H  HH2  . TRP   A 1 215 ? -8.157  22.33   -30.399 0   25.73  ? 905  TRP   A HH2  1 1 
ATOM   3258 N  N    . GLU   A 1 216 ? -2.242  20.441  -28.097 1   21.71  ? 906  GLU   A N    1 1 
ATOM   3259 C  CA   . GLU   A 1 216 ? -2.689  21.273  -26.978 1   22.3   ? 906  GLU   A CA   1 1 
ATOM   3260 C  C    . GLU   A 1 216 ? -1.654  22.352  -26.671 1   22.99  ? 906  GLU   A C    1 1 
ATOM   3261 O  O    . GLU   A 1 216 ? -2.03   23.496  -26.455 1   23.29  ? 906  GLU   A O    1 1 
ATOM   3262 C  CB   . GLU   A 1 216 ? -2.892  20.438  -25.706 1   23.62  ? 906  GLU   A CB   1 1 
ATOM   3263 C  CG   . GLU   A 1 216 ? -4.074  19.504  -25.725 1   26.13  ? 906  GLU   A CG   1 1 
ATOM   3264 C  CD   . GLU   A 1 216 ? -4.106  18.694  -24.45  1   28.62  ? 906  GLU   A CD   1 1 
ATOM   3265 O  OE1  . GLU   A 1 216 ? -4.823  19.097  -23.505 1   29.58  ? 906  GLU   A OE1  1 1 
ATOM   3266 O  OE2  . GLU   A 1 216 ? -3.383  17.675  -24.379 1   28.01  ? 906  GLU   A OE2  1 1 
ATOM   3267 H  H    . GLU   A 1 216 ? -2.091  19.466  -27.855 0   21.7   ? 906  GLU   A H    1 1 
ATOM   3268 H  HA   . GLU   A 1 216 ? -3.631  21.757  -27.231 0   22.28  ? 906  GLU   A HA   1 1 
ATOM   3269 H  HB2  . GLU   A 1 216 ? -2.002  19.836  -25.533 0   23.21  ? 906  GLU   A HB2  1 1 
ATOM   3270 H  HB3  . GLU   A 1 216 ? -3.031  21.12   -24.868 0   23.24  ? 906  GLU   A HB3  1 1 
ATOM   3271 H  HG2  . GLU   A 1 216 ? -4.993  20.084  -25.793 0   25.74  ? 906  GLU   A HG2  1 1 
ATOM   3272 H  HG3  . GLU   A 1 216 ? -3.993  18.825  -26.573 0   25.62  ? 906  GLU   A HG3  1 1 
ATOM   3273 N  N    . LEU   A 1 217 ? -0.36   22.009  -26.669 1   23.44  ? 907  LEU   A N    1 1 
ATOM   3274 C  CA   . LEU   A 1 217 ? 0.681   23.002  -26.388 1   24.25  ? 907  LEU   A CA   1 1 
ATOM   3275 C  C    . LEU   A 1 217 ? 0.725   24.06   -27.488 1   25.15  ? 907  LEU   A C    1 1 
ATOM   3276 O  O    . LEU   A 1 217 ? 0.717   25.254  -27.189 1   25.54  ? 907  LEU   A O    1 1 
ATOM   3277 C  CB   . LEU   A 1 217 ? 2.076   22.354  -26.223 1   24.27  ? 907  LEU   A CB   1 1 
ATOM   3278 C  CG   . LEU   A 1 217 ? 2.209   21.203  -25.221 1   25.69  ? 907  LEU   A CG   1 1 
ATOM   3279 C  CD1  . LEU   A 1 217 ? 3.638   20.742  -25.119 1   26.08  ? 907  LEU   A CD1  1 1 
ATOM   3280 C  CD2  . LEU   A 1 217 ? 1.642   21.558  -23.836 1   26.3   ? 907  LEU   A CD2  1 1 
ATOM   3281 H  H    . LEU   A 1 217 ? -0.016  21.079  -26.883 0   23.09  ? 907  LEU   A H    1 1 
ATOM   3282 H  HA   . LEU   A 1 217 ? 0.429   23.504  -25.455 0   23.68  ? 907  LEU   A HA   1 1 
ATOM   3283 H  HB2  . LEU   A 1 217 ? 2.386   21.968  -27.193 0   24     ? 907  LEU   A HB2  1 1 
ATOM   3284 H  HB3  . LEU   A 1 217 ? 2.771   23.131  -25.907 0   24.04  ? 907  LEU   A HB3  1 1 
ATOM   3285 H  HG   . LEU   A 1 217 ? 1.628   20.362  -25.598 0   25.02  ? 907  LEU   A HG   1 1 
ATOM   3286 H  HD11 . LEU   A 1 217 ? 3.696   19.924  -24.403 0   25.56  ? 907  LEU   A HD11 1 1 
ATOM   3287 H  HD12 . LEU   A 1 217 ? 3.969   20.403  -26.1   0   25.72  ? 907  LEU   A HD12 1 1 
ATOM   3288 H  HD13 . LEU   A 1 217 ? 4.258   21.574  -24.786 0   25.77  ? 907  LEU   A HD13 1 1 
ATOM   3289 H  HD21 . LEU   A 1 217 ? 1.815   20.713  -23.172 0   25.53  ? 907  LEU   A HD21 1 1 
ATOM   3290 H  HD22 . LEU   A 1 217 ? 2.163   22.434  -23.453 0   25.6   ? 907  LEU   A HD22 1 1 
ATOM   3291 H  HD23 . LEU   A 1 217 ? 0.571   21.75   -23.89  0   25.41  ? 907  LEU   A HD23 1 1 
ATOM   3292 N  N    . MET   A 1 218 ? 0.711   23.629  -28.754 1   25.32  ? 908  MET   A N    1 1 
ATOM   3293 C  CA   . MET   A 1 218 ? 0.809   24.537  -29.898 1   26.05  ? 908  MET   A CA   1 1 
ATOM   3294 C  C    . MET   A 1 218 ? -0.387  25.489  -30.02  1   26.31  ? 908  MET   A C    1 1 
ATOM   3295 O  O    . MET   A 1 218 ? -0.225  26.6    -30.513 1   26.1   ? 908  MET   A O    1 1 
ATOM   3296 C  CB   . MET   A 1 218 ? 1.026   23.741  -31.197 1   26.85  ? 908  MET   A CB   1 1 
ATOM   3297 C  CG   . MET   A 1 218 ? 2.321   22.908  -31.219 1   29.06  ? 908  MET   A CG   1 1 
ATOM   3298 S  SD   . MET   A 1 218 ? 3.821   23.88   -31.025 1   33.75  ? 908  MET   A SD   1 1 
ATOM   3299 C  CE   . MET   A 1 218 ? 5.035   22.587  -30.882 1   30.88  ? 908  MET   A CE   1 1 
ATOM   3300 H  H    . MET   A 1 218 ? 0.61    22.652  -29.01  0   24.7   ? 908  MET   A H    1 1 
ATOM   3301 H  HA   . MET   A 1 218 ? 1.687   25.16   -29.736 0   25.48  ? 908  MET   A HA   1 1 
ATOM   3302 H  HB2  . MET   A 1 218 ? 0.193   23.05   -31.32  0   26     ? 908  MET   A HB2  1 1 
ATOM   3303 H  HB3  . MET   A 1 218 ? 1.062   24.435  -32.035 0   26.13  ? 908  MET   A HB3  1 1 
ATOM   3304 H  HG2  . MET   A 1 218 ? 2.294   22.167  -30.421 0   28.04  ? 908  MET   A HG2  1 1 
ATOM   3305 H  HG3  . MET   A 1 218 ? 2.386   22.406  -32.183 0   28.17  ? 908  MET   A HG3  1 1 
ATOM   3306 H  HE1  . MET   A 1 218 ? 6.018   23.037  -30.75  0   30.49  ? 908  MET   A HE1  1 1 
ATOM   3307 H  HE2  . MET   A 1 218 ? 4.79    21.969  -30.02  0   29.91  ? 908  MET   A HE2  1 1 
ATOM   3308 H  HE3  . MET   A 1 218 ? 5.019   21.983  -31.788 0   30.1   ? 908  MET   A HE3  1 1 
ATOM   3309 N  N    . THR   A 1 219 ? -1.569  25.075  -29.554 1   26.79  ? 909  THR   A N    1 1 
ATOM   3310 C  CA   . THR   A 1 219 ? -2.759  25.937  -29.536 1   27.74  ? 909  THR   A CA   1 1 
ATOM   3311 C  C    . THR   A 1 219 ? -2.873  26.743  -28.216 1   28.89  ? 909  THR   A C    1 1 
ATOM   3312 O  O    . THR   A 1 219 ? -3.855  27.448  -28.042 1   29.47  ? 909  THR   A O    1 1 
ATOM   3313 C  CB   . THR   A 1 219 ? -4.044  25.092  -29.74  1   27.98  ? 909  THR   A CB   1 1 
ATOM   3314 O  OG1  . THR   A 1 219 ? -4.12   23.991  -28.823 1   28.23  ? 909  THR   A OG1  1 1 
ATOM   3315 C  CG2  . THR   A 1 219 ? -4.161  24.548  -31.135 1   28.57  ? 909  THR   A CG2  1 1 
ATOM   3316 H  H    . THR   A 1 219 ? -1.757  24.143  -29.198 0   25.87  ? 909  THR   A H    1 1 
ATOM   3317 H  HA   . THR   A 1 219 ? -2.711  26.661  -30.348 0   26.37  ? 909  THR   A HA   1 1 
ATOM   3318 H  HB   . THR   A 1 219 ? -4.912  25.73   -29.582 0   27.13  ? 909  THR   A HB   1 1 
ATOM   3319 H  HG1  . THR   A 1 219 ? -3.53   24.063  -28.028 0   27.05  ? 909  THR   A HG1  1 1 
ATOM   3320 H  HG21 . THR   A 1 219 ? -5.076  23.966  -31.233 0   27.77  ? 909  THR   A HG21 1 1 
ATOM   3321 H  HG22 . THR   A 1 219 ? -4.182  25.368  -31.851 0   27.59  ? 909  THR   A HG22 1 1 
ATOM   3322 H  HG23 . THR   A 1 219 ? -3.309  23.904  -31.346 0   27.45  ? 909  THR   A HG23 1 1 
ATOM   3323 N  N    . PHE   A 1 220 ? -1.896  26.632  -27.303 1   29.14  ? 910  PHE   A N    1 1 
ATOM   3324 C  CA   . PHE   A 1 220 ? -1.896  27.299  -26.011 1   30.06  ? 910  PHE   A CA   1 1 
ATOM   3325 C  C    . PHE   A 1 220 ? -3.088  26.869  -25.149 1   30.58  ? 910  PHE   A C    1 1 
ATOM   3326 O  O    . PHE   A 1 220 ? -3.761  27.697  -24.546 1   31     ? 910  PHE   A O    1 1 
ATOM   3327 C  CB   . PHE   A 1 220 ? -1.776  28.82   -26.164 1   30.23  ? 910  PHE   A CB   1 1 
ATOM   3328 C  CG   . PHE   A 1 220 ? -0.526  29.225  -26.912 1   31.18  ? 910  PHE   A CG   1 1 
ATOM   3329 C  CD1  . PHE   A 1 220 ? 0.715   29.169  -26.303 1   32.18  ? 910  PHE   A CD1  1 1 
ATOM   3330 C  CD2  . PHE   A 1 220 ? -0.593  29.663  -28.222 1   32.23  ? 910  PHE   A CD2  1 1 
ATOM   3331 C  CE1  . PHE   A 1 220 ? 1.864   29.534  -26.993 1   33.02  ? 910  PHE   A CE1  1 1 
ATOM   3332 C  CE2  . PHE   A 1 220 ? 0.557   30.055  -28.899 1   33     ? 910  PHE   A CE2  1 1 
ATOM   3333 C  CZ   . PHE   A 1 220 ? 1.777   29.972  -28.287 1   32.85  ? 910  PHE   A CZ   1 1 
ATOM   3334 H  H    . PHE   A 1 220 ? -1.056  26.078  -27.43  0   27.26  ? 910  PHE   A H    1 1 
ATOM   3335 H  HA   . PHE   A 1 220 ? -1.008  26.963  -25.478 0   28.86  ? 910  PHE   A HA   1 1 
ATOM   3336 H  HB2  . PHE   A 1 220 ? -2.642  29.192  -26.708 0   30.32  ? 910  PHE   A HB2  1 1 
ATOM   3337 H  HB3  . PHE   A 1 220 ? -1.73   29.276  -25.176 0   30.51  ? 910  PHE   A HB3  1 1 
ATOM   3338 H  HD1  . PHE   A 1 220 ? 0.793   28.821  -25.287 0   32.31  ? 910  PHE   A HD1  1 1 
ATOM   3339 H  HD2  . PHE   A 1 220 ? -1.547  29.731  -28.717 0   32.46  ? 910  PHE   A HD2  1 1 
ATOM   3340 H  HE1  . PHE   A 1 220 ? 2.822   29.485  -26.505 0   33.88  ? 910  PHE   A HE1  1 1 
ATOM   3341 H  HE2  . PHE   A 1 220 ? 0.491   30.389  -29.921 0   33.83  ? 910  PHE   A HE2  1 1 
ATOM   3342 H  HZ   . PHE   A 1 220 ? 2.667   30.267  -28.817 0   34.06  ? 910  PHE   A HZ   1 1 
ATOM   3343 N  N    . GLY   A 1 221 ? -3.305  25.559  -25.085 1   30.42  ? 911  GLY   A N    1 1 
ATOM   3344 C  CA   . GLY   A 1 221 ? -4.307  24.933  -24.238 1   30.58  ? 911  GLY   A CA   1 1 
ATOM   3345 C  C    . GLY   A 1 221 ? -5.718  24.818  -24.767 1   30.42  ? 911  GLY   A C    1 1 
ATOM   3346 O  O    . GLY   A 1 221 ? -6.643  24.765  -23.959 1   30.74  ? 911  GLY   A O    1 1 
ATOM   3347 H  H    . GLY   A 1 221 ? -2.777  24.871  -25.612 0   28.23  ? 911  GLY   A H    1 1 
ATOM   3348 H  HA2  . GLY   A 1 221 ? -3.97   23.923  -24.009 0   28.33  ? 911  GLY   A HA2  1 1 
ATOM   3349 H  HA3  . GLY   A 1 221 ? -4.359  25.474  -23.296 0   29.15  ? 911  GLY   A HA3  1 1 
ATOM   3350 N  N    . SER   A 1 222 ? -5.916  24.739  -26.097 1   29.95  ? 912  SER   A N    1 1 
ATOM   3351 C  CA   . SER   A 1 222 ? -7.27   24.575  -26.64  1   29.88  ? 912  SER   A CA   1 1 
ATOM   3352 C  C    . SER   A 1 222 ? -7.762  23.149  -26.377 1   29.55  ? 912  SER   A C    1 1 
ATOM   3353 O  O    . SER   A 1 222 ? -6.957  22.216  -26.249 1   29.16  ? 912  SER   A O    1 1 
ATOM   3354 C  CB   . SER   A 1 222 ? -7.319  24.873  -28.137 1   31.29  ? 912  SER   A CB   1 1 
ATOM   3355 O  OG   . SER   A 1 222 ? -7.124  26.251  -28.415 1   33.63  ? 912  SER   A OG   1 1 
ATOM   3356 H  H    . SER   A 1 222 ? -5.184  24.777  -26.8   0   28.19  ? 912  SER   A H    1 1 
ATOM   3357 H  HA   . SER   A 1 222 ? -7.946  25.27   -26.145 0   29.1   ? 912  SER   A HA   1 1 
ATOM   3358 H  HB2  . SER   A 1 222 ? -6.541  24.302  -28.641 0   29.46  ? 912  SER   A HB2  1 1 
ATOM   3359 H  HB3  . SER   A 1 222 ? -8.295  24.574  -28.516 0   30.16  ? 912  SER   A HB3  1 1 
ATOM   3360 H  HG   . SER   A 1 222 ? -6.989  26.383  -29.39  0   32.71  ? 912  SER   A HG   1 1 
ATOM   3361 N  N    . LYS   A 1 223 ? -9.085  22.991  -26.262 1   29.24  ? 913  LYS   A N    1 1 
ATOM   3362 C  CA   . LYS   A 1 223 ? -9.694  21.692  -26.008 1   29.8   ? 913  LYS   A CA   1 1 
ATOM   3363 C  C    . LYS   A 1 223 ? -9.74   20.91   -27.322 1   30.06  ? 913  LYS   A C    1 1 
ATOM   3364 O  O    . LYS   A 1 223 ? -10.288 21.45   -28.283 1   30.77  ? 913  LYS   A O    1 1 
ATOM   3365 C  CB   . LYS   A 1 223 ? -11.128 21.86   -25.464 1   32     ? 913  LYS   A CB   1 1 
ATOM   3366 C  CG   . LYS   A 1 223 ? -11.18  22.415  -24.044 1   37.11  ? 913  LYS   A CG   1 1 
ATOM   3367 C  CD   . LYS   A 1 223 ? -12.609 22.765  -23.619 1   43.23  ? 913  LYS   A CD   1 1 
ATOM   3368 C  CE   . LYS   A 1 223 ? -12.703 23.232  -22.179 1   48.39  ? 913  LYS   A CE   1 1 
ATOM   3369 N  NZ   . LYS   A 1 223 ? -12.516 22.136  -21.177 1   51.66  ? 913  LYS   A NZ   1 1 
ATOM   3370 H  H    . LYS   A 1 223 ? -9.75   23.753  -26.358 0   29.26  ? 913  LYS   A H    1 1 
ATOM   3371 H  HA   . LYS   A 1 223 ? -9.111  21.169  -25.252 0   29.22  ? 913  LYS   A HA   1 1 
ATOM   3372 H  HB2  . LYS   A 1 223 ? -11.689 22.531  -26.113 0   32.22  ? 913  LYS   A HB2  1 1 
ATOM   3373 H  HB3  . LYS   A 1 223 ? -11.609 20.883  -25.451 0   31.91  ? 913  LYS   A HB3  1 1 
ATOM   3374 H  HG2  . LYS   A 1 223 ? -10.803 21.662  -23.354 0   36.88  ? 913  LYS   A HG2  1 1 
ATOM   3375 H  HG3  . LYS   A 1 223 ? -10.576 23.319  -23.98  0   37.1   ? 913  LYS   A HG3  1 1 
ATOM   3376 H  HD2  . LYS   A 1 223 ? -12.972 23.576  -24.248 0   44.82  ? 913  LYS   A HD2  1 1 
ATOM   3377 H  HD3  . LYS   A 1 223 ? -13.245 21.889  -23.737 0   44.65  ? 913  LYS   A HD3  1 1 
ATOM   3378 H  HE2  . LYS   A 1 223 ? -11.942 23.99   -21.994 0   49.76  ? 913  LYS   A HE2  1 1 
ATOM   3379 H  HE3  . LYS   A 1 223 ? -13.695 23.65   -22.018 0   50.85  ? 913  LYS   A HE3  1 1 
ATOM   3380 H  HZ1  . LYS   A 1 223 ? -12.022 22.496  -20.367 0   52.83  ? 913  LYS   A HZ1  1 1 
ATOM   3381 H  HZ2  . LYS   A 1 223 ? -13.423 21.8    -20.87  0   53.61  ? 913  LYS   A HZ2  1 1 
ATOM   3382 H  HZ3  . LYS   A 1 223 ? -11.996 21.35   -21.551 0   52.37  ? 913  LYS   A HZ3  1 1 
ATOM   3383 N  N    . PRO   A 1 224 ? -9.225  19.66   -27.416 1   29.7   ? 914  PRO   A N    1 1 
ATOM   3384 C  CA   . PRO   A 1 224 ? -9.323  18.938  -28.697 1   29.65  ? 914  PRO   A CA   1 1 
ATOM   3385 C  C    . PRO   A 1 224 ? -10.765 18.557  -29.029 1   29.95  ? 914  PRO   A C    1 1 
ATOM   3386 O  O    . PRO   A 1 224 ? -11.509 18.17   -28.129 1   29.98  ? 914  PRO   A O    1 1 
ATOM   3387 C  CB   . PRO   A 1 224 ? -8.439  17.702  -28.493 1   30.31  ? 914  PRO   A CB   1 1 
ATOM   3388 C  CG   . PRO   A 1 224 ? -8.326  17.527  -27.049 1   30.79  ? 914  PRO   A CG   1 1 
ATOM   3389 C  CD   . PRO   A 1 224 ? -8.539  18.85   -26.386 1   29.15  ? 914  PRO   A CD   1 1 
ATOM   3390 H  HA   . PRO   A 1 224 ? -8.903  19.536  -29.505 0   29.26  ? 914  PRO   A HA   1 1 
ATOM   3391 H  HB2  . PRO   A 1 224 ? -8.91   16.832  -28.947 0   30.11  ? 914  PRO   A HB2  1 1 
ATOM   3392 H  HB3  . PRO   A 1 224 ? -7.459  17.884  -28.933 0   29.44  ? 914  PRO   A HB3  1 1 
ATOM   3393 H  HG2  . PRO   A 1 224 ? -9.084  16.818  -26.719 0   30.56  ? 914  PRO   A HG2  1 1 
ATOM   3394 H  HG3  . PRO   A 1 224 ? -7.33   17.152  -26.817 0   29.82  ? 914  PRO   A HG3  1 1 
ATOM   3395 H  HD2  . PRO   A 1 224 ? -9.168  18.722  -25.507 0   29.01  ? 914  PRO   A HD2  1 1 
ATOM   3396 H  HD3  . PRO   A 1 224 ? -7.582  19.301  -26.131 0   28.34  ? 914  PRO   A HD3  1 1 
ATOM   3397 N  N    . TYR   A 1 225 ? -11.166 18.694  -30.313 1   29.66  ? 915  TYR   A N    1 1 
ATOM   3398 C  CA   . TYR   A 1 225 ? -12.516 18.382  -30.803 1   30.42  ? 915  TYR   A CA   1 1 
ATOM   3399 C  C    . TYR   A 1 225 ? -13.57  19.088  -29.93  1   31.56  ? 915  TYR   A C    1 1 
ATOM   3400 O  O    . TYR   A 1 225 ? -14.447 18.44   -29.362 1   31.98  ? 915  TYR   A O    1 1 
ATOM   3401 C  CB   . TYR   A 1 225 ? -12.756 16.856  -30.878 1   30.06  ? 915  TYR   A CB   1 1 
ATOM   3402 C  CG   . TYR   A 1 225 ? -11.586 16.06   -31.425 1   30.56  ? 915  TYR   A CG   1 1 
ATOM   3403 C  CD1  . TYR   A 1 225 ? -11.426 15.871  -32.79  1   31.37  ? 915  TYR   A CD1  1 1 
ATOM   3404 C  CD2  . TYR   A 1 225 ? -10.714 15.401  -30.575 1   31.28  ? 915  TYR   A CD2  1 1 
ATOM   3405 C  CE1  . TYR   A 1 225 ? -10.383 15.102  -33.295 1   32.21  ? 915  TYR   A CE1  1 1 
ATOM   3406 C  CE2  . TYR   A 1 225 ? -9.658  14.648  -31.065 1   32.11  ? 915  TYR   A CE2  1 1 
ATOM   3407 C  CZ   . TYR   A 1 225 ? -9.497  14.491  -32.427 1   33.08  ? 915  TYR   A CZ   1 1 
ATOM   3408 O  OH   . TYR   A 1 225 ? -8.454  13.718  -32.892 1   34.8   ? 915  TYR   A OH   1 1 
ATOM   3409 H  H    . TYR   A 1 225 ? -10.553 19.024  -31.051 0   29.6   ? 915  TYR   A H    1 1 
ATOM   3410 H  HA   . TYR   A 1 225 ? -12.591 18.781  -31.813 0   31.07  ? 915  TYR   A HA   1 1 
ATOM   3411 H  HB2  . TYR   A 1 225 ? -12.973 16.465  -29.885 0   30.99  ? 915  TYR   A HB2  1 1 
ATOM   3412 H  HB3  . TYR   A 1 225 ? -13.597 16.663  -31.541 0   31.48  ? 915  TYR   A HB3  1 1 
ATOM   3413 H  HD1  . TYR   A 1 225 ? -12.11  16.348  -33.471 0   32.08  ? 915  TYR   A HD1  1 1 
ATOM   3414 H  HD2  . TYR   A 1 225 ? -10.825 15.528  -29.513 0   31.38  ? 915  TYR   A HD2  1 1 
ATOM   3415 H  HE1  . TYR   A 1 225 ? -10.267 14.997  -34.361 0   32.21  ? 915  TYR   A HE1  1 1 
ATOM   3416 H  HE2  . TYR   A 1 225 ? -8.978  14.168  -30.382 0   31.55  ? 915  TYR   A HE2  1 1 
ATOM   3417 H  HH   . TYR   A 1 225 ? -8.571  13.517  -33.857 0   34.16  ? 915  TYR   A HH   1 1 
ATOM   3418 N  N    . ASP   A 1 226 ? -13.405 20.404  -29.751 1   32.07  ? 916  ASP   A N    1 1 
ATOM   3419 C  CA   . ASP   A 1 226 ? -14.246 21.193  -28.864 1   33.65  ? 916  ASP   A CA   1 1 
ATOM   3420 C  C    . ASP   A 1 226 ? -15.707 21.219  -29.339 1   34.65  ? 916  ASP   A C    1 1 
ATOM   3421 O  O    . ASP   A 1 226 ? -15.978 21.496  -30.505 1   34.86  ? 916  ASP   A O    1 1 
ATOM   3422 C  CB   . ASP   A 1 226 ? -13.682 22.618  -28.733 1   35.99  ? 916  ASP   A CB   1 1 
ATOM   3423 C  CG   . ASP   A 1 226 ? -14.309 23.433  -27.616 1   42.43  ? 916  ASP   A CG   1 1 
ATOM   3424 O  OD1  . ASP   A 1 226 ? -14.701 22.834  -26.587 1   43.17  ? 916  ASP   A OD1  1 1 
ATOM   3425 O  OD2  . ASP   A 1 226 ? -14.394 24.676  -27.763 1   45.38  ? 916  ASP   A OD2  1 1 
ATOM   3426 H  H    . ASP   A 1 226 ? -12.698 20.952  -30.23  0   32.35  ? 916  ASP   A H    1 1 
ATOM   3427 H  HA   . ASP   A 1 226 ? -14.209 20.72   -27.884 0   35.21  ? 916  ASP   A HA   1 1 
ATOM   3428 H  HB2  . ASP   A 1 226 ? -12.613 22.559  -28.535 0   36.62  ? 916  ASP   A HB2  1 1 
ATOM   3429 H  HB3  . ASP   A 1 226 ? -13.851 23.15   -29.668 0   37.57  ? 916  ASP   A HB3  1 1 
ATOM   3430 N  N    . GLY   A 1 227 ? -16.628 20.888  -28.445 1   35.26  ? 917  GLY   A N    1 1 
ATOM   3431 C  CA   . GLY   A 1 227 ? -18.053 20.856  -28.776 1   36.59  ? 917  GLY   A CA   1 1 
ATOM   3432 C  C    . GLY   A 1 227 ? -18.504 19.582  -29.469 1   37.45  ? 917  GLY   A C    1 1 
ATOM   3433 O  O    . GLY   A 1 227 ? -19.7   19.359  -29.605 1   37.79  ? 917  GLY   A O    1 1 
ATOM   3434 H  H    . GLY   A 1 227 ? -16.434 20.637  -27.481 0   38.71  ? 917  GLY   A H    1 1 
ATOM   3435 H  HA2  . GLY   A 1 227 ? -18.626 20.953  -27.855 0   42.23  ? 917  GLY   A HA2  1 1 
ATOM   3436 H  HA3  . GLY   A 1 227 ? -18.308 21.703  -29.412 0   41.86  ? 917  GLY   A HA3  1 1 
ATOM   3437 N  N    . ILE   A 1 228 ? -17.562 18.725  -29.904 1   37.94  ? 918  ILE   A N    1 1 
ATOM   3438 C  CA   . ILE   A 1 228 ? -17.871 17.462  -30.577 1   38.4   ? 918  ILE   A CA   1 1 
ATOM   3439 C  C    . ILE   A 1 228 ? -18.061 16.387  -29.494 1   39.2   ? 918  ILE   A C    1 1 
ATOM   3440 O  O    . ILE   A 1 228 ? -17.199 16.302  -28.615 1   39.54  ? 918  ILE   A O    1 1 
ATOM   3441 C  CB   . ILE   A 1 228 ? -16.715 17.089  -31.557 1   38.57  ? 918  ILE   A CB   1 1 
ATOM   3442 C  CG1  . ILE   A 1 228 ? -16.704 18.049  -32.784 1   39.1   ? 918  ILE   A CG1  1 1 
ATOM   3443 C  CG2  . ILE   A 1 228 ? -16.832 15.626  -32.02  1   39.05  ? 918  ILE   A CG2  1 1 
ATOM   3444 C  CD1  . ILE   A 1 228 ? -15.361 18.192  -33.486 1   39.89  ? 918  ILE   A CD1  1 1 
ATOM   3445 H  H    . ILE   A 1 228 ? -16.563 18.875  -29.804 0   41.26  ? 918  ILE   A H    1 1 
ATOM   3446 H  HA   . ILE   A 1 228 ? -18.774 17.591  -31.17  0   43.96  ? 918  ILE   A HA   1 1 
ATOM   3447 H  HB   . ILE   A 1 228 ? -15.765 17.183  -31.035 0   41.17  ? 918  ILE   A HB   1 1 
ATOM   3448 H  HG12 . ILE   A 1 228 ? -17.417 17.68   -33.52  0   43.19  ? 918  ILE   A HG12 1 1 
ATOM   3449 H  HG13 . ILE   A 1 228 ? -17     19.047  -32.465 0   42.76  ? 918  ILE   A HG13 1 1 
ATOM   3450 H  HG21 . ILE   A 1 228 ? -16.021 15.409  -32.713 0   42.09  ? 918  ILE   A HG21 1 1 
ATOM   3451 H  HG22 . ILE   A 1 228 ? -16.754 14.943  -31.176 0   42.94  ? 918  ILE   A HG22 1 1 
ATOM   3452 H  HG23 . ILE   A 1 228 ? -17.784 15.492  -32.53  0   43.81  ? 918  ILE   A HG23 1 1 
ATOM   3453 H  HD11 . ILE   A 1 228 ? -15.475 18.886  -34.317 0   42.09  ? 918  ILE   A HD11 1 1 
ATOM   3454 H  HD12 . ILE   A 1 228 ? -14.644 18.591  -32.771 0   41.4   ? 918  ILE   A HD12 1 1 
ATOM   3455 H  HD13 . ILE   A 1 228 ? -15.028 17.223  -33.855 0   41.8   ? 918  ILE   A HD13 1 1 
ATOM   3456 N  N    . PRO   A 1 229 ? -19.119 15.534  -29.53  1   39.17  ? 919  PRO   A N    1 1 
ATOM   3457 C  CA   . PRO   A 1 229 ? -19.241 14.49   -28.494 1   39.19  ? 919  PRO   A CA   1 1 
ATOM   3458 C  C    . PRO   A 1 229 ? -18.223 13.366  -28.7   1   39.51  ? 919  PRO   A C    1 1 
ATOM   3459 O  O    . PRO   A 1 229 ? -17.822 13.103  -29.832 1   39.49  ? 919  PRO   A O    1 1 
ATOM   3460 C  CB   . PRO   A 1 229 ? -20.698 14.013  -28.629 1   39.89  ? 919  PRO   A CB   1 1 
ATOM   3461 C  CG   . PRO   A 1 229 ? -21.099 14.356  -30.008 1   40.34  ? 919  PRO   A CG   1 1 
ATOM   3462 C  CD   . PRO   A 1 229 ? -20.217 15.451  -30.519 1   39.11  ? 919  PRO   A CD   1 1 
ATOM   3463 H  HA   . PRO   A 1 229 ? -19.117 14.917  -27.499 0   45.62  ? 919  PRO   A HA   1 1 
ATOM   3464 H  HB2  . PRO   A 1 229 ? -20.751 12.937  -28.47  0   48.88  ? 919  PRO   A HB2  1 1 
ATOM   3465 H  HB3  . PRO   A 1 229 ? -21.321 14.542  -27.909 0   49.13  ? 919  PRO   A HB3  1 1 
ATOM   3466 H  HG2  . PRO   A 1 229 ? -21.005 13.472  -30.638 0   49.36  ? 919  PRO   A HG2  1 1 
ATOM   3467 H  HG3  . PRO   A 1 229 ? -22.127 14.715  -30.005 0   50.46  ? 919  PRO   A HG3  1 1 
ATOM   3468 H  HD2  . PRO   A 1 229 ? -19.833 15.186  -31.503 0   46.21  ? 919  PRO   A HD2  1 1 
ATOM   3469 H  HD3  . PRO   A 1 229 ? -20.769 16.388  -30.549 0   47.1   ? 919  PRO   A HD3  1 1 
ATOM   3470 N  N    . ALA   A 1 230 ? -17.778 12.724  -27.619 1   40.05  ? 920  ALA   A N    1 1 
ATOM   3471 C  CA   . ALA   A 1 230 ? -16.752 11.674  -27.718 1   41.33  ? 920  ALA   A CA   1 1 
ATOM   3472 C  C    . ALA   A 1 230 ? -17.2   10.446  -28.519 1   42.07  ? 920  ALA   A C    1 1 
ATOM   3473 O  O    . ALA   A 1 230 ? -16.368 9.732   -29.085 1   42.15  ? 920  ALA   A O    1 1 
ATOM   3474 C  CB   . ALA   A 1 230 ? -16.325 11.243  -26.346 1   41.44  ? 920  ALA   A CB   1 1 
ATOM   3475 H  H    . ALA   A 1 230 ? -18.101 12.901  -26.674 0   46.1   ? 920  ALA   A H    1 1 
ATOM   3476 H  HA   . ALA   A 1 230 ? -15.866 12.108  -28.175 0   45.32  ? 920  ALA   A HA   1 1 
ATOM   3477 H  HB1  . ALA   A 1 230 ? -15.568 10.466  -26.438 0   45.87  ? 920  ALA   A HB1  1 1 
ATOM   3478 H  HB2  . ALA   A 1 230 ? -15.936 12.102  -25.801 0   45.59  ? 920  ALA   A HB2  1 1 
ATOM   3479 H  HB3  . ALA   A 1 230 ? -17.214 10.851  -25.857 0   47.35  ? 920  ALA   A HB3  1 1 
ATOM   3480 N  N    . SER   A 1 231 ? -18.506 10.178  -28.528 1   42.45  ? 921  SER   A N    1 1 
ATOM   3481 C  CA   . SER   A 1 231 ? -19.084 9.061   -29.27  1   43.19  ? 921  SER   A CA   1 1 
ATOM   3482 C  C    . SER   A 1 231 ? -18.98  9.218   -30.797 1   43.51  ? 921  SER   A C    1 1 
ATOM   3483 O  O    . SER   A 1 231 ? -19.294 8.261   -31.507 1   44.57  ? 921  SER   A O    1 1 
ATOM   3484 C  CB   . SER   A 1 231 ? -20.544 8.869   -28.876 1   44.62  ? 921  SER   A CB   1 1 
ATOM   3485 O  OG   . SER   A 1 231 ? -21.243 10.102  -28.953 1   47.51  ? 921  SER   A OG   1 1 
ATOM   3486 H  H    . SER   A 1 231 ? -19.195 10.71   -28.007 0   50.47  ? 921  SER   A H    1 1 
ATOM   3487 H  HA   . SER   A 1 231 ? -18.557 8.149   -28.992 0   51.72  ? 921  SER   A HA   1 1 
ATOM   3488 H  HB2  . SER   A 1 231 ? -21.013 8.152   -29.549 0   56.18  ? 921  SER   A HB2  1 1 
ATOM   3489 H  HB3  . SER   A 1 231 ? -20.583 8.487   -27.857 0   55.53  ? 921  SER   A HB3  1 1 
ATOM   3490 H  HG   . SER   A 1 231 ? -21.994 10.122  -28.303 0   59.2   ? 921  SER   A HG   1 1 
ATOM   3491 N  N    . GLU   A 1 232 ? -18.582 10.406  -31.304 1   42.25  ? 922  GLU   A N    1 1 
ATOM   3492 C  CA   . GLU   A 1 232 ? -18.408 10.666  -32.738 1   41.53  ? 922  GLU   A CA   1 1 
ATOM   3493 C  C    . GLU   A 1 232 ? -16.936 10.601  -33.183 1   40.53  ? 922  GLU   A C    1 1 
ATOM   3494 O  O    . GLU   A 1 232 ? -16.68  10.687  -34.378 1   40.8   ? 922  GLU   A O    1 1 
ATOM   3495 C  CB   . GLU   A 1 232 ? -18.889 12.095  -33.061 1   42.98  ? 922  GLU   A CB   1 1 
ATOM   3496 C  CG   . GLU   A 1 232 ? -19.386 12.284  -34.487 1   46.68  ? 922  GLU   A CG   1 1 
ATOM   3497 C  CD   . GLU   A 1 232 ? -19.594 13.721  -34.92  1   51.17  ? 922  GLU   A CD   1 1 
ATOM   3498 O  OE1  . GLU   A 1 232 ? -19.537 14.623  -34.053 1   50.74  ? 922  GLU   A OE1  1 1 
ATOM   3499 O  OE2  . GLU   A 1 232 ? -19.822 13.942  -36.131 1   53.7   ? 922  GLU   A OE2  1 1 
ATOM   3500 H  H    . GLU   A 1 232 ? -18.375 11.228  -30.746 0   49.01  ? 922  GLU   A H    1 1 
ATOM   3501 H  HA   . GLU   A 1 232 ? -18.975 9.937   -33.316 0   49.57  ? 922  GLU   A HA   1 1 
ATOM   3502 H  HB2  . GLU   A 1 232 ? -19.667 12.379  -32.355 0   50.72  ? 922  GLU   A HB2  1 1 
ATOM   3503 H  HB3  . GLU   A 1 232 ? -18.037 12.76   -32.929 0   48.76  ? 922  GLU   A HB3  1 1 
ATOM   3504 H  HG2  . GLU   A 1 232 ? -18.652 11.85   -35.165 0   53.51  ? 922  GLU   A HG2  1 1 
ATOM   3505 H  HG3  . GLU   A 1 232 ? -20.333 11.762  -34.608 0   55.44  ? 922  GLU   A HG3  1 1 
ATOM   3506 N  N    . ILE   A 1 233 ? -15.979 10.481  -32.251 1   39.39  ? 923  ILE   A N    1 1 
ATOM   3507 C  CA   . ILE   A 1 233 ? -14.558 10.562  -32.582 1   38.85  ? 923  ILE   A CA   1 1 
ATOM   3508 C  C    . ILE   A 1 233 ? -14.114 9.407   -33.486 1   39.25  ? 923  ILE   A C    1 1 
ATOM   3509 O  O    . ILE   A 1 233 ? -13.451 9.658   -34.489 1   39.22  ? 923  ILE   A O    1 1 
ATOM   3510 C  CB   . ILE   A 1 233 ? -13.691 10.697  -31.293 1   38.79  ? 923  ILE   A CB   1 1 
ATOM   3511 C  CG1  . ILE   A 1 233 ? -14.101 11.951  -30.455 1   39.31  ? 923  ILE   A CG1  1 1 
ATOM   3512 C  CG2  . ILE   A 1 233 ? -12.164 10.688  -31.585 1   38.5   ? 923  ILE   A CG2  1 1 
ATOM   3513 C  CD1  . ILE   A 1 233 ? -13.933 13.362  -31.064 1   40.41  ? 923  ILE   A CD1  1 1 
ATOM   3514 H  H    . ILE   A 1 233 ? -16.156 10.251  -31.279 0   44.26  ? 923  ILE   A H    1 1 
ATOM   3515 H  HA   . ILE   A 1 233 ? -14.436 11.488  -33.143 0   41.6   ? 923  ILE   A HA   1 1 
ATOM   3516 H  HB   . ILE   A 1 233 ? -13.897 9.824   -30.676 0   41.85  ? 923  ILE   A HB   1 1 
ATOM   3517 H  HG12 . ILE   A 1 233 ? -15.164 11.856  -30.247 0   42.62  ? 923  ILE   A HG12 1 1 
ATOM   3518 H  HG13 . ILE   A 1 233 ? -13.538 11.936  -29.523 0   41.21  ? 923  ILE   A HG13 1 1 
ATOM   3519 H  HG21 . ILE   A 1 233 ? -11.634 10.828  -30.644 0   39.36  ? 923  ILE   A HG21 1 1 
ATOM   3520 H  HG22 . ILE   A 1 233 ? -11.868 9.733   -32.017 0   40.01  ? 923  ILE   A HG22 1 1 
ATOM   3521 H  HG23 . ILE   A 1 233 ? -11.916 11.495  -32.272 0   39.28  ? 923  ILE   A HG23 1 1 
ATOM   3522 H  HD11 . ILE   A 1 233 ? -14.258 14.09   -30.323 0   42.24  ? 923  ILE   A HD11 1 1 
ATOM   3523 H  HD12 . ILE   A 1 233 ? -12.889 13.549  -31.312 0   41.26  ? 923  ILE   A HD12 1 1 
ATOM   3524 H  HD13 . ILE   A 1 233 ? -14.55  13.469  -31.955 0   42.61  ? 923  ILE   A HD13 1 1 
ATOM   3525 N  N    . SER   A 1 234 ? -14.524 8.158   -33.2   1   39.81  ? 924  SER   A N    1 1 
ATOM   3526 C  CA   . SER   A 1 234 ? -14.133 7.015   -34.049 1   40.73  ? 924  SER   A CA   1 1 
ATOM   3527 C  C    . SER   A 1 234 ? -14.531 7.232   -35.519 1   40.64  ? 924  SER   A C    1 1 
ATOM   3528 O  O    . SER   A 1 234 ? -13.711 7.024   -36.413 1   41.11  ? 924  SER   A O    1 1 
ATOM   3529 C  CB   . SER   A 1 234 ? -14.721 5.708   -33.524 1   42.56  ? 924  SER   A CB   1 1 
ATOM   3530 O  OG   . SER   A 1 234 ? -16.076 5.513   -33.893 1   45.94  ? 924  SER   A OG   1 1 
ATOM   3531 H  H    . SER   A 1 234 ? -15.107 7.914   -32.405 0   44.97  ? 924  SER   A H    1 1 
ATOM   3532 H  HA   . SER   A 1 234 ? -13.049 6.919   -34.017 0   44.73  ? 924  SER   A HA   1 1 
ATOM   3533 H  HB2  . SER   A 1 234 ? -14.133 4.89    -33.938 0   48.95  ? 924  SER   A HB2  1 1 
ATOM   3534 H  HB3  . SER   A 1 234 ? -14.65  5.688   -32.438 0   48.73  ? 924  SER   A HB3  1 1 
ATOM   3535 H  HG   . SER   A 1 234 ? -16.617 6.326   -33.71  0   53.51  ? 924  SER   A HG   1 1 
ATOM   3536 N  N    . SER   A 1 235 ? -15.743 7.758   -35.735 1   39.86  ? 925  SER   A N    1 1 
ATOM   3537 C  CA   . SER   A 1 235 ? -16.305 8.088   -37.054 1   39.33  ? 925  SER   A CA   1 1 
ATOM   3538 C  C    . SER   A 1 235 ? -15.497 9.21    -37.723 1   37.99  ? 925  SER   A C    1 1 
ATOM   3539 O  O    . SER   A 1 235 ? -15.148 9.087   -38.891 1   37.88  ? 925  SER   A O    1 1 
ATOM   3540 C  CB   . SER   A 1 235 ? -17.763 8.53    -36.927 1   40.99  ? 925  SER   A CB   1 1 
ATOM   3541 O  OG   . SER   A 1 235 ? -18.422 7.936   -35.818 1   44.46  ? 925  SER   A OG   1 1 
ATOM   3542 H  H    . SER   A 1 235 ? -16.393 7.962   -34.984 0   46.28  ? 925  SER   A H    1 1 
ATOM   3543 H  HA   . SER   A 1 235 ? -16.27  7.207   -37.693 0   46.25  ? 925  SER   A HA   1 1 
ATOM   3544 H  HB2  . SER   A 1 235 ? -17.801 9.613   -36.821 0   48.02  ? 925  SER   A HB2  1 1 
ATOM   3545 H  HB3  . SER   A 1 235 ? -18.287 8.24    -37.837 0   49.38  ? 925  SER   A HB3  1 1 
ATOM   3546 H  HG   . SER   A 1 235 ? -18.323 8.497   -35.005 0   52.58  ? 925  SER   A HG   1 1 
ATOM   3547 N  N    . ILE   A 1 236 ? -15.21  10.295  -36.985 1   37.09  ? 926  ILE   A N    1 1 
ATOM   3548 C  CA   . ILE   A 1 236 ? -14.411 11.434  -37.472 1   37.33  ? 926  ILE   A CA   1 1 
ATOM   3549 C  C    . ILE   A 1 236 ? -13.031 10.946  -37.92  1   36.87  ? 926  ILE   A C    1 1 
ATOM   3550 O  O    . ILE   A 1 236 ? -12.589 11.28   -39.016 1   37.28  ? 926  ILE   A O    1 1 
ATOM   3551 C  CB   . ILE   A 1 236 ? -14.318 12.553  -36.37  1   38.01  ? 926  ILE   A CB   1 1 
ATOM   3552 C  CG1  . ILE   A 1 236 ? -15.677 13.313  -36.273 1   38.98  ? 926  ILE   A CG1  1 1 
ATOM   3553 C  CG2  . ILE   A 1 236 ? -13.18  13.556  -36.65  1   38.52  ? 926  ILE   A CG2  1 1 
ATOM   3554 C  CD1  . ILE   A 1 236 ? -15.93  13.999  -34.987 1   40.47  ? 926  ILE   A CD1  1 1 
ATOM   3555 H  H    . ILE   A 1 236 ? -15.517 10.403  -36.023 0   41.39  ? 926  ILE   A H    1 1 
ATOM   3556 H  HA   . ILE   A 1 236 ? -14.907 11.857  -38.344 0   40.57  ? 926  ILE   A HA   1 1 
ATOM   3557 H  HB   . ILE   A 1 236 ? -14.107 12.09   -35.407 0   40.32  ? 926  ILE   A HB   1 1 
ATOM   3558 H  HG12 . ILE   A 1 236 ? -15.712 14.068  -37.057 0   42.16  ? 926  ILE   A HG12 1 1 
ATOM   3559 H  HG13 . ILE   A 1 236 ? -16.492 12.606  -36.416 0   43.31  ? 926  ILE   A HG13 1 1 
ATOM   3560 H  HG21 . ILE   A 1 236 ? -13.137 14.281  -35.84  0   39.42  ? 926  ILE   A HG21 1 1 
ATOM   3561 H  HG22 . ILE   A 1 236 ? -12.216 13.053  -36.715 0   39.11  ? 926  ILE   A HG22 1 1 
ATOM   3562 H  HG23 . ILE   A 1 236 ? -13.406 14.082  -37.575 0   39.71  ? 926  ILE   A HG23 1 1 
ATOM   3563 H  HD11 . ILE   A 1 236 ? -16.913 14.466  -35.032 0   44.58  ? 926  ILE   A HD11 1 1 
ATOM   3564 H  HD12 . ILE   A 1 236 ? -15.91  13.264  -34.185 0   43.96  ? 926  ILE   A HD12 1 1 
ATOM   3565 H  HD13 . ILE   A 1 236 ? -15.176 14.764  -34.808 0   42.88  ? 926  ILE   A HD13 1 1 
ATOM   3566 N  N    . LEU   A 1 237 ? -12.387 10.108  -37.108 1   36.06  ? 927  LEU   A N    1 1 
ATOM   3567 C  CA   . LEU   A 1 237 ? -11.065 9.579   -37.42  1   36.04  ? 927  LEU   A CA   1 1 
ATOM   3568 C  C    . LEU   A 1 237 ? -11.087 8.61    -38.604 1   36.97  ? 927  LEU   A C    1 1 
ATOM   3569 O  O    . LEU   A 1 237 ? -10.167 8.634   -39.414 1   37     ? 927  LEU   A O    1 1 
ATOM   3570 C  CB   . LEU   A 1 237 ? -10.446 8.887   -36.189 1   35.66  ? 927  LEU   A CB   1 1 
ATOM   3571 C  CG   . LEU   A 1 237 ? -10.235 9.729   -34.913 1   36.52  ? 927  LEU   A CG   1 1 
ATOM   3572 C  CD1  . LEU   A 1 237 ? -9.716  8.864   -33.786 1   36.9   ? 927  LEU   A CD1  1 1 
ATOM   3573 C  CD2  . LEU   A 1 237 ? -9.296  10.927  -35.149 1   36.63  ? 927  LEU   A CD2  1 1 
ATOM   3574 H  H    . LEU   A 1 237 ? -12.772 9.759   -36.236 0   38.33  ? 927  LEU   A H    1 1 
ATOM   3575 H  HA   . LEU   A 1 237 ? -10.427 10.414  -37.705 0   36.47  ? 927  LEU   A HA   1 1 
ATOM   3576 H  HB2  . LEU   A 1 237 ? -11.111 8.071   -35.914 0   37.63  ? 927  LEU   A HB2  1 1 
ATOM   3577 H  HB3  . LEU   A 1 237 ? -9.476  8.485   -36.476 0   36.4   ? 927  LEU   A HB3  1 1 
ATOM   3578 H  HG   . LEU   A 1 237 ? -11.2   10.126  -34.6   0   37.42  ? 927  LEU   A HG   1 1 
ATOM   3579 H  HD11 . LEU   A 1 237 ? -9.573  9.479   -32.899 0   37.03  ? 927  LEU   A HD11 1 1 
ATOM   3580 H  HD12 . LEU   A 1 237 ? -10.444 8.08    -33.582 0   38.32  ? 927  LEU   A HD12 1 1 
ATOM   3581 H  HD13 . LEU   A 1 237 ? -8.768  8.417   -34.086 0   37.15  ? 927  LEU   A HD13 1 1 
ATOM   3582 H  HD21 . LEU   A 1 237 ? -9.1    11.411  -34.194 0   35.72  ? 927  LEU   A HD21 1 1 
ATOM   3583 H  HD22 . LEU   A 1 237 ? -8.365  10.569  -35.586 0   35.68  ? 927  LEU   A HD22 1 1 
ATOM   3584 H  HD23 . LEU   A 1 237 ? -9.766  11.642  -35.823 0   36.06  ? 927  LEU   A HD23 1 1 
ATOM   3585 N  N    . GLU   A 1 238 ? -12.133 7.768   -38.723 1   37.72  ? 928  GLU   A N    1 1 
ATOM   3586 C  CA   . GLU   A 1 238 ? -12.245 6.839   -39.852 1   38.54  ? 928  GLU   A CA   1 1 
ATOM   3587 C  C    . GLU   A 1 238 ? -12.49  7.584   -41.173 1   39.07  ? 928  GLU   A C    1 1 
ATOM   3588 O  O    . GLU   A 1 238 ? -12.078 7.09    -42.22  1   39.74  ? 928  GLU   A O    1 1 
ATOM   3589 C  CB   . GLU   A 1 238 ? -13.35  5.806   -39.608 1   40.81  ? 928  GLU   A CB   1 1 
ATOM   3590 C  CG   . GLU   A 1 238 ? -12.975 4.735   -38.596 1   44.67  ? 928  GLU   A CG   1 1 
ATOM   3591 C  CD   . GLU   A 1 238 ? -14.133 3.903   -38.081 1   50.66  ? 928  GLU   A CD   1 1 
ATOM   3592 O  OE1  . GLU   A 1 238 ? -15.302 4.246   -38.373 1   53.68  ? 928  GLU   A OE1  1 1 
ATOM   3593 O  OE2  . GLU   A 1 238 ? -13.87  2.909   -37.369 1   51.69  ? 928  GLU   A OE2  1 1 
ATOM   3594 H  H    . GLU   A 1 238 ? -12.898 7.712   -38.058 0   41.36  ? 928  GLU   A H    1 1 
ATOM   3595 H  HA   . GLU   A 1 238 ? -11.301 6.308   -39.962 0   42.06  ? 928  GLU   A HA   1 1 
ATOM   3596 H  HB2  . GLU   A 1 238 ? -14.239 6.329   -39.261 0   46.59  ? 928  GLU   A HB2  1 1 
ATOM   3597 H  HB3  . GLU   A 1 238 ? -13.567 5.306   -40.551 0   46.89  ? 928  GLU   A HB3  1 1 
ATOM   3598 H  HG2  . GLU   A 1 238 ? -12.266 4.055   -39.064 0   50.48  ? 928  GLU   A HG2  1 1 
ATOM   3599 H  HG3  . GLU   A 1 238 ? -12.505 5.211   -37.736 0   49.65  ? 928  GLU   A HG3  1 1 
ATOM   3600 N  N    . LYS   A 1 239 ? -13.128 8.776   -41.129 1   38.51  ? 929  LYS   A N    1 1 
ATOM   3601 C  CA   . LYS   A 1 239 ? -13.327 9.611   -42.32  1   38.51  ? 929  LYS   A CA   1 1 
ATOM   3602 C  C    . LYS   A 1 239 ? -12.021 10.32   -42.777 1   37.68  ? 929  LYS   A C    1 1 
ATOM   3603 O  O    . LYS   A 1 239 ? -12.062 11.061  -43.756 1   38.34  ? 929  LYS   A O    1 1 
ATOM   3604 C  CB   . LYS   A 1 239 ? -14.415 10.686  -42.058 1   41.15  ? 929  LYS   A CB   1 1 
ATOM   3605 C  CG   . LYS   A 1 239 ? -15.835 10.142  -41.982 1   46.93  ? 929  LYS   A CG   1 1 
ATOM   3606 C  CD   . LYS   A 1 239 ? -16.902 11.245  -41.823 1   52.67  ? 929  LYS   A CD   1 1 
ATOM   3607 C  CE   . LYS   A 1 239 ? -17.051 11.741  -40.397 1   57.01  ? 929  LYS   A CE   1 1 
ATOM   3608 N  NZ   . LYS   A 1 239 ? -18.297 12.538  -40.174 1   59.78  ? 929  LYS   A NZ   1 1 
ATOM   3609 H  H    . LYS   A 1 239 ? -13.523 9.179   -40.285 0   41.99  ? 929  LYS   A H    1 1 
ATOM   3610 H  HA   . LYS   A 1 239 ? -13.674 8.986   -43.142 0   42.57  ? 929  LYS   A HA   1 1 
ATOM   3611 H  HB2  . LYS   A 1 239 ? -14.191 11.195  -41.122 0   44.29  ? 929  LYS   A HB2  1 1 
ATOM   3612 H  HB3  . LYS   A 1 239 ? -14.402 11.413  -42.869 0   44.54  ? 929  LYS   A HB3  1 1 
ATOM   3613 H  HG2  . LYS   A 1 239 ? -16.052 9.612   -42.908 0   52.74  ? 929  LYS   A HG2  1 1 
ATOM   3614 H  HG3  . LYS   A 1 239 ? -15.912 9.457   -41.138 0   52.47  ? 929  LYS   A HG3  1 1 
ATOM   3615 H  HD2  . LYS   A 1 239 ? -16.626 12.099  -42.44  0   57.82  ? 929  LYS   A HD2  1 1 
ATOM   3616 H  HD3  . LYS   A 1 239 ? -17.859 10.845  -42.154 0   59.56  ? 929  LYS   A HD3  1 1 
ATOM   3617 H  HE2  . LYS   A 1 239 ? -17.069 10.894  -39.711 0   62.81  ? 929  LYS   A HE2  1 1 
ATOM   3618 H  HE3  . LYS   A 1 239 ? -16.21  12.394  -40.17  0   61.38  ? 929  LYS   A HE3  1 1 
ATOM   3619 H  HZ1  . LYS   A 1 239 ? -18.611 12.416  -39.217 0   66.57  ? 929  LYS   A HZ1  1 1 
ATOM   3620 H  HZ2  . LYS   A 1 239 ? -18.101 13.524  -40.32  0   65.64  ? 929  LYS   A HZ2  1 1 
ATOM   3621 H  HZ3  . LYS   A 1 239 ? -19.043 12.258  -40.802 0   67.19  ? 929  LYS   A HZ3  1 1 
ATOM   3622 N  N    . GLY   A 1 240 ? -10.895 10.113  -42.083 1   36.03  ? 930  GLY   A N    1 1 
ATOM   3623 C  CA   . GLY   A 1 240 ? -9.638  10.772  -42.406 1   35.09  ? 930  GLY   A CA   1 1 
ATOM   3624 C  C    . GLY   A 1 240 ? -9.522  12.188  -41.866 1   33.71  ? 930  GLY   A C    1 1 
ATOM   3625 O  O    . GLY   A 1 240 ? -8.61   12.913  -42.26  1   33.79  ? 930  GLY   A O    1 1 
ATOM   3626 H  H    . GLY   A 1 240 ? -10.807 9.489   -41.287 0   37.5   ? 930  GLY   A H    1 1 
ATOM   3627 H  HA2  . GLY   A 1 240 ? -8.82   10.188  -41.989 0   35.11  ? 930  GLY   A HA2  1 1 
ATOM   3628 H  HA3  . GLY   A 1 240 ? -9.502  10.805  -43.486 0   35.41  ? 930  GLY   A HA3  1 1 
ATOM   3629 N  N    . GLU   A 1 241 ? -10.435 12.606  -40.96  1   32.33  ? 931  GLU   A N    1 1 
ATOM   3630 C  CA   . GLU   A 1 241 ? -10.4   13.952  -40.385 1   30.99  ? 931  GLU   A CA   1 1 
ATOM   3631 C  C    . GLU   A 1 241 ? -9.52   13.99   -39.138 1   29.01  ? 931  GLU   A C    1 1 
ATOM   3632 O  O    . GLU   A 1 241 ? -9.456  13.003  -38.406 1   28.91  ? 931  GLU   A O    1 1 
ATOM   3633 C  CB   . GLU   A 1 241 ? -11.815 14.415  -40.04  1   33.09  ? 931  GLU   A CB   1 1 
ATOM   3634 C  CG   . GLU   A 1 241 ? -12.681 14.69   -41.259 1   37.4   ? 931  GLU   A CG   1 1 
ATOM   3635 C  CD   . GLU   A 1 241 ? -14.091 15.102  -40.902 1   43.3   ? 931  GLU   A CD   1 1 
ATOM   3636 O  OE1  . GLU   A 1 241 ? -15.025 14.766  -41.666 1   44.89  ? 931  GLU   A OE1  1 1 
ATOM   3637 O  OE2  . GLU   A 1 241 ? -14.263 15.755  -39.847 1   45.11  ? 931  GLU   A OE2  1 1 
ATOM   3638 H  H    . GLU   A 1 241 ? -11.191 12.036  -40.595 0   33.3   ? 931  GLU   A H    1 1 
ATOM   3639 H  HA   . GLU   A 1 241 ? -9.989  14.655  -41.108 0   31.26  ? 931  GLU   A HA   1 1 
ATOM   3640 H  HB2  . GLU   A 1 241 ? -12.3   13.621  -39.476 0   34.02  ? 931  GLU   A HB2  1 1 
ATOM   3641 H  HB3  . GLU   A 1 241 ? -11.747 15.32   -39.439 0   33.42  ? 931  GLU   A HB3  1 1 
ATOM   3642 H  HG2  . GLU   A 1 241 ? -12.232 15.494  -41.84  0   37.78  ? 931  GLU   A HG2  1 1 
ATOM   3643 H  HG3  . GLU   A 1 241 ? -12.741 13.79   -41.869 0   38.53  ? 931  GLU   A HG3  1 1 
ATOM   3644 N  N    . ARG   A 1 242 ? -8.857  15.128  -38.88  1   27.22  ? 932  ARG   A N    1 1 
ATOM   3645 C  CA   . ARG   A 1 242 ? -7.957  15.25   -37.725 1   27.07  ? 932  ARG   A CA   1 1 
ATOM   3646 C  C    . ARG   A 1 242 ? -7.98   16.657  -37.107 1   27.07  ? 932  ARG   A C    1 1 
ATOM   3647 O  O    . ARG   A 1 242 ? -8.602  17.568  -37.666 1   27.09  ? 932  ARG   A O    1 1 
ATOM   3648 C  CB   . ARG   A 1 242 ? -6.5    14.871  -38.135 1   27.09  ? 932  ARG   A CB   1 1 
ATOM   3649 C  CG   . ARG   A 1 242 ? -6.292  13.433  -38.624 1   28.47  ? 932  ARG   A CG   1 1 
ATOM   3650 C  CD   . ARG   A 1 242 ? -6.347  12.39   -37.523 1   30.22  ? 932  ARG   A CD   1 1 
ATOM   3651 N  NE   . ARG   A 1 242 ? -6.028  11.05   -38.025 1   32.4   ? 932  ARG   A NE   1 1 
ATOM   3652 C  CZ   . ARG   A 1 242 ? -6.868  10.249  -38.684 1   33.85  ? 932  ARG   A CZ   1 1 
ATOM   3653 N  NH1  . ARG   A 1 242 ? -8.106  10.644  -38.958 1   32.18  ? 932  ARG   A NH1  1 1 
ATOM   3654 N  NH2  . ARG   A 1 242 ? -6.464  9.058   -39.102 1   34.59  ? 932  ARG   A NH2  1 1 
ATOM   3655 H  H    . ARG   A 1 242 ? -8.922  15.972  -39.441 0   27.77  ? 932  ARG   A H    1 1 
ATOM   3656 H  HA   . ARG   A 1 242 ? -8.276  14.576  -36.931 0   27.58  ? 932  ARG   A HA   1 1 
ATOM   3657 H  HB2  . ARG   A 1 242 ? -6.189  15.535  -38.94  0   27.1   ? 932  ARG   A HB2  1 1 
ATOM   3658 H  HB3  . ARG   A 1 242 ? -5.844  15.01   -37.276 0   26.91  ? 932  ARG   A HB3  1 1 
ATOM   3659 H  HG2  . ARG   A 1 242 ? -7.062  13.182  -39.351 0   28.82  ? 932  ARG   A HG2  1 1 
ATOM   3660 H  HG3  . ARG   A 1 242 ? -5.314  13.362  -39.096 0   28.22  ? 932  ARG   A HG3  1 1 
ATOM   3661 H  HD2  . ARG   A 1 242 ? -5.594  12.643  -36.777 0   29.66  ? 932  ARG   A HD2  1 1 
ATOM   3662 H  HD3  . ARG   A 1 242 ? -7.329  12.373  -37.053 0   30.32  ? 932  ARG   A HD3  1 1 
ATOM   3663 H  HE   . ARG   A 1 242 ? -5.091  10.708  -37.845 0   31.62  ? 932  ARG   A HE   1 1 
ATOM   3664 H  HH11 . ARG   A 1 242 ? -8.473  11.548  -38.676 0   32.15  ? 932  ARG   A HH11 1 1 
ATOM   3665 H  HH12 . ARG   A 1 242 ? -8.72   10.019  -39.467 0   32.64  ? 932  ARG   A HH12 1 1 
ATOM   3666 H  HH21 . ARG   A 1 242 ? -5.521  8.741   -38.906 0   33.53  ? 932  ARG   A HH21 1 1 
ATOM   3667 H  HH22 . ARG   A 1 242 ? -7.101  8.45    -39.607 0   34.39  ? 932  ARG   A HH22 1 1 
ATOM   3668 N  N    . LEU   A 1 243 ? -7.274  16.846  -35.956 1   26.51  ? 933  LEU   A N    1 1 
ATOM   3669 C  CA   . LEU   A 1 243 ? -7.217  18.146  -35.281 1   26.24  ? 933  LEU   A CA   1 1 
ATOM   3670 C  C    . LEU   A 1 243 ? -6.611  19.19   -36.219 1   26.6   ? 933  LEU   A C    1 1 
ATOM   3671 O  O    . LEU   A 1 243 ? -5.757  18.824  -37.031 1   27.33  ? 933  LEU   A O    1 1 
ATOM   3672 C  CB   . LEU   A 1 243 ? -6.427  18.068  -33.967 1   25.98  ? 933  LEU   A CB   1 1 
ATOM   3673 C  CG   . LEU   A 1 243 ? -7.061  17.265  -32.819 1   26.4   ? 933  LEU   A CG   1 1 
ATOM   3674 C  CD1  . LEU   A 1 243 ? -6.02   16.958  -31.737 1   26.45  ? 933  LEU   A CD1  1 1 
ATOM   3675 C  CD2  . LEU   A 1 243 ? -8.26   18.01   -32.199 1   26.36  ? 933  LEU   A CD2  1 1 
ATOM   3676 H  H    . LEU   A 1 243 ? -6.744  16.115  -35.491 0   26.53  ? 933  LEU   A H    1 1 
ATOM   3677 H  HA   . LEU   A 1 243 ? -8.249  18.42   -35.073 0   26.69  ? 933  LEU   A HA   1 1 
ATOM   3678 H  HB2  . LEU   A 1 243 ? -5.461  17.617  -34.189 0   25.74  ? 933  LEU   A HB2  1 1 
ATOM   3679 H  HB3  . LEU   A 1 243 ? -6.275  19.083  -33.603 0   25.82  ? 933  LEU   A HB3  1 1 
ATOM   3680 H  HG   . LEU   A 1 243 ? -7.424  16.316  -33.211 0   26.71  ? 933  LEU   A HG   1 1 
ATOM   3681 H  HD11 . LEU   A 1 243 ? -6.499  16.394  -30.937 0   26.47  ? 933  LEU   A HD11 1 1 
ATOM   3682 H  HD12 . LEU   A 1 243 ? -5.215  16.37   -32.175 0   26.18  ? 933  LEU   A HD12 1 1 
ATOM   3683 H  HD13 . LEU   A 1 243 ? -5.626  17.894  -31.345 0   26.11  ? 933  LEU   A HD13 1 1 
ATOM   3684 H  HD21 . LEU   A 1 243 ? -8.64   17.419  -31.367 0   26.8   ? 933  LEU   A HD21 1 1 
ATOM   3685 H  HD22 . LEU   A 1 243 ? -7.923  18.979  -31.833 0   26.38  ? 933  LEU   A HD22 1 1 
ATOM   3686 H  HD23 . LEU   A 1 243 ? -9.053  18.146  -32.932 0   26.97  ? 933  LEU   A HD23 1 1 
ATOM   3687 N  N    . PRO   A 1 244 ? -7.09   20.453  -36.217 1   26.29  ? 934  PRO   A N    1 1 
ATOM   3688 C  CA   . PRO   A 1 244 ? -6.611  21.411  -37.22  1   26.3   ? 934  PRO   A CA   1 1 
ATOM   3689 C  C    . PRO   A 1 244 ? -5.186  21.898  -37.025 1   26.27  ? 934  PRO   A C    1 1 
ATOM   3690 O  O    . PRO   A 1 244 ? -4.609  21.705  -35.958 1   26.02  ? 934  PRO   A O    1 1 
ATOM   3691 C  CB   . PRO   A 1 244 ? -7.615  22.56   -37.091 1   27.12  ? 934  PRO   A CB   1 1 
ATOM   3692 C  CG   . PRO   A 1 244 ? -8.019  22.526  -35.686 1   27.59  ? 934  PRO   A CG   1 1 
ATOM   3693 C  CD   . PRO   A 1 244 ? -8.116  21.073  -35.35  1   25.95  ? 934  PRO   A CD   1 1 
ATOM   3694 H  HA   . PRO   A 1 244 ? -6.71   20.987  -38.218 0   26.4   ? 934  PRO   A HA   1 1 
ATOM   3695 H  HB2  . PRO   A 1 244 ? -7.135  23.507  -37.335 0   26.98  ? 934  PRO   A HB2  1 1 
ATOM   3696 H  HB3  . PRO   A 1 244 ? -8.466  22.367  -37.742 0   27.54  ? 934  PRO   A HB3  1 1 
ATOM   3697 H  HG2  . PRO   A 1 244 ? -7.262  23.017  -35.076 0   27.23  ? 934  PRO   A HG2  1 1 
ATOM   3698 H  HG3  . PRO   A 1 244 ? -8.989  23.01   -35.576 0   27.95  ? 934  PRO   A HG3  1 1 
ATOM   3699 H  HD2  . PRO   A 1 244 ? -7.88   20.929  -34.296 0   26.06  ? 934  PRO   A HD2  1 1 
ATOM   3700 H  HD3  . PRO   A 1 244 ? -9.105  20.687  -35.594 0   26.66  ? 934  PRO   A HD3  1 1 
ATOM   3701 N  N    . GLN   A 1 245 ? -4.629  22.546  -38.056 1   26.59  ? 935  GLN   A N    1 1 
ATOM   3702 C  CA   . GLN   A 1 245 ? -3.283  23.107  -37.995 1   27.35  ? 935  GLN   A CA   1 1 
ATOM   3703 C  C    . GLN   A 1 245 ? -3.264  24.298  -37.047 1   28.6   ? 935  GLN   A C    1 1 
ATOM   3704 O  O    . GLN   A 1 245 ? -3.902  25.298  -37.373 1   28.47  ? 935  GLN   A O    1 1 
ATOM   3705 C  CB   . GLN   A 1 245 ? -2.816  23.555  -39.385 1   28.08  ? 935  GLN   A CB   1 1 
ATOM   3706 C  CG   . GLN   A 1 245 ? -1.326  23.933  -39.418 1   30.47  ? 935  GLN   A CG   1 1 
ATOM   3707 C  CD   . GLN   A 1 245 ? -0.809  24.188  -40.81  1   33.44  ? 935  GLN   A CD   1 1 
ATOM   3708 O  OE1  . GLN   A 1 245 ? -1.571  24.262  -41.787 1   34.64  ? 935  GLN   A OE1  1 1 
ATOM   3709 N  NE2  . GLN   A 1 245 ? 0.505   24.352  -40.936 1   32.51  ? 935  GLN   A NE2  1 1 
ATOM   3710 H  H    . GLN   A 1 245 ? -5.09   22.696  -38.947 0   26.54  ? 935  GLN   A H    1 1 
ATOM   3711 H  HA   . GLN   A 1 245 ? -2.601  22.325  -37.667 0   26.82  ? 935  GLN   A HA   1 1 
ATOM   3712 H  HB2  . GLN   A 1 245 ? -2.962  22.728  -40.078 0   27.67  ? 935  GLN   A HB2  1 1 
ATOM   3713 H  HB3  . GLN   A 1 245 ? -3.395  24.415  -39.717 0   27.63  ? 935  GLN   A HB3  1 1 
ATOM   3714 H  HG2  . GLN   A 1 245 ? -1.159  24.838  -38.835 0   29.47  ? 935  GLN   A HG2  1 1 
ATOM   3715 H  HG3  . GLN   A 1 245 ? -0.754  23.111  -38.993 0   29.53  ? 935  GLN   A HG3  1 1 
ATOM   3716 H  HE21 . GLN   A 1 245 ? 1.11    24.305  -40.123 0   31.44  ? 935  GLN   A HE21 1 1 
ATOM   3717 H  HE22 . GLN   A 1 245 ? 0.906   24.527  -41.852 0   31.57  ? 935  GLN   A HE22 1 1 
ATOM   3718 N  N    . PRO   A 1 246 ? -2.555  24.259  -35.888 1   29.82  ? 936  PRO   A N    1 1 
ATOM   3719 C  CA   . PRO   A 1 246 ? -2.529  25.457  -35.018 1   30.47  ? 936  PRO   A CA   1 1 
ATOM   3720 C  C    . PRO   A 1 246 ? -1.908  26.661  -35.751 1   31.22  ? 936  PRO   A C    1 1 
ATOM   3721 O  O    . PRO   A 1 246 ? -0.93   26.457  -36.465 1   31.49  ? 936  PRO   A O    1 1 
ATOM   3722 C  CB   . PRO   A 1 246 ? -1.66   25.019  -33.83  1   31.08  ? 936  PRO   A CB   1 1 
ATOM   3723 C  CG   . PRO   A 1 246 ? -1.67   23.53   -33.873 1   31.42  ? 936  PRO   A CG   1 1 
ATOM   3724 C  CD   . PRO   A 1 246 ? -1.735  23.171  -35.314 1   29.54  ? 936  PRO   A CD   1 1 
ATOM   3725 H  HA   . PRO   A 1 246 ? -3.536  25.66   -34.658 0   29.42  ? 936  PRO   A HA   1 1 
ATOM   3726 H  HB2  . PRO   A 1 246 ? -0.647  25.4    -33.955 0   29.64  ? 936  PRO   A HB2  1 1 
ATOM   3727 H  HB3  . PRO   A 1 246 ? -2.098  25.378  -32.9   0   29.54  ? 936  PRO   A HB3  1 1 
ATOM   3728 H  HG2  . PRO   A 1 246 ? -0.754  23.148  -33.427 0   30.13  ? 936  PRO   A HG2  1 1 
ATOM   3729 H  HG3  . PRO   A 1 246 ? -2.549  23.143  -33.36  0   30.17  ? 936  PRO   A HG3  1 1 
ATOM   3730 H  HD2  . PRO   A 1 246 ? -0.738  23.161  -35.751 0   28.65  ? 936  PRO   A HD2  1 1 
ATOM   3731 H  HD3  . PRO   A 1 246 ? -2.224  22.202  -35.407 0   28.68  ? 936  PRO   A HD3  1 1 
ATOM   3732 N  N    . PRO   A 1 247 ? -2.443  27.901  -35.644 1   31.27  ? 937  PRO   A N    1 1 
ATOM   3733 C  CA   . PRO   A 1 247 ? -1.86   29.024  -36.419 1   31.35  ? 937  PRO   A CA   1 1 
ATOM   3734 C  C    . PRO   A 1 247 ? -0.346  29.271  -36.314 1   31.12  ? 937  PRO   A C    1 1 
ATOM   3735 O  O    . PRO   A 1 247 ? 0.23    29.826  -37.243 1   31.05  ? 937  PRO   A O    1 1 
ATOM   3736 C  CB   . PRO   A 1 247 ? -2.624  30.24   -35.905 1   31.87  ? 937  PRO   A CB   1 1 
ATOM   3737 C  CG   . PRO   A 1 247 ? -3.879  29.713  -35.379 1   32.4   ? 937  PRO   A CG   1 1 
ATOM   3738 C  CD   . PRO   A 1 247 ? -3.625  28.338  -34.877 1   30.67  ? 937  PRO   A CD   1 1 
ATOM   3739 H  HA   . PRO   A 1 247 ? -2.108  28.907  -37.473 0   30.78  ? 937  PRO   A HA   1 1 
ATOM   3740 H  HB2  . PRO   A 1 247 ? -2.05   30.734  -35.121 0   32.61  ? 937  PRO   A HB2  1 1 
ATOM   3741 H  HB3  . PRO   A 1 247 ? -2.816  30.921  -36.733 0   32.79  ? 937  PRO   A HB3  1 1 
ATOM   3742 H  HG2  . PRO   A 1 247 ? -4.212  30.355  -34.565 0   33.02  ? 937  PRO   A HG2  1 1 
ATOM   3743 H  HG3  . PRO   A 1 247 ? -4.616  29.688  -36.18  0   32.63  ? 937  PRO   A HG3  1 1 
ATOM   3744 H  HD2  . PRO   A 1 247 ? -3.403  28.361  -33.811 0   29.88  ? 937  PRO   A HD2  1 1 
ATOM   3745 H  HD3  . PRO   A 1 247 ? -4.487  27.708  -35.094 0   29.63  ? 937  PRO   A HD3  1 1 
ATOM   3746 N  N    . ILE   A 1 248 ? 0.294   28.893  -35.201 1   30.87  ? 938  ILE   A N    1 1 
ATOM   3747 C  CA   . ILE   A 1 248 ? 1.742   29.103  -35.025 1   30.46  ? 938  ILE   A CA   1 1 
ATOM   3748 C  C    . ILE   A 1 248 ? 2.594   28.013  -35.708 1   30.8   ? 938  ILE   A C    1 1 
ATOM   3749 O  O    . ILE   A 1 248 ? 3.78    28.232  -35.948 1   30.37  ? 938  ILE   A O    1 1 
ATOM   3750 C  CB   . ILE   A 1 248 ? 2.15    29.27   -33.532 1   30.51  ? 938  ILE   A CB   1 1 
ATOM   3751 C  CG1  . ILE   A 1 248 ? 1.927   27.97   -32.7   1   31.43  ? 938  ILE   A CG1  1 1 
ATOM   3752 C  CG2  . ILE   A 1 248 ? 1.443   30.478  -32.9   1   30.86  ? 938  ILE   A CG2  1 1 
ATOM   3753 C  CD1  . ILE   A 1 248 ? 2.896   27.774  -31.524 1   32.67  ? 938  ILE   A CD1  1 1 
ATOM   3754 H  H    . ILE   A 1 248 ? -0.171  28.434  -34.425 0   30.11  ? 938  ILE   A H    1 1 
ATOM   3755 H  HA   . ILE   A 1 248 ? 2.012   30.044  -35.502 0   31.11  ? 938  ILE   A HA   1 1 
ATOM   3756 H  HB   . ILE   A 1 248 ? 3.216   29.492  -33.531 0   31.09  ? 938  ILE   A HB   1 1 
ATOM   3757 H  HG12 . ILE   A 1 248 ? 0.922   27.999  -32.282 0   30.54  ? 938  ILE   A HG12 1 1 
ATOM   3758 H  HG13 . ILE   A 1 248 ? 2.021   27.091  -33.336 0   30.2   ? 938  ILE   A HG13 1 1 
ATOM   3759 H  HG21 . ILE   A 1 248 ? 1.745   30.575  -31.858 0   31.93  ? 938  ILE   A HG21 1 1 
ATOM   3760 H  HG22 . ILE   A 1 248 ? 1.72    31.375  -33.452 0   32.51  ? 938  ILE   A HG22 1 1 
ATOM   3761 H  HG23 . ILE   A 1 248 ? 0.364   30.333  -32.948 0   31.47  ? 938  ILE   A HG23 1 1 
ATOM   3762 H  HD11 . ILE   A 1 248 ? 2.655   26.838  -31.024 0   31.48  ? 938  ILE   A HD11 1 1 
ATOM   3763 H  HD12 . ILE   A 1 248 ? 3.915   27.74   -31.906 0   32.34  ? 938  ILE   A HD12 1 1 
ATOM   3764 H  HD13 . ILE   A 1 248 ? 2.788   28.607  -30.83  0   32.62  ? 938  ILE   A HD13 1 1 
ATOM   3765 N  N    . CYS   A 1 249 ? 2.009   26.834  -35.977 1   31.08  ? 939  CYS   A N    1 1 
ATOM   3766 C  CA   . CYS   A 1 249 ? 2.726   25.712  -36.572 1   31.36  ? 939  CYS   A CA   1 1 
ATOM   3767 C  C    . CYS   A 1 249 ? 3.058   25.887  -38.028 1   31.3   ? 939  CYS   A C    1 1 
ATOM   3768 O  O    . CYS   A 1 249 ? 2.145   26.045  -38.838 1   30.72  ? 939  CYS   A O    1 1 
ATOM   3769 C  CB   . CYS   A 1 249 ? 1.947   24.415  -36.379 1   31.9   ? 939  CYS   A CB   1 1 
ATOM   3770 S  SG   . CYS   A 1 249 ? 1.897   23.821  -34.676 1   35.62  ? 939  CYS   A SG   1 1 
ATOM   3771 H  H    . CYS   A 1 249 ? 1.038   26.618  -35.778 0   29.41  ? 939  CYS   A H    1 1 
ATOM   3772 H  HA   . CYS   A 1 249 ? 3.668   25.604  -36.037 0   30.49  ? 939  CYS   A HA   1 1 
ATOM   3773 H  HB2  . CYS   A 1 249 ? 0.923   24.548  -36.726 0   30.64  ? 939  CYS   A HB2  1 1 
ATOM   3774 H  HB3  . CYS   A 1 249 ? 2.426   23.642  -36.978 0   30.94  ? 939  CYS   A HB3  1 1 
ATOM   3775 H  HG   . CYS   A 1 249 ? 3.145   23.736  -34.197 0   33.13  ? 939  CYS   A HG   1 1 
ATOM   3776 N  N    . THR   A 1 250 ? 4.342   25.704  -38.392 1   31.18  ? 940  THR   A N    1 1 
ATOM   3777 C  CA   . THR   A 1 250 ? 4.699   25.623  -39.806 1   31.74  ? 940  THR   A CA   1 1 
ATOM   3778 C  C    . THR   A 1 250 ? 4.312   24.172  -40.233 1   32.32  ? 940  THR   A C    1 1 
ATOM   3779 O  O    . THR   A 1 250 ? 3.965   23.335  -39.385 1   32.2   ? 940  THR   A O    1 1 
ATOM   3780 C  CB   . THR   A 1 250 ? 6.172   25.955  -40.07  1   32.46  ? 940  THR   A CB   1 1 
ATOM   3781 O  OG1  . THR   A 1 250 ? 7       24.994  -39.414 1   32.74  ? 940  THR   A OG1  1 1 
ATOM   3782 C  CG2  . THR   A 1 250 ? 6.534   27.393  -39.688 1   33.06  ? 940  THR   A CG2  1 1 
ATOM   3783 H  H    . THR   A 1 250 ? 5.124   25.597  -37.754 0   30.7   ? 940  THR   A H    1 1 
ATOM   3784 H  HA   . THR   A 1 250 ? 4.101   26.325  -40.386 0   30.92  ? 940  THR   A HA   1 1 
ATOM   3785 H  HB   . THR   A 1 250 ? 6.346   25.865  -41.141 0   32.33  ? 940  THR   A HB   1 1 
ATOM   3786 H  HG1  . THR   A 1 250 ? 7.058   25.203  -38.445 0   32.44  ? 940  THR   A HG1  1 1 
ATOM   3787 H  HG21 . THR   A 1 250 ? 7.586   27.581  -39.9   0   34.4   ? 940  THR   A HG21 1 1 
ATOM   3788 H  HG22 . THR   A 1 250 ? 5.931   28.097  -40.259 0   33.92  ? 940  THR   A HG22 1 1 
ATOM   3789 H  HG23 . THR   A 1 250 ? 6.359   27.559  -38.626 0   33.67  ? 940  THR   A HG23 1 1 
ATOM   3790 N  N    . ILE   A 1 251 ? 4.334   23.888  -41.537 1   32.5   ? 941  ILE   A N    1 1 
ATOM   3791 C  CA   . ILE   A 1 251 ? 3.906   22.588  -42.038 1   32.51  ? 941  ILE   A CA   1 1 
ATOM   3792 C  C    . ILE   A 1 251 ? 4.697   21.393  -41.448 1   32.37  ? 941  ILE   A C    1 1 
ATOM   3793 O  O    . ILE   A 1 251 ? 4.107   20.326  -41.261 1   32.52  ? 941  ILE   A O    1 1 
ATOM   3794 C  CB   . ILE   A 1 251 ? 3.887   22.558  -43.597 1   33.02  ? 941  ILE   A CB   1 1 
ATOM   3795 C  CG1  . ILE   A 1 251 ? 3.16    21.311  -44.143 1   33.9   ? 941  ILE   A CG1  1 1 
ATOM   3796 C  CG2  . ILE   A 1 251 ? 5.289   22.635  -44.207 1   33.25  ? 941  ILE   A CG2  1 1 
ATOM   3797 C  CD1  . ILE   A 1 251 ? 1.744   21.147  -43.813 1   34.68  ? 941  ILE   A CD1  1 1 
ATOM   3798 H  H    . ILE   A 1 251 ? 4.609   24.553  -42.253 0   31.87  ? 941  ILE   A H    1 1 
ATOM   3799 H  HA   . ILE   A 1 251 ? 2.886   22.495  -41.671 0   31.42  ? 941  ILE   A HA   1 1 
ATOM   3800 H  HB   . ILE   A 1 251 ? 3.336   23.434  -43.934 0   32.13  ? 941  ILE   A HB   1 1 
ATOM   3801 H  HG12 . ILE   A 1 251 ? 3.202   21.368  -45.229 0   33.1   ? 941  ILE   A HG12 1 1 
ATOM   3802 H  HG13 . ILE   A 1 251 ? 3.692   20.417  -43.828 0   33.05  ? 941  ILE   A HG13 1 1 
ATOM   3803 H  HG21 . ILE   A 1 251 ? 5.2     22.641  -45.293 0   32.79  ? 941  ILE   A HG21 1 1 
ATOM   3804 H  HG22 . ILE   A 1 251 ? 5.77    23.554  -43.875 0   32.88  ? 941  ILE   A HG22 1 1 
ATOM   3805 H  HG23 . ILE   A 1 251 ? 5.879   21.773  -43.9   0   32.87  ? 941  ILE   A HG23 1 1 
ATOM   3806 H  HD11 . ILE   A 1 251 ? 1.397   20.236  -44.296 0   33.5   ? 941  ILE   A HD11 1 1 
ATOM   3807 H  HD12 . ILE   A 1 251 ? 1.572   21.035  -42.745 0   33.33  ? 941  ILE   A HD12 1 1 
ATOM   3808 H  HD13 . ILE   A 1 251 ? 1.191   22.004  -44.196 0   33.41  ? 941  ILE   A HD13 1 1 
ATOM   3809 N  N    . ASP   A 1 252 ? 5.999   21.564  -41.139 1   31.41  ? 942  ASP   A N    1 1 
ATOM   3810 C  CA   . ASP   A 1 252 ? 6.82    20.479  -40.609 1   31.22  ? 942  ASP   A CA   1 1 
ATOM   3811 C  C    . ASP   A 1 252 ? 6.372   20.06   -39.208 1   30.1   ? 942  ASP   A C    1 1 
ATOM   3812 O  O    . ASP   A 1 252 ? 6.43    18.873  -38.886 1   30.37  ? 942  ASP   A O    1 1 
ATOM   3813 C  CB   . ASP   A 1 252 ? 8.31    20.875  -40.59  1   34.32  ? 942  ASP   A CB   1 1 
ATOM   3814 C  CG   . ASP   A 1 252 ? 8.887   21.227  -41.948 1   41.83  ? 942  ASP   A CG   1 1 
ATOM   3815 O  OD1  . ASP   A 1 252 ? 8.293   22.077  -42.645 1   43.32  ? 942  ASP   A OD1  1 1 
ATOM   3816 O  OD2  . ASP   A 1 252 ? 9.948   20.676  -42.301 1   45.4   ? 942  ASP   A OD2  1 1 
ATOM   3817 H  H    . ASP   A 1 252 ? 6.497   22.444  -41.23  0   31.33  ? 942  ASP   A H    1 1 
ATOM   3818 H  HA   . ASP   A 1 252 ? 6.72    19.612  -41.262 0   31.05  ? 942  ASP   A HA   1 1 
ATOM   3819 H  HB2  . ASP   A 1 252 ? 8.428   21.744  -39.944 0   34.1   ? 942  ASP   A HB2  1 1 
ATOM   3820 H  HB3  . ASP   A 1 252 ? 8.886   20.042  -40.19  0   34.26  ? 942  ASP   A HB3  1 1 
ATOM   3821 N  N    . VAL   A 1 253 ? 5.938   21.016  -38.375 1   28.75  ? 943  VAL   A N    1 1 
ATOM   3822 C  CA   . VAL   A 1 253 ? 5.482   20.698  -37.016 1   28.49  ? 943  VAL   A CA   1 1 
ATOM   3823 C  C    . VAL   A 1 253 ? 4.127   19.977  -37.084 1   28.23  ? 943  VAL   A C    1 1 
ATOM   3824 O  O    . VAL   A 1 253 ? 3.914   19.007  -36.358 1   28.78  ? 943  VAL   A O    1 1 
ATOM   3825 C  CB   . VAL   A 1 253 ? 5.425   21.944  -36.085 1   29.1   ? 943  VAL   A CB   1 1 
ATOM   3826 C  CG1  . VAL   A 1 253 ? 4.885   21.58   -34.701 1   29.46  ? 943  VAL   A CG1  1 1 
ATOM   3827 C  CG2  . VAL   A 1 253 ? 6.804   22.59   -35.947 1   29.69  ? 943  VAL   A CG2  1 1 
ATOM   3828 H  H    . VAL   A 1 253 ? 5.875   22      -38.616 0   28.74  ? 943  VAL   A H    1 1 
ATOM   3829 H  HA   . VAL   A 1 253 ? 6.201   20.016  -36.57  0   28.55  ? 943  VAL   A HA   1 1 
ATOM   3830 H  HB   . VAL   A 1 253 ? 4.754   22.682  -36.523 0   28.64  ? 943  VAL   A HB   1 1 
ATOM   3831 H  HG11 . VAL   A 1 253 ? 4.909   22.472  -34.077 0   28.94  ? 943  VAL   A HG11 1 1 
ATOM   3832 H  HG12 . VAL   A 1 253 ? 3.86    21.22   -34.769 0   28.66  ? 943  VAL   A HG12 1 1 
ATOM   3833 H  HG13 . VAL   A 1 253 ? 5.524   20.812  -34.267 0   29.13  ? 943  VAL   A HG13 1 1 
ATOM   3834 H  HG21 . VAL   A 1 253 ? 6.721   23.449  -35.283 0   29.61  ? 943  VAL   A HG21 1 1 
ATOM   3835 H  HG22 . VAL   A 1 253 ? 7.493   21.86   -35.524 0   29.87  ? 943  VAL   A HG22 1 1 
ATOM   3836 H  HG23 . VAL   A 1 253 ? 7.156   22.912  -36.925 0   29.88  ? 943  VAL   A HG23 1 1 
ATOM   3837 N  N    . TYR   A 1 254 ? 3.225   20.434  -37.962 1   27.11  ? 944  TYR   A N    1 1 
ATOM   3838 C  CA   . TYR   A 1 254 ? 1.918   19.808  -38.098 1   27.07  ? 944  TYR   A CA   1 1 
ATOM   3839 C  C    . TYR   A 1 254 ? 2       18.417  -38.71  1   27.18  ? 944  TYR   A C    1 1 
ATOM   3840 O  O    . TYR   A 1 254 ? 1.273   17.525  -38.275 1   26.71  ? 944  TYR   A O    1 1 
ATOM   3841 C  CB   . TYR   A 1 254 ? 0.974   20.706  -38.883 1   26.47  ? 944  TYR   A CB   1 1 
ATOM   3842 C  CG   . TYR   A 1 254 ? -0.447  20.188  -38.927 1   26.46  ? 944  TYR   A CG   1 1 
ATOM   3843 C  CD1  . TYR   A 1 254 ? -1.188  20.025  -37.763 1   27.01  ? 944  TYR   A CD1  1 1 
ATOM   3844 C  CD2  . TYR   A 1 254 ? -1.074  19.938  -40.133 1   26.89  ? 944  TYR   A CD2  1 1 
ATOM   3845 C  CE1  . TYR   A 1 254 ? -2.508  19.589  -37.804 1   27.69  ? 944  TYR   A CE1  1 1 
ATOM   3846 C  CE2  . TYR   A 1 254 ? -2.407  19.549  -40.188 1   27.57  ? 944  TYR   A CE2  1 1 
ATOM   3847 C  CZ   . TYR   A 1 254 ? -3.12   19.375  -39.022 1   28.24  ? 944  TYR   A CZ   1 1 
ATOM   3848 O  OH   . TYR   A 1 254 ? -4.416  18.919  -39.076 1   29.52  ? 944  TYR   A OH   1 1 
ATOM   3849 H  H    . TYR   A 1 254 ? 3.351   21.24   -38.565 0   26.97  ? 944  TYR   A H    1 1 
ATOM   3850 H  HA   . TYR   A 1 254 ? 1.494   19.698  -37.103 0   26.6   ? 944  TYR   A HA   1 1 
ATOM   3851 H  HB2  . TYR   A 1 254 ? 0.963   21.686  -38.409 0   26.13  ? 944  TYR   A HB2  1 1 
ATOM   3852 H  HB3  . TYR   A 1 254 ? 1.346   20.793  -39.902 0   26.34  ? 944  TYR   A HB3  1 1 
ATOM   3853 H  HD1  . TYR   A 1 254 ? -0.737  20.22   -36.805 0   26.49  ? 944  TYR   A HD1  1 1 
ATOM   3854 H  HD2  . TYR   A 1 254 ? -0.522  20.093  -41.039 0   26.69  ? 944  TYR   A HD2  1 1 
ATOM   3855 H  HE1  . TYR   A 1 254 ? -3.062  19.46   -36.89  0   27.2   ? 944  TYR   A HE1  1 1 
ATOM   3856 H  HE2  . TYR   A 1 254 ? -2.867  19.335  -41.137 0   27.38  ? 944  TYR   A HE2  1 1 
ATOM   3857 H  HH   . TYR   A 1 254 ? -4.969  19.386  -38.396 0   29.01  ? 944  TYR   A HH   1 1 
ATOM   3858 N  N    . MET   A 1 255 ? 2.931   18.198  -39.65  1   27.44  ? 945  MET   A N    1 1 
ATOM   3859 C  CA   . MET   A 1 255 ? 3.113   16.859  -40.222 1   27.96  ? 945  MET   A CA   1 1 
ATOM   3860 C  C    . MET   A 1 255 ? 3.586   15.844  -39.167 1   27.79  ? 945  MET   A C    1 1 
ATOM   3861 O  O    . MET   A 1 255 ? 3.263   14.666  -39.292 1   27.94  ? 945  MET   A O    1 1 
ATOM   3862 C  CB   . MET   A 1 255 ? 4.062   16.881  -41.431 1   29.27  ? 945  MET   A CB   1 1 
ATOM   3863 C  CG   . MET   A 1 255 ? 3.464   17.548  -42.672 1   31.87  ? 945  MET   A CG   1 1 
ATOM   3864 S  SD   . MET   A 1 255 ? 1.788   17.04   -43.179 1   39.4   ? 945  MET   A SD   1 1 
ATOM   3865 C  CE   . MET   A 1 255 ? 2.032   15.324  -43.372 1   36.41  ? 945  MET   A CE   1 1 
ATOM   3866 H  H    . MET   A 1 255 ? 3.552   18.906  -40.029 0   27.35  ? 945  MET   A H    1 1 
ATOM   3867 H  HA   . MET   A 1 255 ? 2.14    16.509  -40.559 0   27.59  ? 945  MET   A HA   1 1 
ATOM   3868 H  HB2  . MET   A 1 255 ? 4.96    17.436  -41.16  0   29.19  ? 945  MET   A HB2  1 1 
ATOM   3869 H  HB3  . MET   A 1 255 ? 4.344   15.859  -41.677 0   29.11  ? 945  MET   A HB3  1 1 
ATOM   3870 H  HG2  . MET   A 1 255 ? 3.426   18.616  -42.464 0   31.12  ? 945  MET   A HG2  1 1 
ATOM   3871 H  HG3  . MET   A 1 255 ? 4.132   17.363  -43.511 0   31.43  ? 945  MET   A HG3  1 1 
ATOM   3872 H  HE1  . MET   A 1 255 ? 1.16    14.872  -43.842 0   34.92  ? 945  MET   A HE1  1 1 
ATOM   3873 H  HE2  . MET   A 1 255 ? 2.92    15.212  -43.99  0   35.17  ? 945  MET   A HE2  1 1 
ATOM   3874 H  HE3  . MET   A 1 255 ? 2.211   14.868  -42.399 0   34.91  ? 945  MET   A HE3  1 1 
ATOM   3875 N  N    . ILE   A 1 256 ? 4.254   16.296  -38.094 1   27.29  ? 946  ILE   A N    1 1 
ATOM   3876 C  CA   . ILE   A 1 256 ? 4.67    15.401  -37.015 1   27.38  ? 946  ILE   A CA   1 1 
ATOM   3877 C  C    . ILE   A 1 256 ? 3.408   14.948  -36.291 1   26.37  ? 946  ILE   A C    1 1 
ATOM   3878 O  O    . ILE   A 1 256 ? 3.24    13.752  -36.062 1   26.27  ? 946  ILE   A O    1 1 
ATOM   3879 C  CB   . ILE   A 1 256 ? 5.648   16.064  -36.011 1   28.55  ? 946  ILE   A CB   1 1 
ATOM   3880 C  CG1  . ILE   A 1 256 ? 6.996   16.449  -36.67  1   29.81  ? 946  ILE   A CG1  1 1 
ATOM   3881 C  CG2  . ILE   A 1 256 ? 5.904   15.096  -34.855 1   29.63  ? 946  ILE   A CG2  1 1 
ATOM   3882 C  CD1  . ILE   A 1 256 ? 7.837   17.457  -35.797 1   31.1   ? 946  ILE   A CD1  1 1 
ATOM   3883 H  H    . ILE   A 1 256 ? 4.508   17.266  -37.936 0   27.18  ? 946  ILE   A H    1 1 
ATOM   3884 H  HA   . ILE   A 1 256 ? 5.158   14.523  -37.436 0   27.47  ? 946  ILE   A HA   1 1 
ATOM   3885 H  HB   . ILE   A 1 256 ? 5.186   16.967  -35.614 0   28.15  ? 946  ILE   A HB   1 1 
ATOM   3886 H  HG12 . ILE   A 1 256 ? 7.591   15.548  -36.813 0   29.93  ? 946  ILE   A HG12 1 1 
ATOM   3887 H  HG13 . ILE   A 1 256 ? 6.811   16.927  -37.631 0   29.68  ? 946  ILE   A HG13 1 1 
ATOM   3888 H  HG21 . ILE   A 1 256 ? 6.589   15.538  -34.135 0   29.43  ? 946  ILE   A HG21 1 1 
ATOM   3889 H  HG22 . ILE   A 1 256 ? 4.975   14.864  -34.336 0   28.95  ? 946  ILE   A HG22 1 1 
ATOM   3890 H  HG23 . ILE   A 1 256 ? 6.336   14.179  -35.252 0   29.47  ? 946  ILE   A HG23 1 1 
ATOM   3891 H  HD11 . ILE   A 1 256 ? 8.675   17.815  -36.393 0   31.39  ? 946  ILE   A HD11 1 1 
ATOM   3892 H  HD12 . ILE   A 1 256 ? 7.211   18.299  -35.51  0   30.67  ? 946  ILE   A HD12 1 1 
ATOM   3893 H  HD13 . ILE   A 1 256 ? 8.223   16.975  -34.901 0   30.91  ? 946  ILE   A HD13 1 1 
ATOM   3894 N  N    . MET   A 1 257 ? 2.514   15.906  -35.924 1   25.4   ? 947  MET   A N    1 1 
ATOM   3895 C  CA   . MET   A 1 257 ? 1.262   15.578  -35.247 1   25.03  ? 947  MET   A CA   1 1 
ATOM   3896 C  C    . MET   A 1 257 ? 0.432   14.634  -36.122 1   23.54  ? 947  MET   A C    1 1 
ATOM   3897 O  O    . MET   A 1 257 ? -0.1    13.653  -35.601 1   23.93  ? 947  MET   A O    1 1 
ATOM   3898 C  CB   . MET   A 1 257 ? 0.421   16.834  -34.949 1   26.58  ? 947  MET   A CB   1 1 
ATOM   3899 C  CG   . MET   A 1 257 ? 0.981   17.736  -33.87  1   30.19  ? 947  MET   A CG   1 1 
ATOM   3900 S  SD   . MET   A 1 257 ? -0.028  19.254  -33.748 1   35.66  ? 947  MET   A SD   1 1 
ATOM   3901 C  CE   . MET   A 1 257 ? 1.201   20.468  -34.008 1   33.69  ? 947  MET   A CE   1 1 
ATOM   3902 H  H    . MET   A 1 257 ? 2.64    16.897  -36.103 0   25.31  ? 947  MET   A H    1 1 
ATOM   3903 H  HA   . MET   A 1 257 ? 1.487   15.084  -34.302 0   24.87  ? 947  MET   A HA   1 1 
ATOM   3904 H  HB2  . MET   A 1 257 ? 0.333   17.422  -35.861 0   26.21  ? 947  MET   A HB2  1 1 
ATOM   3905 H  HB3  . MET   A 1 257 ? -0.568  16.515  -34.626 0   26.14  ? 947  MET   A HB3  1 1 
ATOM   3906 H  HG2  . MET   A 1 257 ? 0.951   17.218  -32.913 0   29.16  ? 947  MET   A HG2  1 1 
ATOM   3907 H  HG3  . MET   A 1 257 ? 2.006   18.004  -34.124 0   29.33  ? 947  MET   A HG3  1 1 
ATOM   3908 H  HE1  . MET   A 1 257 ? 0.742   21.454  -33.961 0   31.93  ? 947  MET   A HE1  1 1 
ATOM   3909 H  HE2  . MET   A 1 257 ? 1.982   20.389  -33.256 0   32.08  ? 947  MET   A HE2  1 1 
ATOM   3910 H  HE3  . MET   A 1 257 ? 1.655   20.32   -34.984 0   32.17  ? 947  MET   A HE3  1 1 
ATOM   3911 N  N    A ARG   A 1 258 ? 0.358   14.896  -37.441 0.5 22.36  ? 948  ARG   A N    1 1 
ATOM   3912 N  N    B ARG   A 1 258 ? 0.35    14.906  -37.44  0.5 23.02  ? 948  ARG   A N    1 1 
ATOM   3913 C  CA   A ARG   A 1 258 ? -0.432  14.07   -38.352 0.5 22.01  ? 948  ARG   A CA   1 1 
ATOM   3914 C  CA   B ARG   A 1 258 ? -0.425  14.053  -38.335 0.5 23.31  ? 948  ARG   A CA   1 1 
ATOM   3915 C  C    A ARG   A 1 258 ? 0.162   12.675  -38.559 0.5 22.76  ? 948  ARG   A C    1 1 
ATOM   3916 C  C    B ARG   A 1 258 ? 0.164   12.658  -38.474 0.5 23.38  ? 948  ARG   A C    1 1 
ATOM   3917 O  O    A ARG   A 1 258 ? -0.6    11.733  -38.783 0.5 22.51  ? 948  ARG   A O    1 1 
ATOM   3918 O  O    B ARG   A 1 258 ? -0.6    11.701  -38.59  0.5 23.18  ? 948  ARG   A O    1 1 
ATOM   3919 C  CB   A ARG   A 1 258 ? -0.68   14.795  -39.693 0.5 21.41  ? 948  ARG   A CB   1 1 
ATOM   3920 C  CB   B ARG   A 1 258 ? -0.618  14.68   -39.734 0.5 24.48  ? 948  ARG   A CB   1 1 
ATOM   3921 C  CG   A ARG   A 1 258 ? -1.511  16.099  -39.593 0.5 21.1   ? 948  ARG   A CG   1 1 
ATOM   3922 C  CG   B ARG   A 1 258 ? -1.829  15.608  -39.876 0.5 27.58  ? 948  ARG   A CG   1 1 
ATOM   3923 C  CD   A ARG   A 1 258 ? -2.985  15.919  -39.218 0.5 20.53  ? 948  ARG   A CD   1 1 
ATOM   3924 C  CD   B ARG   A 1 258 ? -3.195  14.915  -39.798 0.5 30.18  ? 948  ARG   A CD   1 1 
ATOM   3925 N  NE   A ARG   A 1 258 ? -3.701  15.081  -40.186 0.5 20.04  ? 948  ARG   A NE   1 1 
ATOM   3926 N  NE   B ARG   A 1 258 ? -3.378  13.817  -40.768 0.5 32.28  ? 948  ARG   A NE   1 1 
ATOM   3927 C  CZ   A ARG   A 1 258 ? -4.529  15.488  -41.151 0.5 19.49  ? 948  ARG   A CZ   1 1 
ATOM   3928 C  CZ   B ARG   A 1 258 ? -3.337  12.499  -40.537 0.5 33.04  ? 948  ARG   A CZ   1 1 
ATOM   3929 N  NH1  A ARG   A 1 258 ? -4.806  16.781  -41.309 0.5 18.63  ? 948  ARG   A NH1  1 1 
ATOM   3930 N  NH1  B ARG   A 1 258 ? -3.541  11.639  -41.527 0.5 32.36  ? 948  ARG   A NH1  1 1 
ATOM   3931 N  NH2  A ARG   A 1 258 ? -5.088  14.604  -41.965 0.5 17.7   ? 948  ARG   A NH2  1 1 
ATOM   3932 N  NH2  B ARG   A 1 258 ? -3.102  12.032  -39.315 0.5 31.72  ? 948  ARG   A NH2  1 1 
ATOM   3933 H  H    A ARG   A 1 258 ? 0.841   15.664  -37.897 0   22.8   ? 948  ARG   A H    1 1 
ATOM   3934 H  H    B ARG   A 1 258 ? 0.791   15.701  -37.892 0   23.27  ? 948  ARG   A H    1 1 
ATOM   3935 H  HA   A ARG   A 1 258 ? -1.396  13.901  -37.874 0   22.64  ? 948  ARG   A HA   1 1 
ATOM   3936 H  HA   B ARG   A 1 258 ? -1.392  13.933  -37.851 0   23.58  ? 948  ARG   A HA   1 1 
ATOM   3937 H  HB2  A ARG   A 1 258 ? 0.284   15.06   -40.125 0   22.44  ? 948  ARG   A HB2  1 1 
ATOM   3938 H  HB2  B ARG   A 1 258 ? 0.265   15.261  -39.994 0   24.63  ? 948  ARG   A HB2  1 1 
ATOM   3939 H  HB3  A ARG   A 1 258 ? -1.197  14.111  -40.364 0   22.54  ? 948  ARG   A HB3  1 1 
ATOM   3940 H  HB3  B ARG   A 1 258 ? -0.728  13.871  -40.454 0   24.76  ? 948  ARG   A HB3  1 1 
ATOM   3941 H  HG2  A ARG   A 1 258 ? -1.059  16.751  -38.847 0   22.48  ? 948  ARG   A HG2  1 1 
ATOM   3942 H  HG2  B ARG   A 1 258 ? -1.791  16.353  -39.082 0   27.17  ? 948  ARG   A HG2  1 1 
ATOM   3943 H  HG3  A ARG   A 1 258 ? -1.488  16.59   -40.564 0   22.67  ? 948  ARG   A HG3  1 1 
ATOM   3944 H  HG3  B ARG   A 1 258 ? -1.771  16.105  -40.843 0   27.35  ? 948  ARG   A HG3  1 1 
ATOM   3945 H  HD2  A ARG   A 1 258 ? -3.053  15.417  -38.257 0   22.61  ? 948  ARG   A HD2  1 1 
ATOM   3946 H  HD2  B ARG   A 1 258 ? -3.413  14.618  -38.774 0   29.58  ? 948  ARG   A HD2  1 1 
ATOM   3947 H  HD3  A ARG   A 1 258 ? -3.442  16.899  -39.095 0   22.64  ? 948  ARG   A HD3  1 1 
ATOM   3948 H  HD3  B ARG   A 1 258 ? -3.928  15.668  -40.084 0   29.7   ? 948  ARG   A HD3  1 1 
ATOM   3949 H  HE   A ARG   A 1 258 ? -3.54   14.082  -40.118 0   22.79  ? 948  ARG   A HE   1 1 
ATOM   3950 H  HE   B ARG   A 1 258 ? -3.622  14.093  -41.711 0   31.63  ? 948  ARG   A HE   1 1 
ATOM   3951 H  HH11 A ARG   A 1 258 ? -4.412  17.531  -40.753 0   21.66  ? 948  ARG   A HH11 1 1 
ATOM   3952 H  HH11 B ARG   A 1 258 ? -3.745  11.976  -42.463 0   31.83  ? 948  ARG   A HH11 1 1 
ATOM   3953 H  HH12 A ARG   A 1 258 ? -5.445  17.048  -42.051 0   22.07  ? 948  ARG   A HH12 1 1 
ATOM   3954 H  HH12 B ARG   A 1 258 ? -3.502  10.64   -41.355 0   31.81  ? 948  ARG   A HH12 1 1 
ATOM   3955 H  HH21 A ARG   A 1 258 ? -4.899  13.614  -41.85  0   21.35  ? 948  ARG   A HH21 1 1 
ATOM   3956 H  HH21 B ARG   A 1 258 ? -2.917  12.627  -38.517 0   30.89  ? 948  ARG   A HH21 1 1 
ATOM   3957 H  HH22 A ARG   A 1 258 ? -5.729  14.911  -42.689 0   21.53  ? 948  ARG   A HH22 1 1 
ATOM   3958 H  HH22 B ARG   A 1 258 ? -3.049  11.028  -39.175 0   31.12  ? 948  ARG   A HH22 1 1 
ATOM   3959 N  N    . LYS   A 1 259 ? 1.495   12.521  -38.456 1   23.24  ? 949  LYS   A N    1 1 
ATOM   3960 C  CA   . LYS   A 1 259 ? 2.121   11.198  -38.54  1   24.33  ? 949  LYS   A CA   1 1 
ATOM   3961 C  C    . LYS   A 1 259 ? 1.802   10.421  -37.231 1   24.78  ? 949  LYS   A C    1 1 
ATOM   3962 O  O    . LYS   A 1 259 ? 1.594   9.214   -37.296 1   25.48  ? 949  LYS   A O    1 1 
ATOM   3963 C  CB   . LYS   A 1 259 ? 3.637   11.282  -38.837 1   27.15  ? 949  LYS   A CB   1 1 
ATOM   3964 C  CG   . LYS   A 1 259 ? 3.92    11.6    -40.308 1   32.85  ? 949  LYS   A CG   1 1 
ATOM   3965 C  CD   . LYS   A 1 259 ? 5.364   11.935  -40.621 1   37.85  ? 949  LYS   A CD   1 1 
ATOM   3966 C  CE   . LYS   A 1 259 ? 5.483   12.324  -42.081 1   42.62  ? 949  LYS   A CE   1 1 
ATOM   3967 N  NZ   . LYS   A 1 259 ? 6.89    12.552  -42.528 1   46.33  ? 949  LYS   A NZ   1 1 
ATOM   3968 H  H    A LYS   A 1 259 ? 2.158   13.28   -38.338 0   23.61  ? 949  LYS   A H    1 1 
ATOM   3969 H  H    B LYS   A 1 259 ? 2.156   13.289  -38.404 0   23.61  ? 949  LYS   A H    1 1 
ATOM   3970 H  HA   . LYS   A 1 259 ? 1.664   10.641  -39.356 0   24.66  ? 949  LYS   A HA   1 1 
ATOM   3971 H  HB2  . LYS   A 1 259 ? 4.108   12.046  -38.219 0   27.09  ? 949  LYS   A HB2  1 1 
ATOM   3972 H  HB3  . LYS   A 1 259 ? 4.09    10.314  -38.63  0   27.24  ? 949  LYS   A HB3  1 1 
ATOM   3973 H  HG2  . LYS   A 1 259 ? 3.646   10.733  -40.907 0   32.14  ? 949  LYS   A HG2  1 1 
ATOM   3974 H  HG3  . LYS   A 1 259 ? 3.311   12.452  -40.608 0   31.93  ? 949  LYS   A HG3  1 1 
ATOM   3975 H  HD2  . LYS   A 1 259 ? 5.69    12.775  -40.008 0   36.08  ? 949  LYS   A HD2  1 1 
ATOM   3976 H  HD3  . LYS   A 1 259 ? 5.988   11.062  -40.439 0   36.19  ? 949  LYS   A HD3  1 1 
ATOM   3977 H  HE2  . LYS   A 1 259 ? 5.061   11.53   -42.696 0   40.62  ? 949  LYS   A HE2  1 1 
ATOM   3978 H  HE3  . LYS   A 1 259 ? 4.935   13.251  -42.242 0   40.1   ? 949  LYS   A HE3  1 1 
ATOM   3979 H  HZ1  . LYS   A 1 259 ? 6.996   12.25   -43.491 0   44.97  ? 949  LYS   A HZ1  1 1 
ATOM   3980 H  HZ2  . LYS   A 1 259 ? 7.109   13.542  -42.477 0   44.58  ? 949  LYS   A HZ2  1 1 
ATOM   3981 H  HZ3  . LYS   A 1 259 ? 7.55    12.042  -41.95  0   45     ? 949  LYS   A HZ3  1 1 
ATOM   3982 N  N    . CYS   A 1 260 ? 1.69    11.113  -36.07  1   24.33  ? 950  CYS   A N    1 1 
ATOM   3983 C  CA   . CYS   A 1 260 ? 1.301   10.491  -34.799 1   24.76  ? 950  CYS   A CA   1 1 
ATOM   3984 C  C    . CYS   A 1 260 ? -0.129  9.94    -34.843 1   24.99  ? 950  CYS   A C    1 1 
ATOM   3985 O  O    . CYS   A 1 260 ? -0.444  9.065   -34.044 1   25.16  ? 950  CYS   A O    1 1 
ATOM   3986 C  CB   . CYS   A 1 260 ? 1.439   11.484  -33.649 1   25.42  ? 950  CYS   A CB   1 1 
ATOM   3987 S  SG   . CYS   A 1 260 ? 3.123   12.084  -33.369 1   25.24  ? 950  CYS   A SG   1 1 
ATOM   3988 H  H    . CYS   A 1 260 ? 1.888   12.103  -35.973 0   24.39  ? 950  CYS   A H    1 1 
ATOM   3989 H  HA   . CYS   A 1 260 ? 1.964   9.652   -34.595 0   24.86  ? 950  CYS   A HA   1 1 
ATOM   3990 H  HB2  . CYS   A 1 260 ? 0.806   12.346  -33.856 0   25.21  ? 950  CYS   A HB2  1 1 
ATOM   3991 H  HB3  . CYS   A 1 260 ? 1.107   11.005  -32.729 0   25.22  ? 950  CYS   A HB3  1 1 
ATOM   3992 H  HG   . CYS   A 1 260 ? 3.146   12.773  -32.221 0   25.14  ? 950  CYS   A HG   1 1 
ATOM   3993 N  N    . TRP   A 1 261 ? -1.014  10.522  -35.675 1   24.66  ? 951  TRP   A N    1 1 
ATOM   3994 C  CA   . TRP   A 1 261 ? -2.402  10.096  -35.773 1   25.68  ? 951  TRP   A CA   1 1 
ATOM   3995 C  C    . TRP   A 1 261 ? -2.667  9.289   -37.05  1   28.25  ? 951  TRP   A C    1 1 
ATOM   3996 O  O    . TRP   A 1 261 ? -3.737  9.423   -37.635 1   29.31  ? 951  TRP   A O    1 1 
ATOM   3997 C  CB   . TRP   A 1 261 ? -3.361  11.3    -35.671 1   24.03  ? 951  TRP   A CB   1 1 
ATOM   3998 C  CG   . TRP   A 1 261 ? -3.047  12.259  -34.559 1   22.97  ? 951  TRP   A CG   1 1 
ATOM   3999 C  CD1  . TRP   A 1 261 ? -2.763  11.956  -33.26  1   23.31  ? 951  TRP   A CD1  1 1 
ATOM   4000 C  CD2  . TRP   A 1 261 ? -3.09   13.689  -34.637 1   22.33  ? 951  TRP   A CD2  1 1 
ATOM   4001 N  NE1  . TRP   A 1 261 ? -2.585  13.111  -32.536 1   23.39  ? 951  TRP   A NE1  1 1 
ATOM   4002 C  CE2  . TRP   A 1 261 ? -2.813  14.189  -33.352 1   22.81  ? 951  TRP   A CE2  1 1 
ATOM   4003 C  CE3  . TRP   A 1 261 ? -3.363  14.594  -35.666 1   22.55  ? 951  TRP   A CE3  1 1 
ATOM   4004 C  CZ2  . TRP   A 1 261 ? -2.801  15.549  -33.072 1   23.27  ? 951  TRP   A CZ2  1 1 
ATOM   4005 C  CZ3  . TRP   A 1 261 ? -3.351  15.94   -35.385 1   23.44  ? 951  TRP   A CZ3  1 1 
ATOM   4006 C  CH2  . TRP   A 1 261 ? -3.027  16.408  -34.11  1   23.43  ? 951  TRP   A CH2  1 1 
ATOM   4007 H  H    . TRP   A 1 261 ? -0.808  11.308  -36.283 0   24.69  ? 951  TRP   A H    1 1 
ATOM   4008 H  HA   . TRP   A 1 261 ? -2.649  9.446   -34.936 0   25.72  ? 951  TRP   A HA   1 1 
ATOM   4009 H  HB2  . TRP   A 1 261 ? -3.334  11.85   -36.608 0   24.31  ? 951  TRP   A HB2  1 1 
ATOM   4010 H  HB3  . TRP   A 1 261 ? -4.37   10.927  -35.498 0   24.57  ? 951  TRP   A HB3  1 1 
ATOM   4011 H  HD1  . TRP   A 1 261 ? -2.633  10.961  -32.865 0   23.58  ? 951  TRP   A HD1  1 1 
ATOM   4012 H  HE1  . TRP   A 1 261 ? -2.32   13.161  -31.533 0   23.39  ? 951  TRP   A HE1  1 1 
ATOM   4013 H  HE3  . TRP   A 1 261 ? -3.653  14.228  -36.633 0   23.05  ? 951  TRP   A HE3  1 1 
ATOM   4014 H  HZ2  . TRP   A 1 261 ? -2.52   15.914  -32.099 0   23.21  ? 951  TRP   A HZ2  1 1 
ATOM   4015 H  HZ3  . TRP   A 1 261 ? -3.544  16.646  -36.175 0   23.63  ? 951  TRP   A HZ3  1 1 
ATOM   4016 H  HH2  . TRP   A 1 261 ? -3.022  17.469  -33.927 0   23.4   ? 951  TRP   A HH2  1 1 
ATOM   4017 N  N    . MET   A 1 262 ? -1.719  8.434   -37.47  1   29.1   ? 952  MET   A N    1 1 
ATOM   4018 C  CA   . MET   A 1 262 ? -1.944  7.565   -38.629 1   30.67  ? 952  MET   A CA   1 1 
ATOM   4019 C  C    . MET   A 1 262 ? -2.725  6.344   -38.178 1   32.27  ? 952  MET   A C    1 1 
ATOM   4020 O  O    . MET   A 1 262 ? -2.57   5.903   -37.038 1   32.77  ? 952  MET   A O    1 1 
ATOM   4021 C  CB   . MET   A 1 262 ? -0.626  7.114   -39.282 1   31.27  ? 952  MET   A CB   1 1 
ATOM   4022 C  CG   . MET   A 1 262 ? -0.003  8.166   -40.149 1   33.6   ? 952  MET   A CG   1 1 
ATOM   4023 S  SD   . MET   A 1 262 ? 1.673   7.729   -40.624 1   41.75  ? 952  MET   A SD   1 1 
ATOM   4024 C  CE   . MET   A 1 262 ? 1.342   6.847   -42.145 1   39.46  ? 952  MET   A CE   1 1 
ATOM   4025 H  H    . MET   A 1 262 ? -0.814  8.312   -37.028 0   28.57  ? 952  MET   A H    1 1 
ATOM   4026 H  HA   . MET   A 1 262 ? -2.537  8.094   -39.374 0   30.24  ? 952  MET   A HA   1 1 
ATOM   4027 H  HB2  . MET   A 1 262 ? 0.094   6.84    -38.512 0   30.23  ? 952  MET   A HB2  1 1 
ATOM   4028 H  HB3  . MET   A 1 262 ? -0.831  6.249   -39.911 0   30.72  ? 952  MET   A HB3  1 1 
ATOM   4029 H  HG2  . MET   A 1 262 ? -0.594  8.27    -41.058 0   32.16  ? 952  MET   A HG2  1 1 
ATOM   4030 H  HG3  . MET   A 1 262 ? 0.007   9.106   -39.601 0   32.07  ? 952  MET   A HG3  1 1 
ATOM   4031 H  HE1  . MET   A 1 262 ? 2.284   6.493   -42.561 0   39.12  ? 952  MET   A HE1  1 1 
ATOM   4032 H  HE2  . MET   A 1 262 ? 0.685   6.006   -41.93  0   39.26  ? 952  MET   A HE2  1 1 
ATOM   4033 H  HE3  . MET   A 1 262 ? 0.866   7.533   -42.843 0   38.5   ? 952  MET   A HE3  1 1 
ATOM   4034 N  N    . ILE   A 1 263 ? -3.545  5.773   -39.082 1   32.77  ? 953  ILE   A N    1 1 
ATOM   4035 C  CA   . ILE   A 1 263 ? -4.356  4.585   -38.781 1   33.38  ? 953  ILE   A CA   1 1 
ATOM   4036 C  C    . ILE   A 1 263 ? -3.426  3.417   -38.411 1   33.95  ? 953  ILE   A C    1 1 
ATOM   4037 O  O    . ILE   A 1 263 ? -3.647  2.768   -37.386 1   34.26  ? 953  ILE   A O    1 1 
ATOM   4038 C  CB   . ILE   A 1 263 ? -5.296  4.21    -39.975 1   33.99  ? 953  ILE   A CB   1 1 
ATOM   4039 C  CG1  . ILE   A 1 263 ? -6.343  5.332   -40.305 1   34.94  ? 953  ILE   A CG1  1 1 
ATOM   4040 C  CG2  . ILE   A 1 263 ? -6.001  2.841   -39.773 1   34.53  ? 953  ILE   A CG2  1 1 
ATOM   4041 C  CD1  . ILE   A 1 263 ? -7.36   5.72    -39.246 1   36.43  ? 953  ILE   A CD1  1 1 
ATOM   4042 H  H    . ILE   A 1 263 ? -3.631  6.108   -40.036 0   32.78  ? 953  ILE   A H    1 1 
ATOM   4043 H  HA   . ILE   A 1 263 ? -4.967  4.803   -37.907 0   34.47  ? 953  ILE   A HA   1 1 
ATOM   4044 H  HB   . ILE   A 1 263 ? -4.659  4.107   -40.852 0   35.8   ? 953  ILE   A HB   1 1 
ATOM   4045 H  HG12 . ILE   A 1 263 ? -5.799  6.238   -40.567 0   35.62  ? 953  ILE   A HG12 1 1 
ATOM   4046 H  HG13 . ILE   A 1 263 ? -6.913  5.001   -41.173 0   37     ? 953  ILE   A HG13 1 1 
ATOM   4047 H  HG21 . ILE   A 1 263 ? -6.669  2.675   -40.617 0   38.28  ? 953  ILE   A HG21 1 1 
ATOM   4048 H  HG22 . ILE   A 1 263 ? -5.268  2.037   -39.741 0   38.08  ? 953  ILE   A HG22 1 1 
ATOM   4049 H  HG23 . ILE   A 1 263 ? -6.575  2.855   -38.847 0   37.84  ? 953  ILE   A HG23 1 1 
ATOM   4050 H  HD11 . ILE   A 1 263 ? -8.008  6.49    -39.662 0   37.8   ? 953  ILE   A HD11 1 1 
ATOM   4051 H  HD12 . ILE   A 1 263 ? -7.965  4.858   -38.972 0   38.86  ? 953  ILE   A HD12 1 1 
ATOM   4052 H  HD13 . ILE   A 1 263 ? -6.853  6.113   -38.366 0   37.39  ? 953  ILE   A HD13 1 1 
ATOM   4053 N  N    . ASP   A 1 264 ? -2.374  3.168   -39.222 1   33.66  ? 954  ASP   A N    1 1 
ATOM   4054 C  CA   . ASP   A 1 264 ? -1.451  2.08    -38.929 1   34     ? 954  ASP   A CA   1 1 
ATOM   4055 C  C    . ASP   A 1 264 ? -0.545  2.491   -37.781 1   34.33  ? 954  ASP   A C    1 1 
ATOM   4056 O  O    . ASP   A 1 264 ? 0.288   3.378   -37.951 1   34.82  ? 954  ASP   A O    1 1 
ATOM   4057 C  CB   . ASP   A 1 264 ? -0.625  1.706   -40.167 1   35.66  ? 954  ASP   A CB   1 1 
ATOM   4058 C  CG   . ASP   A 1 264 ? 0.303   0.53    -39.938 1   40.12  ? 954  ASP   A CG   1 1 
ATOM   4059 O  OD1  . ASP   A 1 264 ? -0.095  -0.411  -39.215 1   41.2   ? 954  ASP   A OD1  1 1 
ATOM   4060 O  OD2  . ASP   A 1 264 ? 1.423   0.546   -40.48  1   42.2   ? 954  ASP   A OD2  1 1 
ATOM   4061 H  H    . ASP   A 1 264 ? -2.151  3.684   -40.067 0   35.06  ? 954  ASP   A H    1 1 
ATOM   4062 H  HA   . ASP   A 1 264 ? -2.027  1.203   -38.638 0   37.28  ? 954  ASP   A HA   1 1 
ATOM   4063 H  HB2  . ASP   A 1 264 ? -1.307  1.437   -40.973 0   38.9   ? 954  ASP   A HB2  1 1 
ATOM   4064 H  HB3  . ASP   A 1 264 ? -0.021  2.561   -40.468 0   37.75  ? 954  ASP   A HB3  1 1 
ATOM   4065 N  N    . ALA   A 1 265 ? -0.713  1.854   -36.613 1   34.16  ? 955  ALA   A N    1 1 
ATOM   4066 C  CA   . ALA   A 1 265 ? 0.079   2.142   -35.413 1   34.56  ? 955  ALA   A CA   1 1 
ATOM   4067 C  C    . ALA   A 1 265 ? 1.595   2.103   -35.64  1   34.55  ? 955  ALA   A C    1 1 
ATOM   4068 O  O    . ALA   A 1 265 ? 2.301   2.967   -35.126 1   34.45  ? 955  ALA   A O    1 1 
ATOM   4069 C  CB   . ALA   A 1 265 ? -0.296  1.175   -34.301 1   34.86  ? 955  ALA   A CB   1 1 
ATOM   4070 H  H    . ALA   A 1 265 ? -1.402  1.122   -36.47  0   37.18  ? 955  ALA   A H    1 1 
ATOM   4071 H  HA   . ALA   A 1 265 ? -0.174  3.143   -35.066 0   35.62  ? 955  ALA   A HA   1 1 
ATOM   4072 H  HB1  . ALA   A 1 265 ? 0.3     1.407   -33.421 0   37.22  ? 955  ALA   A HB1  1 1 
ATOM   4073 H  HB2  . ALA   A 1 265 ? -1.356  1.293   -34.077 0   37.53  ? 955  ALA   A HB2  1 1 
ATOM   4074 H  HB3  . ALA   A 1 265 ? -0.095  0.158   -34.632 0   38.45  ? 955  ALA   A HB3  1 1 
ATOM   4075 N  N    . ASP   A 1 266 ? 2.097   1.113   -36.398 1   34.54  ? 956  ASP   A N    1 1 
ATOM   4076 C  CA   . ASP   A 1 266 ? 3.533   0.987   -36.675 1   35.1   ? 956  ASP   A CA   1 1 
ATOM   4077 C  C    . ASP   A 1 266 ? 4.081   2.116   -37.553 1   34.62  ? 956  ASP   A C    1 1 
ATOM   4078 O  O    . ASP   A 1 266 ? 5.266   2.415   -37.472 1   35.12  ? 956  ASP   A O    1 1 
ATOM   4079 C  CB   . ASP   A 1 266 ? 3.845   -0.368  -37.338 1   38.14  ? 956  ASP   A CB   1 1 
ATOM   4080 C  CG   . ASP   A 1 266 ? 3.66    -1.585  -36.446 1   44.88  ? 956  ASP   A CG   1 1 
ATOM   4081 O  OD1  . ASP   A 1 266 ? 3.26    -1.41   -35.273 1   46.27  ? 956  ASP   A OD1  1 1 
ATOM   4082 O  OD2  . ASP   A 1 266 ? 3.917   -2.716  -36.923 1   47.75  ? 956  ASP   A OD2  1 1 
ATOM   4083 H  H    . ASP   A 1 266 ? 1.534   0.384   -36.824 0   38.05  ? 956  ASP   A H    1 1 
ATOM   4084 H  HA   . ASP   A 1 266 ? 4.075   1.029   -35.732 0   38.11  ? 956  ASP   A HA   1 1 
ATOM   4085 H  HB2  . ASP   A 1 266 ? 3.204   -0.492  -38.21  0   42.71  ? 956  ASP   A HB2  1 1 
ATOM   4086 H  HB3  . ASP   A 1 266 ? 4.886   -0.355  -37.655 0   42.78  ? 956  ASP   A HB3  1 1 
ATOM   4087 N  N    . SER   A 1 267 ? 3.244   2.726   -38.406 1   33.73  ? 957  SER   A N    1 1 
ATOM   4088 C  CA   . SER   A 1 267 ? 3.667   3.838   -39.263 1   33.29  ? 957  SER   A CA   1 1 
ATOM   4089 C  C    . SER   A 1 267 ? 3.84    5.173   -38.495 1   33.12  ? 957  SER   A C    1 1 
ATOM   4090 O  O    . SER   A 1 267 ? 4.451   6.102   -39.029 1   33.52  ? 957  SER   A O    1 1 
ATOM   4091 C  CB   . SER   A 1 267 ? 2.669   4.029   -40.397 1   34.09  ? 957  SER   A CB   1 1 
ATOM   4092 O  OG   . SER   A 1 267 ? 2.652   2.904   -41.262 1   35.84  ? 957  SER   A OG   1 1 
ATOM   4093 H  H    . SER   A 1 267 ? 2.272   2.466   -38.542 0   35.67  ? 957  SER   A H    1 1 
ATOM   4094 H  HA   . SER   A 1 267 ? 4.628   3.594   -39.713 0   34.85  ? 957  SER   A HA   1 1 
ATOM   4095 H  HB2  . SER   A 1 267 ? 1.673   4.175   -39.983 0   34.86  ? 957  SER   A HB2  1 1 
ATOM   4096 H  HB3  . SER   A 1 267 ? 2.956   4.91    -40.969 0   34.6   ? 957  SER   A HB3  1 1 
ATOM   4097 H  HG   . SER   A 1 267 ? 2.074   2.188   -40.887 0   38.27  ? 957  SER   A HG   1 1 
ATOM   4098 N  N    . ARG   A 1 268 ? 3.335   5.265   -37.249 1   32.27  ? 958  ARG   A N    1 1 
ATOM   4099 C  CA   . ARG   A 1 268 ? 3.456   6.476   -36.438 1   31.82  ? 958  ARG   A CA   1 1 
ATOM   4100 C  C    . ARG   A 1 268 ? 4.92    6.681   -36.036 1   33.06  ? 958  ARG   A C    1 1 
ATOM   4101 O  O    . ARG   A 1 268 ? 5.663   5.687   -35.955 1   33.69  ? 958  ARG   A O    1 1 
ATOM   4102 C  CB   . ARG   A 1 268 ? 2.589   6.383   -35.167 1   31.25  ? 958  ARG   A CB   1 1 
ATOM   4103 C  CG   . ARG   A 1 268 ? 1.088   6.404   -35.441 1   31.18  ? 958  ARG   A CG   1 1 
ATOM   4104 C  CD   . ARG   A 1 268 ? 0.271   5.991   -34.237 1   32.57  ? 958  ARG   A CD   1 1 
ATOM   4105 N  NE   . ARG   A 1 268 ? -1.07   5.563   -34.655 1   32.63  ? 958  ARG   A NE   1 1 
ATOM   4106 C  CZ   . ARG   A 1 268 ? -1.9    4.811   -33.938 1   33.75  ? 958  ARG   A CZ   1 1 
ATOM   4107 N  NH1  . ARG   A 1 268 ? -3.071  4.452   -34.437 1   33.53  ? 958  ARG   A NH1  1 1 
ATOM   4108 N  NH2  . ARG   A 1 268 ? -1.565  4.413   -32.715 1   33.65  ? 958  ARG   A NH2  1 1 
ATOM   4109 H  H    . ARG   A 1 268 ? 2.857   4.508   -36.771 0   32.55  ? 958  ARG   A H    1 1 
ATOM   4110 H  HA   . ARG   A 1 268 ? 3.101   7.311   -37.041 0   30.51  ? 958  ARG   A HA   1 1 
ATOM   4111 H  HB2  . ARG   A 1 268 ? 2.836   5.463   -34.638 0   30.73  ? 958  ARG   A HB2  1 1 
ATOM   4112 H  HB3  . ARG   A 1 268 ? 2.814   7.238   -34.532 0   29.92  ? 958  ARG   A HB3  1 1 
ATOM   4113 H  HG2  . ARG   A 1 268 ? 0.797   7.416   -35.717 0   29.87  ? 958  ARG   A HG2  1 1 
ATOM   4114 H  HG3  . ARG   A 1 268 ? 0.856   5.721   -36.256 0   30.49  ? 958  ARG   A HG3  1 1 
ATOM   4115 H  HD2  . ARG   A 1 268 ? 0.77    5.159   -33.742 0   32.08  ? 958  ARG   A HD2  1 1 
ATOM   4116 H  HD3  . ARG   A 1 268 ? 0.175   6.834   -33.555 0   31.08  ? 958  ARG   A HD3  1 1 
ATOM   4117 H  HE   . ARG   A 1 268 ? -1.369  5.832   -35.586 0   31.94  ? 958  ARG   A HE   1 1 
ATOM   4118 H  HH11 . ARG   A 1 268 ? -3.348  4.754   -35.365 0   33.94  ? 958  ARG   A HH11 1 1 
ATOM   4119 H  HH12 . ARG   A 1 268 ? -3.713  3.893   -33.883 0   34.58  ? 958  ARG   A HH12 1 1 
ATOM   4120 H  HH21 . ARG   A 1 268 ? -0.68   4.646   -32.276 0   33.49  ? 958  ARG   A HH21 1 1 
ATOM   4121 H  HH22 . ARG   A 1 268 ? -2.221  3.847   -32.187 0   34.31  ? 958  ARG   A HH22 1 1 
ATOM   4122 N  N    . PRO   A 1 269 ? 5.389   7.928   -35.756 1   33.14  ? 959  PRO   A N    1 1 
ATOM   4123 C  CA   . PRO   A 1 269 ? 6.788   8.072   -35.337 1   33.34  ? 959  PRO   A CA   1 1 
ATOM   4124 C  C    . PRO   A 1 269 ? 7.047   7.373   -34.009 1   33.38  ? 959  PRO   A C    1 1 
ATOM   4125 O  O    . PRO   A 1 269 ? 6.129   7.176   -33.23  1   33.36  ? 959  PRO   A O    1 1 
ATOM   4126 C  CB   . PRO   A 1 269 ? 6.975   9.589   -35.213 1   34.04  ? 959  PRO   A CB   1 1 
ATOM   4127 C  CG   . PRO   A 1 269 ? 5.811   10.202  -35.909 1   34.28  ? 959  PRO   A CG   1 1 
ATOM   4128 C  CD   . PRO   A 1 269 ? 4.702   9.238   -35.728 1   32.51  ? 959  PRO   A CD   1 1 
ATOM   4129 H  HA   . PRO   A 1 269 ? 7.465   7.688   -36.1   0   32.96  ? 959  PRO   A HA   1 1 
ATOM   4130 H  HB2  . PRO   A 1 269 ? 6.969   9.863   -34.16  0   33.03  ? 959  PRO   A HB2  1 1 
ATOM   4131 H  HB3  . PRO   A 1 269 ? 7.911   9.884   -35.687 0   33.58  ? 959  PRO   A HB3  1 1 
ATOM   4132 H  HG2  . PRO   A 1 269 ? 5.568   11.157  -35.447 0   33.07  ? 959  PRO   A HG2  1 1 
ATOM   4133 H  HG3  . PRO   A 1 269 ? 6.04    10.326  -36.967 0   33.4   ? 959  PRO   A HG3  1 1 
ATOM   4134 H  HD2  . PRO   A 1 269 ? 4.246   9.395   -34.751 0   31.45  ? 959  PRO   A HD2  1 1 
ATOM   4135 H  HD3  . PRO   A 1 269 ? 3.98    9.359   -36.533 0   31.57  ? 959  PRO   A HD3  1 1 
ATOM   4136 N  N    . LYS   A 1 270 ? 8.292   6.996   -33.758 1   33.06  ? 960  LYS   A N    1 1 
ATOM   4137 C  CA   . LYS   A 1 270 ? 8.67    6.381   -32.493 1   33.1   ? 960  LYS   A CA   1 1 
ATOM   4138 C  C    . LYS   A 1 270 ? 9.113   7.521   -31.561 1   32.64  ? 960  LYS   A C    1 1 
ATOM   4139 O  O    . LYS   A 1 270 ? 9.547   8.572   -32.054 1   32.84  ? 960  LYS   A O    1 1 
ATOM   4140 C  CB   . LYS   A 1 270 ? 9.808   5.377   -32.714 1   35.86  ? 960  LYS   A CB   1 1 
ATOM   4141 C  CG   . LYS   A 1 270 ? 9.56    4.324   -33.812 1   40.93  ? 960  LYS   A CG   1 1 
ATOM   4142 C  CD   . LYS   A 1 270 ? 8.514   3.266   -33.474 1   45.7   ? 960  LYS   A CD   1 1 
ATOM   4143 C  CE   . LYS   A 1 270 ? 8.079   2.508   -34.714 1   49.84  ? 960  LYS   A CE   1 1 
ATOM   4144 N  NZ   . LYS   A 1 270 ? 7.092   3.254   -35.56  1   52.29  ? 960  LYS   A NZ   1 1 
ATOM   4145 H  H    . LYS   A 1 270 ? 9.066   7.144   -34.399 0   33.5   ? 960  LYS   A H    1 1 
ATOM   4146 H  HA   . LYS   A 1 270 ? 7.833   5.86    -32.031 0   33.54  ? 960  LYS   A HA   1 1 
ATOM   4147 H  HB2  . LYS   A 1 270 ? 10.684  5.943   -33.027 0   37.71  ? 960  LYS   A HB2  1 1 
ATOM   4148 H  HB3  . LYS   A 1 270 ? 10.015  4.856   -31.78  0   37.87  ? 960  LYS   A HB3  1 1 
ATOM   4149 H  HG2  . LYS   A 1 270 ? 9.265   4.811   -34.741 0   42.78  ? 960  LYS   A HG2  1 1 
ATOM   4150 H  HG3  . LYS   A 1 270 ? 10.496  3.792   -33.97  0   44.02  ? 960  LYS   A HG3  1 1 
ATOM   4151 H  HD2  . LYS   A 1 270 ? 8.949   2.547   -32.782 0   48.75  ? 960  LYS   A HD2  1 1 
ATOM   4152 H  HD3  . LYS   A 1 270 ? 7.632   3.722   -33.026 0   47.4   ? 960  LYS   A HD3  1 1 
ATOM   4153 H  HE2  . LYS   A 1 270 ? 8.953   2.313   -35.334 0   53.33  ? 960  LYS   A HE2  1 1 
ATOM   4154 H  HE3  . LYS   A 1 270 ? 7.622   1.568   -34.411 0   53.29  ? 960  LYS   A HE3  1 1 
ATOM   4155 H  HZ1  . LYS   A 1 270 ? 6.306   2.649   -35.775 0   54.54  ? 960  LYS   A HZ1  1 1 
ATOM   4156 H  HZ2  . LYS   A 1 270 ? 6.74    4.089   -35.101 0   53.59  ? 960  LYS   A HZ2  1 1 
ATOM   4157 H  HZ3  . LYS   A 1 270 ? 7.53    3.528   -36.433 0   54.38  ? 960  LYS   A HZ3  1 1 
ATOM   4158 N  N    . PHE   A 1 271 ? 9.043   7.33    -30.227 1   32.01  ? 961  PHE   A N    1 1 
ATOM   4159 C  CA   . PHE   A 1 271 ? 9.506   8.372   -29.302 1   32.19  ? 961  PHE   A CA   1 1 
ATOM   4160 C  C    . PHE   A 1 271 ? 10.98   8.722   -29.515 1   33.19  ? 961  PHE   A C    1 1 
ATOM   4161 O  O    . PHE   A 1 271 ? 11.348  9.885   -29.354 1   33.32  ? 961  PHE   A O    1 1 
ATOM   4162 C  CB   . PHE   A 1 271 ? 9.208   8.032   -27.831 1   31.47  ? 961  PHE   A CB   1 1 
ATOM   4163 C  CG   . PHE   A 1 271 ? 7.727   8.05    -27.523 1   31.2   ? 961  PHE   A CG   1 1 
ATOM   4164 C  CD1  . PHE   A 1 271 ? 6.988   9.212   -27.663 1   31.51  ? 961  PHE   A CD1  1 1 
ATOM   4165 C  CD2  . PHE   A 1 271 ? 7.072   6.901   -27.117 1   31.57  ? 961  PHE   A CD2  1 1 
ATOM   4166 C  CE1  . PHE   A 1 271 ? 5.621   9.21    -27.432 1   32.36  ? 961  PHE   A CE1  1 1 
ATOM   4167 C  CE2  . PHE   A 1 271 ? 5.708   6.904   -26.891 1   32.09  ? 961  PHE   A CE2  1 1 
ATOM   4168 C  CZ   . PHE   A 1 271 ? 4.992   8.061   -27.035 1   31.93  ? 961  PHE   A CZ   1 1 
ATOM   4169 H  H    . PHE   A 1 271 ? 8.687   6.493   -29.778 0   32.41  ? 961  PHE   A H    1 1 
ATOM   4170 H  HA   . PHE   A 1 271 ? 8.954   9.275   -29.549 0   31.77  ? 961  PHE   A HA   1 1 
ATOM   4171 H  HB2  . PHE   A 1 271 ? 9.598   7.04    -27.608 0   32.03  ? 961  PHE   A HB2  1 1 
ATOM   4172 H  HB3  . PHE   A 1 271 ? 9.691   8.77    -27.193 0   31.57  ? 961  PHE   A HB3  1 1 
ATOM   4173 H  HD1  . PHE   A 1 271 ? 7.465   10.123  -27.979 0   31.05  ? 961  PHE   A HD1  1 1 
ATOM   4174 H  HD2  . PHE   A 1 271 ? 7.621   5.98    -27.018 0   31.78  ? 961  PHE   A HD2  1 1 
ATOM   4175 H  HE1  . PHE   A 1 271 ? 5.064   10.123  -27.542 0   31.11  ? 961  PHE   A HE1  1 1 
ATOM   4176 H  HE2  . PHE   A 1 271 ? 5.215   6       -26.575 0   31.53  ? 961  PHE   A HE2  1 1 
ATOM   4177 H  HZ   . PHE   A 1 271 ? 3.934   8.067   -26.835 0   30.32  ? 961  PHE   A HZ   1 1 
ATOM   4178 N  N    . ARG   A 1 272 ? 11.812  7.746   -29.928 1   33.74  ? 962  ARG   A N    1 1 
ATOM   4179 C  CA   . ARG   A 1 272 ? 13.213  8.04    -30.244 1   34.67  ? 962  ARG   A CA   1 1 
ATOM   4180 C  C    . ARG   A 1 272 ? 13.326  9.038   -31.422 1   34.42  ? 962  ARG   A C    1 1 
ATOM   4181 O  O    . ARG   A 1 272 ? 14.115  9.982   -31.348 1   34.77  ? 962  ARG   A O    1 1 
ATOM   4182 C  CB   . ARG   A 1 272 ? 14.027  6.75    -30.501 1   37.4   ? 962  ARG   A CB   1 1 
ATOM   4183 C  CG   . ARG   A 1 272 ? 13.622  5.936   -31.729 1   42.55  ? 962  ARG   A CG   1 1 
ATOM   4184 C  CD   . ARG   A 1 272 ? 14.282  4.575   -31.73  1   47.91  ? 962  ARG   A CD   1 1 
ATOM   4185 N  NE   . ARG   A 1 272 ? 14.232  3.944   -33.055 1   52.2   ? 962  ARG   A NE   1 1 
ATOM   4186 C  CZ   . ARG   A 1 272 ? 13.314  3.079   -33.493 1   54.57  ? 962  ARG   A CZ   1 1 
ATOM   4187 N  NH1  . ARG   A 1 272 ? 12.32   2.685   -32.699 1   54.21  ? 962  ARG   A NH1  1 1 
ATOM   4188 N  NH2  . ARG   A 1 272 ? 13.394  2.586   -34.723 1   54.56  ? 962  ARG   A NH2  1 1 
ATOM   4189 H  H    . ARG   A 1 272 ? 11.556  6.767   -30     0   35.57  ? 962  ARG   A H    1 1 
ATOM   4190 H  HA   . ARG   A 1 272 ? 13.667  8.515   -29.379 0   37.22  ? 962  ARG   A HA   1 1 
ATOM   4191 H  HB2  . ARG   A 1 272 ? 15.075  7.024   -30.614 0   41.73  ? 962  ARG   A HB2  1 1 
ATOM   4192 H  HB3  . ARG   A 1 272 ? 13.916  6.102   -29.632 0   41.21  ? 962  ARG   A HB3  1 1 
ATOM   4193 H  HG2  . ARG   A 1 272 ? 12.544  5.789   -31.721 0   45.56  ? 962  ARG   A HG2  1 1 
ATOM   4194 H  HG3  . ARG   A 1 272 ? 13.931  6.463   -32.63  0   46.27  ? 962  ARG   A HG3  1 1 
ATOM   4195 H  HD2  . ARG   A 1 272 ? 15.335  4.723   -31.5   0   53.67  ? 962  ARG   A HD2  1 1 
ATOM   4196 H  HD3  . ARG   A 1 272 ? 13.848  3.943   -30.957 0   52.88  ? 962  ARG   A HD3  1 1 
ATOM   4197 H  HE   . ARG   A 1 272 ? 14.969  4.207   -33.702 0   58.09  ? 962  ARG   A HE   1 1 
ATOM   4198 H  HH11 . ARG   A 1 272 ? 12.174  3.019   -31.754 0   58.73  ? 962  ARG   A HH11 1 1 
ATOM   4199 H  HH12 . ARG   A 1 272 ? 11.644  2.025   -33.069 0   59.16  ? 962  ARG   A HH12 1 1 
ATOM   4200 H  HH21 . ARG   A 1 272 ? 14.153  2.867   -35.335 0   60.83  ? 962  ARG   A HH21 1 1 
ATOM   4201 H  HH22 . ARG   A 1 272 ? 12.704  1.92    -35.056 0   60.43  ? 962  ARG   A HH22 1 1 
ATOM   4202 N  N    . GLU   A 1 273 ? 12.492  8.863   -32.468 1   33.45  ? 963  GLU   A N    1 1 
ATOM   4203 C  CA   . GLU   A 1 273 ? 12.48   9.727   -33.65  1   33.19  ? 963  GLU   A CA   1 1 
ATOM   4204 C  C    . GLU   A 1 273 ? 11.913  11.118  -33.325 1   32.82  ? 963  GLU   A C    1 1 
ATOM   4205 O  O    . GLU   A 1 273 ? 12.345  12.105  -33.933 1   33.43  ? 963  GLU   A O    1 1 
ATOM   4206 C  CB   . GLU   A 1 273 ? 11.642  9.09    -34.776 1   35.49  ? 963  GLU   A CB   1 1 
ATOM   4207 C  CG   . GLU   A 1 273 ? 12.198  7.787   -35.334 1   40.38  ? 963  GLU   A CG   1 1 
ATOM   4208 C  CD   . GLU   A 1 273 ? 11.252  7.027   -36.246 1   46.09  ? 963  GLU   A CD   1 1 
ATOM   4209 O  OE1  . GLU   A 1 273 ? 10.022  7.179   -36.086 1   45.81  ? 963  GLU   A OE1  1 1 
ATOM   4210 O  OE2  . GLU   A 1 273 ? 11.738  6.263   -37.112 1   49.85  ? 963  GLU   A OE2  1 1 
ATOM   4211 H  H    . GLU   A 1 273 ? 11.797  8.124   -32.504 0   34.91  ? 963  GLU   A H    1 1 
ATOM   4212 H  HA   . GLU   A 1 273 ? 13.499  9.852   -34.014 0   35.34  ? 963  GLU   A HA   1 1 
ATOM   4213 H  HB2  . GLU   A 1 273 ? 10.644  8.905   -34.382 0   36.01  ? 963  GLU   A HB2  1 1 
ATOM   4214 H  HB3  . GLU   A 1 273 ? 11.582  9.8     -35.599 0   36.35  ? 963  GLU   A HB3  1 1 
ATOM   4215 H  HG2  . GLU   A 1 273 ? 13.099  8.012   -35.903 0   43.03  ? 963  GLU   A HG2  1 1 
ATOM   4216 H  HG3  . GLU   A 1 273 ? 12.452  7.122   -34.51  0   42.84  ? 963  GLU   A HG3  1 1 
ATOM   4217 N  N    . LEU   A 1 274 ? 10.932  11.199  -32.393 1   31.51  ? 964  LEU   A N    1 1 
ATOM   4218 C  CA   . LEU   A 1 274 ? 10.318  12.476  -31.995 1   30.67  ? 964  LEU   A CA   1 1 
ATOM   4219 C  C    . LEU   A 1 274 ? 11.303  13.308  -31.188 1   30.36  ? 964  LEU   A C    1 1 
ATOM   4220 O  O    . LEU   A 1 274 ? 11.358  14.527  -31.359 1   29.88  ? 964  LEU   A O    1 1 
ATOM   4221 C  CB   . LEU   A 1 274 ? 9.016   12.258  -31.191 1   30.19  ? 964  LEU   A CB   1 1 
ATOM   4222 C  CG   . LEU   A 1 274 ? 7.872   11.567  -31.95  1   30.95  ? 964  LEU   A CG   1 1 
ATOM   4223 C  CD1  . LEU   A 1 274 ? 6.8     11.075  -31.012 1   31.14  ? 964  LEU   A CD1  1 1 
ATOM   4224 C  CD2  . LEU   A 1 274 ? 7.218   12.505  -32.957 1   31.6   ? 964  LEU   A CD2  1 1 
ATOM   4225 H  H    . LEU   A 1 274 ? 10.557  10.4    -31.891 0   31.73  ? 964  LEU   A H    1 1 
ATOM   4226 H  HA   . LEU   A 1 274 ? 10.086  13.047  -32.892 0   30.9   ? 964  LEU   A HA   1 1 
ATOM   4227 H  HB2  . LEU   A 1 274 ? 9.254   11.642  -30.324 0   30.29  ? 964  LEU   A HB2  1 1 
ATOM   4228 H  HB3  . LEU   A 1 274 ? 8.65    13.229  -30.86  0   29.99  ? 964  LEU   A HB3  1 1 
ATOM   4229 H  HG   . LEU   A 1 274 ? 8.275   10.705  -32.48  0   30.91  ? 964  LEU   A HG   1 1 
ATOM   4230 H  HD11 . LEU   A 1 274 ? 6.012   10.608  -31.599 0   30.37  ? 964  LEU   A HD11 1 1 
ATOM   4231 H  HD12 . LEU   A 1 274 ? 7.2     10.354  -30.305 0   30.71  ? 964  LEU   A HD12 1 1 
ATOM   4232 H  HD13 . LEU   A 1 274 ? 6.394   11.929  -30.47  0   30.33  ? 964  LEU   A HD13 1 1 
ATOM   4233 H  HD21 . LEU   A 1 274 ? 6.379   11.995  -33.427 0   30.84  ? 964  LEU   A HD21 1 1 
ATOM   4234 H  HD22 . LEU   A 1 274 ? 6.858   13.389  -32.432 0   30.84  ? 964  LEU   A HD22 1 1 
ATOM   4235 H  HD23 . LEU   A 1 274 ? 7.934   12.797  -33.724 0   31.42  ? 964  LEU   A HD23 1 1 
ATOM   4236 N  N    . ILE   A 1 275 ? 12.135  12.666  -30.346 1   30.67  ? 965  ILE   A N    1 1 
ATOM   4237 C  CA   . ILE   A 1 275 ? 13.211  13.368  -29.619 1   31.69  ? 965  ILE   A CA   1 1 
ATOM   4238 C  C    . ILE   A 1 275 ? 14.121  14.085  -30.665 1   32.47  ? 965  ILE   A C    1 1 
ATOM   4239 O  O    . ILE   A 1 275 ? 14.328  15.285  -30.573 1   32.88  ? 965  ILE   A O    1 1 
ATOM   4240 C  CB   . ILE   A 1 275 ? 14.078  12.376  -28.754 1   32.31  ? 965  ILE   A CB   1 1 
ATOM   4241 C  CG1  . ILE   A 1 275 ? 13.299  11.821  -27.53  1   32.89  ? 965  ILE   A CG1  1 1 
ATOM   4242 C  CG2  . ILE   A 1 275 ? 15.409  13.055  -28.301 1   32.43  ? 965  ILE   A CG2  1 1 
ATOM   4243 C  CD1  . ILE   A 1 275 ? 14.002  10.517  -26.895 1   33.74  ? 965  ILE   A CD1  1 1 
ATOM   4244 H  H    . ILE   A 1 275 ? 12.087  11.673  -30.145 0   31.5   ? 965  ILE   A H    1 1 
ATOM   4245 H  HA   . ILE   A 1 275 ? 12.78   14.12   -28.96  0   32.42  ? 965  ILE   A HA   1 1 
ATOM   4246 H  HB   . ILE   A 1 275 ? 14.342  11.529  -29.386 0   34.52  ? 965  ILE   A HB   1 1 
ATOM   4247 H  HG12 . ILE   A 1 275 ? 13.235  12.59   -26.761 0   34.07  ? 965  ILE   A HG12 1 1 
ATOM   4248 H  HG13 . ILE   A 1 275 ? 12.3    11.53   -27.85  0   33.57  ? 965  ILE   A HG13 1 1 
ATOM   4249 H  HG21 . ILE   A 1 275 ? 16.015  12.364  -27.718 0   35.97  ? 965  ILE   A HG21 1 1 
ATOM   4250 H  HG22 . ILE   A 1 275 ? 15.983  13.351  -29.177 0   35.85  ? 965  ILE   A HG22 1 1 
ATOM   4251 H  HG23 . ILE   A 1 275 ? 15.176  13.936  -27.705 0   35.08  ? 965  ILE   A HG23 1 1 
ATOM   4252 H  HD11 . ILE   A 1 275 ? 13.314  10.012  -26.221 0   35.59  ? 965  ILE   A HD11 1 1 
ATOM   4253 H  HD12 . ILE   A 1 275 ? 14.259  9.831   -27.698 0   36.2   ? 965  ILE   A HD12 1 1 
ATOM   4254 H  HD13 . ILE   A 1 275 ? 14.911  10.793  -26.363 0   36.7   ? 965  ILE   A HD13 1 1 
ATOM   4255 N  N    . ILE   A 1 276 ? 14.547  13.348  -31.699 1   32.75  ? 966  ILE   A N    1 1 
ATOM   4256 C  CA   . ILE   A 1 276 ? 15.444  13.841  -32.754 1   33.57  ? 966  ILE   A CA   1 1 
ATOM   4257 C  C    . ILE   A 1 276 ? 14.813  14.966  -33.583 1   33.38  ? 966  ILE   A C    1 1 
ATOM   4258 O  O    . ILE   A 1 276 ? 15.428  16.021  -33.763 1   33.74  ? 966  ILE   A O    1 1 
ATOM   4259 C  CB   . ILE   A 1 276 ? 15.924  12.644  -33.653 1   34.81  ? 966  ILE   A CB   1 1 
ATOM   4260 C  CG1  . ILE   A 1 276 ? 16.963  11.781  -32.88  1   36.06  ? 966  ILE   A CG1  1 1 
ATOM   4261 C  CG2  . ILE   A 1 276 ? 16.54   13.137  -34.995 1   35.93  ? 966  ILE   A CG2  1 1 
ATOM   4262 C  CD1  . ILE   A 1 276 ? 17.197  10.352  -33.394 1   37.25  ? 966  ILE   A CD1  1 1 
ATOM   4263 H  H    . ILE   A 1 276 ? 14.265  12.384  -31.839 0   34.81  ? 966  ILE   A H    1 1 
ATOM   4264 H  HA   . ILE   A 1 276 ? 16.321  14.261  -32.261 0   37.29  ? 966  ILE   A HA   1 1 
ATOM   4265 H  HB   . ILE   A 1 276 ? 15.071  12.015  -33.904 0   37.68  ? 966  ILE   A HB   1 1 
ATOM   4266 H  HG12 . ILE   A 1 276 ? 17.911  12.312  -32.925 0   41.6   ? 966  ILE   A HG12 1 1 
ATOM   4267 H  HG13 . ILE   A 1 276 ? 16.648  11.695  -31.841 0   40.37  ? 966  ILE   A HG13 1 1 
ATOM   4268 H  HG21 . ILE   A 1 276 ? 16.891  12.285  -35.574 0   40.56  ? 966  ILE   A HG21 1 1 
ATOM   4269 H  HG22 . ILE   A 1 276 ? 15.796  13.669  -35.586 0   39.35  ? 966  ILE   A HG22 1 1 
ATOM   4270 H  HG23 . ILE   A 1 276 ? 17.38   13.795  -34.774 0   40.87  ? 966  ILE   A HG23 1 1 
ATOM   4271 H  HD11 . ILE   A 1 276 ? 17.938  9.87    -32.757 0   43.32  ? 966  ILE   A HD11 1 1 
ATOM   4272 H  HD12 . ILE   A 1 276 ? 16.258  9.803   -33.346 0   41.72  ? 966  ILE   A HD12 1 1 
ATOM   4273 H  HD13 . ILE   A 1 276 ? 17.557  10.374  -34.421 0   42.88  ? 966  ILE   A HD13 1 1 
ATOM   4274 N  N    . GLU   A 1 277 ? 13.605  14.727  -34.112 1   32.83  ? 967  GLU   A N    1 1 
ATOM   4275 C  CA   . GLU   A 1 277 ? 12.932  15.7    -34.962 1   32.48  ? 967  GLU   A CA   1 1 
ATOM   4276 C  C    . GLU   A 1 277 ? 12.656  16.999  -34.202 1   31.25  ? 967  GLU   A C    1 1 
ATOM   4277 O  O    . GLU   A 1 277 ? 12.982  18.065  -34.72  1   31.14  ? 967  GLU   A O    1 1 
ATOM   4278 C  CB   . GLU   A 1 277 ? 11.65   15.089  -35.536 1   35.7   ? 967  GLU   A CB   1 1 
ATOM   4279 C  CG   . GLU   A 1 277 ? 10.887  15.961  -36.521 1   41.75  ? 967  GLU   A CG   1 1 
ATOM   4280 C  CD   . GLU   A 1 277 ? 11.091  15.641  -37.989 1   47     ? 967  GLU   A CD   1 1 
ATOM   4281 O  OE1  . GLU   A 1 277 ? 10.075  15.463  -38.701 1   45.01  ? 967  GLU   A OE1  1 1 
ATOM   4282 O  OE2  . GLU   A 1 277 ? 12.262  15.552  -38.424 1   49.17  ? 967  GLU   A OE2  1 1 
ATOM   4283 H  H    . GLU   A 1 277 ? 13.076  13.873  -33.965 0   33.83  ? 967  GLU   A H    1 1 
ATOM   4284 H  HA   . GLU   A 1 277 ? 13.59   15.919  -35.802 0   34.22  ? 967  GLU   A HA   1 1 
ATOM   4285 H  HB2  . GLU   A 1 277 ? 11.911  14.162  -36.044 0   36.2   ? 967  GLU   A HB2  1 1 
ATOM   4286 H  HB3  . GLU   A 1 277 ? 10.977  14.871  -34.707 0   35.51  ? 967  GLU   A HB3  1 1 
ATOM   4287 H  HG2  . GLU   A 1 277 ? 9.829   15.808  -36.319 0   40.55  ? 967  GLU   A HG2  1 1 
ATOM   4288 H  HG3  . GLU   A 1 277 ? 11.126  17.013  -36.372 0   41.46  ? 967  GLU   A HG3  1 1 
ATOM   4289 N  N    . PHE   A 1 278 ? 12.111  16.928  -32.975 1   30.61  ? 968  PHE   A N    1 1 
ATOM   4290 C  CA   . PHE   A 1 278 ? 11.838  18.149  -32.205 1   30.94  ? 968  PHE   A CA   1 1 
ATOM   4291 C  C    . PHE   A 1 278 ? 13.12   18.812  -31.705 1   31.76  ? 968  PHE   A C    1 1 
ATOM   4292 O  O    . PHE   A 1 278 ? 13.138  20.034  -31.56  1   31.27  ? 968  PHE   A O    1 1 
ATOM   4293 C  CB   . PHE   A 1 278 ? 10.845  17.915  -31.053 1   30.49  ? 968  PHE   A CB   1 1 
ATOM   4294 C  CG   . PHE   A 1 278 ? 9.386   17.927  -31.475 1   31.08  ? 968  PHE   A CG   1 1 
ATOM   4295 C  CD1  . PHE   A 1 278 ? 8.749   19.116  -31.79  1   31.5   ? 968  PHE   A CD1  1 1 
ATOM   4296 C  CD2  . PHE   A 1 278 ? 8.669   16.752  -31.581 1   31.72  ? 968  PHE   A CD2  1 1 
ATOM   4297 C  CE1  . PHE   A 1 278 ? 7.412   19.13   -32.176 1   32.19  ? 968  PHE   A CE1  1 1 
ATOM   4298 C  CE2  . PHE   A 1 278 ? 7.333   16.771  -31.973 1   32.45  ? 968  PHE   A CE2  1 1 
ATOM   4299 C  CZ   . PHE   A 1 278 ? 6.72    17.959  -32.279 1   31.96  ? 968  PHE   A CZ   1 1 
ATOM   4300 H  H    . PHE   A 1 278 ? 11.851  16.066  -32.508 0   31.43  ? 968  PHE   A H    1 1 
ATOM   4301 H  HA   . PHE   A 1 278 ? 11.401  18.871  -32.895 0   31.65  ? 968  PHE   A HA   1 1 
ATOM   4302 H  HB2  . PHE   A 1 278 ? 11.054  16.959  -30.574 0   31.13  ? 968  PHE   A HB2  1 1 
ATOM   4303 H  HB3  . PHE   A 1 278 ? 10.973  18.716  -30.327 0   31.18  ? 968  PHE   A HB3  1 1 
ATOM   4304 H  HD1  . PHE   A 1 278 ? 9.293   20.043  -31.723 0   31.75  ? 968  PHE   A HD1  1 1 
ATOM   4305 H  HD2  . PHE   A 1 278 ? 9.137   15.813  -31.338 0   31.71  ? 968  PHE   A HD2  1 1 
ATOM   4306 H  HE1  . PHE   A 1 278 ? 6.934   20.063  -32.421 0   31.54  ? 968  PHE   A HE1  1 1 
ATOM   4307 H  HE2  . PHE   A 1 278 ? 6.778   15.849  -32.022 0   31.64  ? 968  PHE   A HE2  1 1 
ATOM   4308 H  HZ   . PHE   A 1 278 ? 5.684   17.97   -32.573 0   30.99  ? 968  PHE   A HZ   1 1 
ATOM   4309 N  N    . SER   A 1 279 ? 14.202  18.036  -31.473 1   32.63  ? 969  SER   A N    1 1 
ATOM   4310 C  CA   . SER   A 1 279 ? 15.472  18.626  -31.073 1   33.64  ? 969  SER   A CA   1 1 
ATOM   4311 C  C    . SER   A 1 279 ? 16.058  19.388  -32.262 1   35.21  ? 969  SER   A C    1 1 
ATOM   4312 O  O    . SER   A 1 279 ? 16.568  20.492  -32.085 1   36.3   ? 969  SER   A O    1 1 
ATOM   4313 C  CB   . SER   A 1 279 ? 16.451  17.565  -30.578 1   35.09  ? 969  SER   A CB   1 1 
ATOM   4314 O  OG   . SER   A 1 279 ? 16.002  16.956  -29.377 1   37.08  ? 969  SER   A OG   1 1 
ATOM   4315 H  H    . SER   A 1 279 ? 14.223  17.023  -31.53  0   34.5   ? 969  SER   A H    1 1 
ATOM   4316 H  HA   . SER   A 1 279 ? 15.31   19.332  -30.259 0   36.85  ? 969  SER   A HA   1 1 
ATOM   4317 H  HB2  . SER   A 1 279 ? 16.575  16.802  -31.345 0   39.13  ? 969  SER   A HB2  1 1 
ATOM   4318 H  HB3  . SER   A 1 279 ? 17.404  18.056  -30.385 0   40.16  ? 969  SER   A HB3  1 1 
ATOM   4319 H  HG   . SER   A 1 279 ? 15.11   16.536  -29.492 0   39.69  ? 969  SER   A HG   1 1 
ATOM   4320 N  N    . LYS   A 1 280 ? 15.946  18.84   -33.484 1   35.51  ? 970  LYS   A N    1 1 
ATOM   4321 C  CA   . LYS   A 1 280 ? 16.376  19.531  -34.703 1   36.42  ? 970  LYS   A CA   1 1 
ATOM   4322 C  C    . LYS   A 1 280 ? 15.615  20.864  -34.84  1   36.6   ? 970  LYS   A C    1 1 
ATOM   4323 O  O    . LYS   A 1 280 ? 16.214  21.883  -35.142 1   37.14  ? 970  LYS   A O    1 1 
ATOM   4324 C  CB   . LYS   A 1 280 ? 16.121  18.637  -35.934 1   38.66  ? 970  LYS   A CB   1 1 
ATOM   4325 C  CG   . LYS   A 1 280 ? 16.432  19.31   -37.28  1   43.32  ? 970  LYS   A CG   1 1 
ATOM   4326 C  CD   . LYS   A 1 280 ? 16.041  18.474  -38.512 1   48.74  ? 970  LYS   A CD   1 1 
ATOM   4327 C  CE   . LYS   A 1 280 ? 14.558  18.193  -38.709 1   52.97  ? 970  LYS   A CE   1 1 
ATOM   4328 N  NZ   . LYS   A 1 280 ? 13.68   19.39   -38.537 1   56.36  ? 970  LYS   A NZ   1 1 
ATOM   4329 H  H    . LYS   A 1 280 ? 15.584  17.908  -33.661 0   38.75  ? 970  LYS   A H    1 1 
ATOM   4330 H  HA   . LYS   A 1 280 ? 17.442  19.746  -34.643 0   41.97  ? 970  LYS   A HA   1 1 
ATOM   4331 H  HB2  . LYS   A 1 280 ? 16.747  17.75   -35.855 0   43.12  ? 970  LYS   A HB2  1 1 
ATOM   4332 H  HB3  . LYS   A 1 280 ? 15.072  18.347  -35.917 0   41.62  ? 970  LYS   A HB3  1 1 
ATOM   4333 H  HG2  . LYS   A 1 280 ? 15.912  20.263  -37.364 0   47.62  ? 970  LYS   A HG2  1 1 
ATOM   4334 H  HG3  . LYS   A 1 280 ? 17.507  19.477  -37.336 0   49.05  ? 970  LYS   A HG3  1 1 
ATOM   4335 H  HD2  . LYS   A 1 280 ? 16.388  19.003  -39.399 0   53.38  ? 970  LYS   A HD2  1 1 
ATOM   4336 H  HD3  . LYS   A 1 280 ? 16.542  17.509  -38.447 0   53.2   ? 970  LYS   A HD3  1 1 
ATOM   4337 H  HE2  . LYS   A 1 280 ? 14.408  17.825  -39.723 0   55.55  ? 970  LYS   A HE2  1 1 
ATOM   4338 H  HE3  . LYS   A 1 280 ? 14.233  17.441  -37.991 0   55.21  ? 970  LYS   A HE3  1 1 
ATOM   4339 H  HZ1  . LYS   A 1 280 ? 12.894  19.329  -39.176 0   57.89  ? 970  LYS   A HZ1  1 1 
ATOM   4340 H  HZ2  . LYS   A 1 280 ? 13.316  19.418  -37.59  0   58.06  ? 970  LYS   A HZ2  1 1 
ATOM   4341 H  HZ3  . LYS   A 1 280 ? 14.176  20.256  -38.724 0   59.18  ? 970  LYS   A HZ3  1 1 
ATOM   4342 N  N    . MET   A 1 281 ? 14.314  20.858  -34.525 1   35.89  ? 971  MET   A N    1 1 
ATOM   4343 C  CA   . MET   A 1 281 ? 13.477  22.051  -34.583 1   35.72  ? 971  MET   A CA   1 1 
ATOM   4344 C  C    . MET   A 1 281 ? 13.867  23.068  -33.516 1   35.9   ? 971  MET   A C    1 1 
ATOM   4345 O  O    . MET   A 1 281 ? 13.9    24.257  -33.807 1   35.93  ? 971  MET   A O    1 1 
ATOM   4346 C  CB   . MET   A 1 281 ? 11.99   21.669  -34.46  1   35.72  ? 971  MET   A CB   1 1 
ATOM   4347 C  CG   . MET   A 1 281 ? 11.523  20.827  -35.611 1   36.72  ? 971  MET   A CG   1 1 
ATOM   4348 S  SD   . MET   A 1 281 ? 9.754   20.571  -35.705 1   37.44  ? 971  MET   A SD   1 1 
ATOM   4349 C  CE   . MET   A 1 281 ? 9.643   20.021  -37.368 1   36.05  ? 971  MET   A CE   1 1 
ATOM   4350 H  H    . MET   A 1 281 ? 13.824  20.031  -34.201 0   38.01  ? 971  MET   A H    1 1 
ATOM   4351 H  HA   . MET   A 1 281 ? 13.62   22.519  -35.556 0   38.54  ? 971  MET   A HA   1 1 
ATOM   4352 H  HB2  . MET   A 1 281 ? 11.836  21.106  -33.541 0   36.53  ? 971  MET   A HB2  1 1 
ATOM   4353 H  HB3  . MET   A 1 281 ? 11.391  22.579  -34.443 0   36.72  ? 971  MET   A HB3  1 1 
ATOM   4354 H  HG2  . MET   A 1 281 ? 11.831  21.304  -36.539 0   37.73  ? 971  MET   A HG2  1 1 
ATOM   4355 H  HG3  . MET   A 1 281 ? 11.984  19.843  -35.536 0   37.41  ? 971  MET   A HG3  1 1 
ATOM   4356 H  HE1  . MET   A 1 281 ? 8.601   19.812  -37.606 0   34.97  ? 971  MET   A HE1  1 1 
ATOM   4357 H  HE2  . MET   A 1 281 ? 10.021  20.807  -38.02  0   35.79  ? 971  MET   A HE2  1 1 
ATOM   4358 H  HE3  . MET   A 1 281 ? 10.246  19.124  -37.491 0   35.86  ? 971  MET   A HE3  1 1 
ATOM   4359 N  N    . ALA   A 1 282 ? 14.186  22.614  -32.296 1   36.02  ? 972  ALA   A N    1 1 
ATOM   4360 C  CA   . ALA   A 1 282 ? 14.608  23.503  -31.212 1   36.84  ? 972  ALA   A CA   1 1 
ATOM   4361 C  C    . ALA   A 1 282 ? 15.961  24.203  -31.474 1   37.31  ? 972  ALA   A C    1 1 
ATOM   4362 O  O    . ALA   A 1 282 ? 16.247  25.191  -30.803 1   37.15  ? 972  ALA   A O    1 1 
ATOM   4363 C  CB   . ALA   A 1 282 ? 14.67   22.734  -29.902 1   37.15  ? 972  ALA   A CB   1 1 
ATOM   4364 H  H    . ALA   A 1 282 ? 14.146  21.639  -32.017 0   38.88  ? 972  ALA   A H    1 1 
ATOM   4365 H  HA   . ALA   A 1 282 ? 13.857  24.282  -31.092 0   40.58  ? 972  ALA   A HA   1 1 
ATOM   4366 H  HB1  . ALA   A 1 282 ? 14.986  23.414  -29.111 0   41.54  ? 972  ALA   A HB1  1 1 
ATOM   4367 H  HB2  . ALA   A 1 282 ? 13.681  22.339  -29.679 0   39.89  ? 972  ALA   A HB2  1 1 
ATOM   4368 H  HB3  . ALA   A 1 282 ? 15.386  21.919  -29.996 0   41.27  ? 972  ALA   A HB3  1 1 
ATOM   4369 N  N    . ARG   A 1 283 ? 16.782  23.718  -32.432 1   37.59  ? 973  ARG   A N    1 1 
ATOM   4370 C  CA   . ARG   A 1 283 ? 18.049  24.383  -32.762 1   38.5   ? 973  ARG   A CA   1 1 
ATOM   4371 C  C    . ARG   A 1 283 ? 17.804  25.665  -33.589 1   39.28  ? 973  ARG   A C    1 1 
ATOM   4372 O  O    . ARG   A 1 283 ? 18.599  26.594  -33.503 1   39.55  ? 973  ARG   A O    1 1 
ATOM   4373 C  CB   . ARG   A 1 283 ? 19.017  23.428  -33.485 1   39.62  ? 973  ARG   A CB   1 1 
ATOM   4374 C  CG   . ARG   A 1 283 ? 19.5    22.29   -32.589 1   40.88  ? 973  ARG   A CG   1 1 
ATOM   4375 C  CD   . ARG   A 1 283 ? 20.739  21.584  -33.112 1   42.17  ? 973  ARG   A CD   1 1 
ATOM   4376 N  NE   . ARG   A 1 283 ? 20.477  20.679  -34.237 1   42.9   ? 973  ARG   A NE   1 1 
ATOM   4377 C  CZ   . ARG   A 1 283 ? 19.93   19.465  -34.147 1   43.06  ? 973  ARG   A CZ   1 1 
ATOM   4378 N  NH1  . ARG   A 1 283 ? 19.521  18.993  -32.971 1   41.75  ? 973  ARG   A NH1  1 1 
ATOM   4379 N  NH2  . ARG   A 1 283 ? 19.762  18.724  -35.236 1   42.24  ? 973  ARG   A NH2  1 1 
ATOM   4380 H  H    . ARG   A 1 283 ? 16.598  22.891  -32.991 0   43.3   ? 973  ARG   A H    1 1 
ATOM   4381 H  HA   . ARG   A 1 283 ? 18.535  24.695  -31.838 0   47.2   ? 973  ARG   A HA   1 1 
ATOM   4382 H  HB2  . ARG   A 1 283 ? 18.517  22.991  -34.348 0   47.55  ? 973  ARG   A HB2  1 1 
ATOM   4383 H  HB3  . ARG   A 1 283 ? 19.885  23.999  -33.812 0   49.63  ? 973  ARG   A HB3  1 1 
ATOM   4384 H  HG2  . ARG   A 1 283 ? 19.738  22.69   -31.604 0   50.01  ? 973  ARG   A HG2  1 1 
ATOM   4385 H  HG3  . ARG   A 1 283 ? 18.703  21.553  -32.5   0   48.36  ? 973  ARG   A HG3  1 1 
ATOM   4386 H  HD2  . ARG   A 1 283 ? 21.452  22.332  -33.455 0   53.41  ? 973  ARG   A HD2  1 1 
ATOM   4387 H  HD3  . ARG   A 1 283 ? 21.187  21.009  -32.302 0   52.49  ? 973  ARG   A HD3  1 1 
ATOM   4388 H  HE   . ARG   A 1 283 ? 20.773  20.994  -35.154 0   52.74  ? 973  ARG   A HE   1 1 
ATOM   4389 H  HH11 . ARG   A 1 283 ? 19.632  19.507  -32.103 0   49.65  ? 973  ARG   A HH11 1 1 
ATOM   4390 H  HH12 . ARG   A 1 283 ? 19.104  18.068  -32.93  0   48.72  ? 973  ARG   A HH12 1 1 
ATOM   4391 H  HH21 . ARG   A 1 283 ? 20.053  19.074  -36.143 0   50.72  ? 973  ARG   A HH21 1 1 
ATOM   4392 H  HH22 . ARG   A 1 283 ? 19.33   17.808  -35.171 0   49.55  ? 973  ARG   A HH22 1 1 
ATOM   4393 N  N    . ASP   A 1 284 ? 16.711  25.722  -34.371 1   39.53  ? 974  ASP   A N    1 1 
ATOM   4394 C  CA   . ASP   A 1 284 ? 16.313  26.911  -35.134 1   40.06  ? 974  ASP   A CA   1 1 
ATOM   4395 C  C    . ASP   A 1 284 ? 14.806  27.053  -34.864 1   39.37  ? 974  ASP   A C    1 1 
ATOM   4396 O  O    . ASP   A 1 284 ? 13.997  26.7    -35.719 1   39.5   ? 974  ASP   A O    1 1 
ATOM   4397 C  CB   . ASP   A 1 284 ? 16.618  26.711  -36.634 1   42.51  ? 974  ASP   A CB   1 1 
ATOM   4398 C  CG   . ASP   A 1 284 ? 16.426  27.941  -37.503 1   47.34  ? 974  ASP   A CG   1 1 
ATOM   4399 O  OD1  . ASP   A 1 284 ? 16.054  29.006  -36.958 1   47.95  ? 974  ASP   A OD1  1 1 
ATOM   4400 O  OD2  . ASP   A 1 284 ? 16.648  27.839  -38.731 1   49.78  ? 974  ASP   A OD2  1 1 
ATOM   4401 H  H    . ASP   A 1 284 ? 16.084  24.939  -34.529 0   45.74  ? 974  ASP   A H    1 1 
ATOM   4402 H  HA   . ASP   A 1 284 ? 16.839  27.801  -34.792 0   48.9   ? 974  ASP   A HA   1 1 
ATOM   4403 H  HB2  . ASP   A 1 284 ? 17.663  26.418  -36.727 0   51.36  ? 974  ASP   A HB2  1 1 
ATOM   4404 H  HB3  . ASP   A 1 284 ? 15.993  25.915  -37.034 0   49.29  ? 974  ASP   A HB3  1 1 
ATOM   4405 N  N    . PRO   A 1 285 ? 14.397  27.445  -33.634 1   38.49  ? 975  PRO   A N    1 1 
ATOM   4406 C  CA   . PRO   A 1 285 ? 12.957  27.43   -33.304 1   37.83  ? 975  PRO   A CA   1 1 
ATOM   4407 C  C    . PRO   A 1 285 ? 12.06   28.401  -34.06  1   37.41  ? 975  PRO   A C    1 1 
ATOM   4408 O  O    . PRO   A 1 285 ? 10.874  28.112  -34.216 1   37.32  ? 975  PRO   A O    1 1 
ATOM   4409 C  CB   . PRO   A 1 285 ? 12.942  27.727  -31.802 1   38.57  ? 975  PRO   A CB   1 1 
ATOM   4410 C  CG   . PRO   A 1 285 ? 14.19   28.481  -31.553 1   38.93  ? 975  PRO   A CG   1 1 
ATOM   4411 C  CD   . PRO   A 1 285 ? 15.202  27.864  -32.467 1   37.53  ? 975  PRO   A CD   1 1 
ATOM   4412 H  HA   . PRO   A 1 285 ? 12.561  26.425  -33.446 0   41.63  ? 975  PRO   A HA   1 1 
ATOM   4413 H  HB2  . PRO   A 1 285 ? 12.068  28.326  -31.55  0   43.22  ? 975  PRO   A HB2  1 1 
ATOM   4414 H  HB3  . PRO   A 1 285 ? 12.963  26.793  -31.243 0   42.91  ? 975  PRO   A HB3  1 1 
ATOM   4415 H  HG2  . PRO   A 1 285 ? 14.04   29.532  -31.794 0   46.22  ? 975  PRO   A HG2  1 1 
ATOM   4416 H  HG3  . PRO   A 1 285 ? 14.487  28.352  -30.513 0   45.8   ? 975  PRO   A HG3  1 1 
ATOM   4417 H  HD2  . PRO   A 1 285 ? 15.94   28.617  -32.74  0   45.97  ? 975  PRO   A HD2  1 1 
ATOM   4418 H  HD3  . PRO   A 1 285 ? 15.666  27      -31.996 0   44.6   ? 975  PRO   A HD3  1 1 
ATOM   4419 N  N    . GLN   A 1 286 ? 12.594  29.534  -34.529 1   36.92  ? 976  GLN   A N    1 1 
ATOM   4420 C  CA   . GLN   A 1 286 ? 11.777  30.511  -35.257 1   37.3   ? 976  GLN   A CA   1 1 
ATOM   4421 C  C    . GLN   A 1 286 ? 11.535  30.12   -36.722 1   37.03  ? 976  GLN   A C    1 1 
ATOM   4422 O  O    . GLN   A 1 286 ? 10.643  30.69   -37.356 1   36.94  ? 976  GLN   A O    1 1 
ATOM   4423 C  CB   . GLN   A 1 286 ? 12.362  31.917  -35.108 1   39.55  ? 976  GLN   A CB   1 1 
ATOM   4424 C  CG   . GLN   A 1 286 ? 12.321  32.354  -33.647 1   44.17  ? 976  GLN   A CG   1 1 
ATOM   4425 C  CD   . GLN   A 1 286 ? 12.819  33.74   -33.392 1   50.81  ? 976  GLN   A CD   1 1 
ATOM   4426 O  OE1  . GLN   A 1 286 ? 13.309  34.439  -34.287 1   52.61  ? 976  GLN   A OE1  1 1 
ATOM   4427 N  NE2  . GLN   A 1 286 ? 12.718  34.15   -32.133 1   52.85  ? 976  GLN   A NE2  1 1 
ATOM   4428 H  H    . GLN   A 1 286 ? 13.572  29.793  -34.444 0   43.95  ? 976  GLN   A H    1 1 
ATOM   4429 H  HA   . GLN   A 1 286 ? 10.783  30.531  -34.81  0   42.61  ? 976  GLN   A HA   1 1 
ATOM   4430 H  HB2  . GLN   A 1 286 ? 13.398  31.924  -35.444 0   48.26  ? 976  GLN   A HB2  1 1 
ATOM   4431 H  HB3  . GLN   A 1 286 ? 11.769  32.621  -35.691 0   47.51  ? 976  GLN   A HB3  1 1 
ATOM   4432 H  HG2  . GLN   A 1 286 ? 11.292  32.303  -33.294 0   51.41  ? 976  GLN   A HG2  1 1 
ATOM   4433 H  HG3  . GLN   A 1 286 ? 12.943  31.685  -33.054 0   52.2   ? 976  GLN   A HG3  1 1 
ATOM   4434 H  HE21 . GLN   A 1 286 ? 12.327  33.545  -31.417 0   62.19  ? 976  GLN   A HE21 1 1 
ATOM   4435 H  HE22 . GLN   A 1 286 ? 13.036  35.075  -31.872 0   64.43  ? 976  GLN   A HE22 1 1 
ATOM   4436 N  N    . ARG   A 1 287 ? 12.264  29.119  -37.245 1   36.71  ? 977  ARG   A N    1 1 
ATOM   4437 C  CA   . ARG   A 1 287 ? 11.991  28.572  -38.565 1   37.01  ? 977  ARG   A CA   1 1 
ATOM   4438 C  C    . ARG   A 1 287 ? 10.712  27.705  -38.48  1   36.69  ? 977  ARG   A C    1 1 
ATOM   4439 O  O    . ARG   A 1 287 ? 9.882   27.748  -39.381 1   36.53  ? 977  ARG   A O    1 1 
ATOM   4440 C  CB   . ARG   A 1 287 ? 13.172  27.696  -39.041 1   38.79  ? 977  ARG   A CB   1 1 
ATOM   4441 C  CG   . ARG   A 1 287 ? 12.901  26.952  -40.351 1   42.64  ? 977  ARG   A CG   1 1 
ATOM   4442 C  CD   . ARG   A 1 287 ? 14.125  26.269  -40.911 1   46.41  ? 977  ARG   A CD   1 1 
ATOM   4443 N  NE   . ARG   A 1 287 ? 13.788  25.465  -42.088 1   50.36  ? 977  ARG   A NE   1 1 
ATOM   4444 C  CZ   . ARG   A 1 287 ? 14.671  24.866  -42.887 1   53.15  ? 977  ARG   A CZ   1 1 
ATOM   4445 N  NH1  . ARG   A 1 287 ? 14.256  24.156  -43.93  1   53     ? 977  ARG   A NH1  1 1 
ATOM   4446 N  NH2  . ARG   A 1 287 ? 15.975  24.969  -42.647 1   52.8   ? 977  ARG   A NH2  1 1 
ATOM   4447 H  H    . ARG   A 1 287 ? 13.062  28.682  -36.795 0   42.5   ? 977  ARG   A H    1 1 
ATOM   4448 H  HA   . ARG   A 1 287 ? 11.834  29.373  -39.286 0   42.44  ? 977  ARG   A HA   1 1 
ATOM   4449 H  HB2  . ARG   A 1 287 ? 14.045  28.33   -39.189 0   45.35  ? 977  ARG   A HB2  1 1 
ATOM   4450 H  HB3  . ARG   A 1 287 ? 13.384  26.945  -38.282 0   43.81  ? 977  ARG   A HB3  1 1 
ATOM   4451 H  HG2  . ARG   A 1 287 ? 12.154  26.177  -40.186 0   46.27  ? 977  ARG   A HG2  1 1 
ATOM   4452 H  HG3  . ARG   A 1 287 ? 12.539  27.661  -41.094 0   47.56  ? 977  ARG   A HG3  1 1 
ATOM   4453 H  HD2  . ARG   A 1 287 ? 14.855  27.022  -41.202 0   53.05  ? 977  ARG   A HD2  1 1 
ATOM   4454 H  HD3  . ARG   A 1 287 ? 14.548  25.608  -40.156 0   51.84  ? 977  ARG   A HD3  1 1 
ATOM   4455 H  HE   . ARG   A 1 287 ? 12.803  25.363  -42.311 0   54.29  ? 977  ARG   A HE   1 1 
ATOM   4456 H  HH11 . ARG   A 1 287 ? 13.265  24.072  -44.132 0   56.93  ? 977  ARG   A HH11 1 1 
ATOM   4457 H  HH12 . ARG   A 1 287 ? 14.929  23.703  -44.54  0   58.35  ? 977  ARG   A HH12 1 1 
ATOM   4458 H  HH21 . ARG   A 1 287 ? 16.349  25.492  -41.863 0   60.07  ? 977  ARG   A HH21 1 1 
ATOM   4459 H  HH22 . ARG   A 1 287 ? 16.628  24.501  -43.269 0   60.08  ? 977  ARG   A HH22 1 1 
ATOM   4460 N  N    . TYR   A 1 288 ? 10.575  26.909  -37.405 1   36.37  ? 978  TYR   A N    1 1 
ATOM   4461 C  CA   . TYR   A 1 288 ? 9.489   25.948  -37.267 1   36.4   ? 978  TYR   A CA   1 1 
ATOM   4462 C  C    . TYR   A 1 288 ? 8.215   26.46   -36.58  1   37.05  ? 978  TYR   A C    1 1 
ATOM   4463 O  O    . TYR   A 1 288 ? 7.182   25.837  -36.785 1   37.08  ? 978  TYR   A O    1 1 
ATOM   4464 C  CB   . TYR   A 1 288 ? 10.008  24.683  -36.567 1   35.85  ? 978  TYR   A CB   1 1 
ATOM   4465 C  CG   . TYR   A 1 288 ? 11.065  23.982  -37.392 1   36.27  ? 978  TYR   A CG   1 1 
ATOM   4466 C  CD1  . TYR   A 1 288 ? 10.713  23.178  -38.464 1   36.92  ? 978  TYR   A CD1  1 1 
ATOM   4467 C  CD2  . TYR   A 1 288 ? 12.414  24.238  -37.194 1   37.1   ? 978  TYR   A CD2  1 1 
ATOM   4468 C  CE1  . TYR   A 1 288 ? 11.675  22.555  -39.246 1   37.53  ? 978  TYR   A CE1  1 1 
ATOM   4469 C  CE2  . TYR   A 1 288 ? 13.388  23.64   -37.983 1   37.96  ? 978  TYR   A CE2  1 1 
ATOM   4470 C  CZ   . TYR   A 1 288 ? 13.015  22.795  -39.008 1   38.54  ? 978  TYR   A CZ   1 1 
ATOM   4471 O  OH   . TYR   A 1 288 ? 13.974  22.203  -39.791 1   38.99  ? 978  TYR   A OH   1 1 
ATOM   4472 H  H    . TYR   A 1 288 ? 11.212  26.899  -36.616 0   39.49  ? 978  TYR   A H    1 1 
ATOM   4473 H  HA   . TYR   A 1 288 ? 9.17    25.653  -38.266 0   37.51  ? 978  TYR   A HA   1 1 
ATOM   4474 H  HB2  . TYR   A 1 288 ? 10.439  24.947  -35.603 0   37.26  ? 978  TYR   A HB2  1 1 
ATOM   4475 H  HB3  . TYR   A 1 288 ? 9.178   23.993  -36.424 0   36.03  ? 978  TYR   A HB3  1 1 
ATOM   4476 H  HD1  . TYR   A 1 288 ? 9.671   22.98   -38.65  0   37.14  ? 978  TYR   A HD1  1 1 
ATOM   4477 H  HD2  . TYR   A 1 288 ? 12.714  24.886  -36.388 0   40.26  ? 978  TYR   A HD2  1 1 
ATOM   4478 H  HE1  . TYR   A 1 288 ? 11.367  21.912  -40.054 0   38.63  ? 978  TYR   A HE1  1 1 
ATOM   4479 H  HE2  . TYR   A 1 288 ? 14.431  23.821  -37.784 0   42.17  ? 978  TYR   A HE2  1 1 
ATOM   4480 H  HH   . TYR   A 1 288 ? 13.606  21.4    -40.245 0   41.73  ? 978  TYR   A HH   1 1 
ATOM   4481 N  N    . LEU   A 1 289 ? 8.247   27.558  -35.809 1   37.49  ? 979  LEU   A N    1 1 
ATOM   4482 C  CA   . LEU   A 1 289 ? 7.028   28.111  -35.208 1   38.49  ? 979  LEU   A CA   1 1 
ATOM   4483 C  C    . LEU   A 1 289 ? 7.029   29.623  -35.395 1   40.06  ? 979  LEU   A C    1 1 
ATOM   4484 O  O    . LEU   A 1 289 ? 7.994   30.282  -35.01  1   40.49  ? 979  LEU   A O    1 1 
ATOM   4485 C  CB   . LEU   A 1 289 ? 6.913   27.78   -33.711 1   38.29  ? 979  LEU   A CB   1 1 
ATOM   4486 C  CG   . LEU   A 1 289 ? 6.849   26.306  -33.284 1   39.01  ? 979  LEU   A CG   1 1 
ATOM   4487 C  CD1  . LEU   A 1 289 ? 6.901   26.191  -31.783 1   39.19  ? 979  LEU   A CD1  1 1 
ATOM   4488 C  CD2  . LEU   A 1 289 ? 5.598   25.621  -33.787 1   39.28  ? 979  LEU   A CD2  1 1 
ATOM   4489 H  H    . LEU   A 1 289 ? 9.085   28.079  -35.571 0   39.85  ? 979  LEU   A H    1 1 
ATOM   4490 H  HA   . LEU   A 1 289 ? 6.147   27.728  -35.72  0   38.97  ? 979  LEU   A HA   1 1 
ATOM   4491 H  HB2  . LEU   A 1 289 ? 7.79    28.203  -33.227 0   39.94  ? 979  LEU   A HB2  1 1 
ATOM   4492 H  HB3  . LEU   A 1 289 ? 6.02    28.269  -33.324 0   39.1   ? 979  LEU   A HB3  1 1 
ATOM   4493 H  HG   . LEU   A 1 289 ? 7.71    25.776  -33.69  0   39.16  ? 979  LEU   A HG   1 1 
ATOM   4494 H  HD11 . LEU   A 1 289 ? 6.822   25.142  -31.502 0   38.59  ? 979  LEU   A HD11 1 1 
ATOM   4495 H  HD12 . LEU   A 1 289 ? 7.855   26.589  -31.443 0   39.9   ? 979  LEU   A HD12 1 1 
ATOM   4496 H  HD13 . LEU   A 1 289 ? 6.078   26.758  -31.349 0   39.1   ? 979  LEU   A HD13 1 1 
ATOM   4497 H  HD21 . LEU   A 1 289 ? 5.58    24.602  -33.401 0   37.83  ? 979  LEU   A HD21 1 1 
ATOM   4498 H  HD22 . LEU   A 1 289 ? 4.72    26.165  -33.442 0   38.27  ? 979  LEU   A HD22 1 1 
ATOM   4499 H  HD23 . LEU   A 1 289 ? 5.628   25.587  -34.874 0   38.37  ? 979  LEU   A HD23 1 1 
ATOM   4500 N  N    . VAL   A 1 290 ? 5.957   30.169  -35.982 1   40.77  ? 980  VAL   A N    1 1 
ATOM   4501 C  CA   . VAL   A 1 290 ? 5.83    31.603  -36.23  1   41.97  ? 980  VAL   A CA   1 1 
ATOM   4502 C  C    . VAL   A 1 290 ? 4.993   32.207  -35.098 1   42.98  ? 980  VAL   A C    1 1 
ATOM   4503 O  O    . VAL   A 1 290 ? 3.771   32.06   -35.097 1   42.8   ? 980  VAL   A O    1 1 
ATOM   4504 C  CB   . VAL   A 1 290 ? 5.211   31.878  -37.626 1   42.73  ? 980  VAL   A CB   1 1 
ATOM   4505 C  CG1  . VAL   A 1 290 ? 5.099   33.377  -37.896 1   43.28  ? 980  VAL   A CG1  1 1 
ATOM   4506 C  CG2  . VAL   A 1 290 ? 6.033   31.211  -38.729 1   43.2   ? 980  VAL   A CG2  1 1 
ATOM   4507 H  H    . VAL   A 1 290 ? 5.142   29.643  -36.282 0   42.16  ? 980  VAL   A H    1 1 
ATOM   4508 H  HA   . VAL   A 1 290 ? 6.811   32.076  -36.222 0   46.08  ? 980  VAL   A HA   1 1 
ATOM   4509 H  HB   . VAL   A 1 290 ? 4.209   31.455  -37.662 0   45.19  ? 980  VAL   A HB   1 1 
ATOM   4510 H  HG11 . VAL   A 1 290 ? 4.691   33.518  -38.896 0   47.8   ? 980  VAL   A HG11 1 1 
ATOM   4511 H  HG12 . VAL   A 1 290 ? 4.441   33.847  -37.168 0   47.94  ? 980  VAL   A HG12 1 1 
ATOM   4512 H  HG13 . VAL   A 1 290 ? 6.093   33.817  -37.84  0   48.68  ? 980  VAL   A HG13 1 1 
ATOM   4513 H  HG21 . VAL   A 1 290 ? 5.58    31.448  -39.69  0   46.29  ? 980  VAL   A HG21 1 1 
ATOM   4514 H  HG22 . VAL   A 1 290 ? 7.05    31.6    -38.696 0   47.12  ? 980  VAL   A HG22 1 1 
ATOM   4515 H  HG23 . VAL   A 1 290 ? 6.041   30.131  -38.589 0   45.45  ? 980  VAL   A HG23 1 1 
ATOM   4516 N  N    . ILE   A 1 291 ? 5.662   32.851  -34.116 1   43.76  ? 981  ILE   A N    1 1 
ATOM   4517 C  CA   . ILE   A 1 291 ? 5.005   33.483  -32.967 1   45.08  ? 981  ILE   A CA   1 1 
ATOM   4518 C  C    . ILE   A 1 291 ? 5.298   34.997  -32.998 1   46.73  ? 981  ILE   A C    1 1 
ATOM   4519 O  O    . ILE   A 1 291 ? 6.448   35.399  -33.167 1   46.66  ? 981  ILE   A O    1 1 
ATOM   4520 C  CB   . ILE   A 1 291 ? 5.428   32.802  -31.621 1   45.25  ? 981  ILE   A CB   1 1 
ATOM   4521 C  CG1  . ILE   A 1 291 ? 5.036   31.29   -31.643 1   45.71  ? 981  ILE   A CG1  1 1 
ATOM   4522 C  CG2  . ILE   A 1 291 ? 4.769   33.521  -30.417 1   45.75  ? 981  ILE   A CG2  1 1 
ATOM   4523 C  CD1  . ILE   A 1 291 ? 5.546   30.385  -30.498 1   46.51  ? 981  ILE   A CD1  1 1 
ATOM   4524 H  H    . ILE   A 1 291 ? 6.673   32.94   -34.087 0   48.57  ? 981  ILE   A H    1 1 
ATOM   4525 H  HA   . ILE   A 1 291 ? 3.927   33.358  -33.051 0   49.1   ? 981  ILE   A HA   1 1 
ATOM   4526 H  HB   . ILE   A 1 291 ? 6.509   32.878  -31.519 0   50.02  ? 981  ILE   A HB   1 1 
ATOM   4527 H  HG12 . ILE   A 1 291 ? 3.95    31.222  -31.647 0   47.92  ? 981  ILE   A HG12 1 1 
ATOM   4528 H  HG13 . ILE   A 1 291 ? 5.426   30.841  -32.555 0   48.17  ? 981  ILE   A HG13 1 1 
ATOM   4529 H  HG21 . ILE   A 1 291 ? 5.077   33.051  -29.485 0   50.05  ? 981  ILE   A HG21 1 1 
ATOM   4530 H  HG22 . ILE   A 1 291 ? 5.065   34.569  -30.392 0   51.49  ? 981  ILE   A HG22 1 1 
ATOM   4531 H  HG23 . ILE   A 1 291 ? 3.688   33.45   -30.521 0   49.86  ? 981  ILE   A HG23 1 1 
ATOM   4532 H  HD11 . ILE   A 1 291 ? 5.221   29.365  -30.696 0   47.79  ? 981  ILE   A HD11 1 1 
ATOM   4533 H  HD12 . ILE   A 1 291 ? 6.634   30.422  -30.469 0   49.23  ? 981  ILE   A HD12 1 1 
ATOM   4534 H  HD13 . ILE   A 1 291 ? 5.135   30.715  -29.544 0   48.9   ? 981  ILE   A HD13 1 1 
ATOM   4535 N  N    . GLN   A 1 292 ? 4.246   35.828  -32.863 1   47.96  ? 982  GLN   A N    1 1 
ATOM   4536 C  CA   . GLN   A 1 292 ? 4.38    37.285  -32.873 1   49.59  ? 982  GLN   A CA   1 1 
ATOM   4537 C  C    . GLN   A 1 292 ? 5.103   37.739  -31.615 1   50.95  ? 982  GLN   A C    1 1 
ATOM   4538 O  O    . GLN   A 1 292 ? 4.682   37.379  -30.518 1   51.13  ? 982  GLN   A O    1 1 
ATOM   4539 C  CB   . GLN   A 1 292 ? 2.997   37.96   -32.924 1   51.46  ? 982  GLN   A CB   1 1 
ATOM   4540 C  CG   . GLN   A 1 292 ? 2.323   37.907  -34.293 1   55.46  ? 982  GLN   A CG   1 1 
ATOM   4541 C  CD   . GLN   A 1 292 ? 2.721   39.072  -35.177 1   60.76  ? 982  GLN   A CD   1 1 
ATOM   4542 O  OE1  . GLN   A 1 292 ? 2.502   40.245  -34.84  1   62.44  ? 982  GLN   A OE1  1 1 
ATOM   4543 N  NE2  . GLN   A 1 292 ? 3.297   38.789  -36.341 1   61.63  ? 982  GLN   A NE2  1 1 
ATOM   4544 H  H    . GLN   A 1 292 ? 3.293   35.505  -32.731 0   53.89  ? 982  GLN   A H    1 1 
ATOM   4545 H  HA   . GLN   A 1 292 ? 4.952   37.59   -33.747 0   58.43  ? 982  GLN   A HA   1 1 
ATOM   4546 H  HB2  . GLN   A 1 292 ? 2.332   37.479  -32.208 0   59.32  ? 982  GLN   A HB2  1 1 
ATOM   4547 H  HB3  . GLN   A 1 292 ? 3.119   39.005  -32.645 0   61.36  ? 982  GLN   A HB3  1 1 
ATOM   4548 H  HG2  . GLN   A 1 292 ? 2.587   36.971  -34.782 0   62.71  ? 982  GLN   A HG2  1 1 
ATOM   4549 H  HG3  . GLN   A 1 292 ? 1.244   37.955  -34.149 0   63.44  ? 982  GLN   A HG3  1 1 
ATOM   4550 H  HE21 . GLN   A 1 292 ? 3.453   37.828  -36.628 0   70.12  ? 982  GLN   A HE21 1 1 
ATOM   4551 H  HE22 . GLN   A 1 292 ? 3.571   39.547  -36.958 0   72.26  ? 982  GLN   A HE22 1 1 
ATOM   4552 N  N    . GLY   A 1 293 ? 6.167   38.522  -31.78  1   51.71  ? 983  GLY   A N    1 1 
ATOM   4553 C  CA   . GLY   A 1 293 ? 6.956   39.025  -30.663 1   53.16  ? 983  GLY   A CA   1 1 
ATOM   4554 C  C    . GLY   A 1 293 ? 7.749   37.951  -29.945 1   54.69  ? 983  GLY   A C    1 1 
ATOM   4555 O  O    . GLY   A 1 293 ? 7.976   38.056  -28.739 1   54.84  ? 983  GLY   A O    1 1 
ATOM   4556 H  H    . GLY   A 1 293 ? 6.511   38.836  -32.681 0   62.91  ? 983  GLY   A H    1 1 
ATOM   4557 H  HA2  . GLY   A 1 293 ? 7.655   39.776  -31.028 0   66.32  ? 983  GLY   A HA2  1 1 
ATOM   4558 H  HA3  . GLY   A 1 293 ? 6.294   39.501  -29.942 0   65.27  ? 983  GLY   A HA3  1 1 
ATOM   4559 N  N    . ASP   A 1 294 ? 8.221   36.942  -30.688 1   55.63  ? 984  ASP   A N    1 1 
ATOM   4560 C  CA   . ASP   A 1 294 ? 8.955   35.804  -30.134 1   56.98  ? 984  ASP   A CA   1 1 
ATOM   4561 C  C    . ASP   A 1 294 ? 10.329  36.184  -29.567 1   58.62  ? 984  ASP   A C    1 1 
ATOM   4562 O  O    . ASP   A 1 294 ? 10.709  35.653  -28.525 1   58.7   ? 984  ASP   A O    1 1 
ATOM   4563 C  CB   . ASP   A 1 294 ? 9.104   34.715  -31.213 1   58.07  ? 984  ASP   A CB   1 1 
ATOM   4564 C  CG   . ASP   A 1 294 ? 9.432   33.327  -30.704 1   61.07  ? 984  ASP   A CG   1 1 
ATOM   4565 O  OD1  . ASP   A 1 294 ? 9.598   33.165  -29.479 1   61.5   ? 984  ASP   A OD1  1 1 
ATOM   4566 O  OD2  . ASP   A 1 294 ? 9.511   32.4    -31.533 1   62.73  ? 984  ASP   A OD2  1 1 
ATOM   4567 H  H    . ASP   A 1 294 ? 8.14    36.908  -31.699 0   65.46  ? 984  ASP   A H    1 1 
ATOM   4568 H  HA   . ASP   A 1 294 ? 8.364   35.396  -29.315 0   65.48  ? 984  ASP   A HA   1 1 
ATOM   4569 H  HB2  . ASP   A 1 294 ? 8.164   34.633  -31.756 0   65.49  ? 984  ASP   A HB2  1 1 
ATOM   4570 H  HB3  . ASP   A 1 294 ? 9.895   35.012  -31.899 0   67     ? 984  ASP   A HB3  1 1 
ATOM   4571 N  N    . GLU   A 1 295 ? 11.073  37.087  -30.234 1   59.73  ? 985  GLU   A N    1 1 
ATOM   4572 C  CA   . GLU   A 1 295 ? 12.395  37.517  -29.75  1   61.23  ? 985  GLU   A CA   1 1 
ATOM   4573 C  C    . GLU   A 1 295 ? 12.337  38.337  -28.441 1   62.56  ? 985  GLU   A C    1 1 
ATOM   4574 O  O    . GLU   A 1 295 ? 13.371  38.498  -27.793 1   62.76  ? 985  GLU   A O    1 1 
ATOM   4575 C  CB   . GLU   A 1 295 ? 13.135  38.343  -30.828 1   63.53  ? 985  GLU   A CB   1 1 
ATOM   4576 C  CG   . GLU   A 1 295 ? 13.654  37.52   -31.994 1   68.89  ? 985  GLU   A CG   1 1 
ATOM   4577 C  CD   . GLU   A 1 295 ? 14.46   38.268  -33.036 1   75.73  ? 985  GLU   A CD   1 1 
ATOM   4578 O  OE1  . GLU   A 1 295 ? 14.99   39.358  -32.719 1   77.43  ? 985  GLU   A OE1  1 1 
ATOM   4579 O  OE2  . GLU   A 1 295 ? 14.574  37.752  -34.172 1   77.8   ? 985  GLU   A OE2  1 1 
ATOM   4580 H  H    . GLU   A 1 295 ? 10.784  37.532  -31.099 0   72.24  ? 985  GLU   A H    1 1 
ATOM   4581 H  HA   . GLU   A 1 295 ? 12.992  36.631  -29.54  0   74.55  ? 985  GLU   A HA   1 1 
ATOM   4582 H  HB2  . GLU   A 1 295 ? 12.466  39.106  -31.224 0   79.45  ? 985  GLU   A HB2  1 1 
ATOM   4583 H  HB3  . GLU   A 1 295 ? 13.992  38.825  -30.359 0   80.59  ? 985  GLU   A HB3  1 1 
ATOM   4584 H  HG2  . GLU   A 1 295 ? 14.301  36.741  -31.593 0   83.5   ? 985  GLU   A HG2  1 1 
ATOM   4585 H  HG3  . GLU   A 1 295 ? 12.801  37.078  -32.507 0   82.49  ? 985  GLU   A HG3  1 1 
ATOM   4586 N  N    . ARG   A 1 296 ? 11.147  38.829  -28.045 1   63.24  ? 986  ARG   A N    1 1 
ATOM   4587 C  CA   . ARG   A 1 296 ? 10.969  39.655  -26.849 1   64.47  ? 986  ARG   A CA   1 1 
ATOM   4588 C  C    . ARG   A 1 296 ? 9.996   39.003  -25.845 1   65.03  ? 986  ARG   A C    1 1 
ATOM   4589 O  O    . ARG   A 1 296 ? 9.138   39.68   -25.276 1   65.35  ? 986  ARG   A O    1 1 
ATOM   4590 C  CB   . ARG   A 1 296 ? 10.537  41.091  -27.242 1   66.65  ? 986  ARG   A CB   1 1 
ATOM   4591 C  CG   . ARG   A 1 296 ? 9.304   41.199  -28.147 1   71.02  ? 986  ARG   A CG   1 1 
ATOM   4592 C  CD   . ARG   A 1 296 ? 9.109   42.608  -28.676 1   75.36  ? 986  ARG   A CD   1 1 
ATOM   4593 N  NE   . ARG   A 1 296 ? 7.965   42.702  -29.591 1   79.25  ? 986  ARG   A NE   1 1 
ATOM   4594 C  CZ   . ARG   A 1 296 ? 7.966   42.368  -30.883 1   82.02  ? 986  ARG   A CZ   1 1 
ATOM   4595 N  NH1  . ARG   A 1 296 ? 6.861   42.494  -31.608 1   81.61  ? 986  ARG   A NH1  1 1 
ATOM   4596 N  NH2  . ARG   A 1 296 ? 9.067   41.888  -31.458 1   82.28  ? 986  ARG   A NH2  1 1 
ATOM   4597 H  H    . ARG   A 1 296 ? 10.269  38.617  -28.509 0   76.93  ? 986  ARG   A H    1 1 
ATOM   4598 H  HA   . ARG   A 1 296 ? 11.92   39.756  -26.328 0   81.16  ? 986  ARG   A HA   1 1 
ATOM   4599 H  HB2  . ARG   A 1 296 ? 10.34   41.667  -26.339 0   84.74  ? 986  ARG   A HB2  1 1 
ATOM   4600 H  HB3  . ARG   A 1 296 ? 11.366  41.552  -27.777 0   85.3   ? 986  ARG   A HB3  1 1 
ATOM   4601 H  HG2  . ARG   A 1 296 ? 9.421   40.544  -29.009 0   86.51  ? 986  ARG   A HG2  1 1 
ATOM   4602 H  HG3  . ARG   A 1 296 ? 8.416   40.92   -27.582 0   86.47  ? 986  ARG   A HG3  1 1 
ATOM   4603 H  HD2  . ARG   A 1 296 ? 8.901   43.262  -27.831 0   94.68  ? 986  ARG   A HD2  1 1 
ATOM   4604 H  HD3  . ARG   A 1 296 ? 10.014  42.948  -29.178 0   94.79  ? 986  ARG   A HD3  1 1 
ATOM   4605 H  HE   . ARG   A 1 296 ? 7.1     43.059  -29.199 0   96.84  ? 986  ARG   A HE   1 1 
ATOM   4606 H  HH11 . ARG   A 1 296 ? 6.012   42.858  -31.185 0   98.1   ? 986  ARG   A HH11 1 1 
ATOM   4607 H  HH12 . ARG   A 1 296 ? 6.86    42.24   -32.59  0   97.61  ? 986  ARG   A HH12 1 1 
ATOM   4608 H  HH21 . ARG   A 1 296 ? 9.943   41.759  -30.962 0   99.78  ? 986  ARG   A HH21 1 1 
ATOM   4609 H  HH22 . ARG   A 1 296 ? 9.036   41.639  -32.441 0   98.85  ? 986  ARG   A HH22 1 1 
ATOM   4610 N  N    . MET   A 1 297 ? 10.17   37.687  -25.603 1   64.85  ? 987  MET   A N    1 1 
ATOM   4611 C  CA   . MET   A 1 297 ? 9.373   36.914  -24.648 1   65.1   ? 987  MET   A CA   1 1 
ATOM   4612 C  C    . MET   A 1 297 ? 10.32   36.279  -23.64  1   65.49  ? 987  MET   A C    1 1 
ATOM   4613 O  O    . MET   A 1 297 ? 11.363  35.758  -24.031 1   65.8   ? 987  MET   A O    1 1 
ATOM   4614 C  CB   . MET   A 1 297 ? 8.582   35.815  -25.366 1   65.41  ? 987  MET   A CB   1 1 
ATOM   4615 C  CG   . MET   A 1 297 ? 7.381   36.326  -26.105 1   66.75  ? 987  MET   A CG   1 1 
ATOM   4616 S  SD   . MET   A 1 297 ? 6.486   35.003  -26.92  1   67.56  ? 987  MET   A SD   1 1 
ATOM   4617 C  CE   . MET   A 1 297 ? 5.054   35.879  -27.446 1   66.54  ? 987  MET   A CE   1 1 
ATOM   4618 H  H    . MET   A 1 297 ? 10.882  37.121  -26.054 0   77.39  ? 987  MET   A H    1 1 
ATOM   4619 H  HA   . MET   A 1 297 ? 8.677   37.562  -24.118 0   76.8   ? 987  MET   A HA   1 1 
ATOM   4620 H  HB2  . MET   A 1 297 ? 9.235   35.328  -26.089 0   74.64  ? 987  MET   A HB2  1 1 
ATOM   4621 H  HB3  . MET   A 1 297 ? 8.24    35.089  -24.63  0   73.92  ? 987  MET   A HB3  1 1 
ATOM   4622 H  HG2  . MET   A 1 297 ? 6.707   36.824  -25.41  0   76.26  ? 987  MET   A HG2  1 1 
ATOM   4623 H  HG3  . MET   A 1 297 ? 7.71    37.027  -26.871 0   76.9   ? 987  MET   A HG3  1 1 
ATOM   4624 H  HE1  . MET   A 1 297 ? 4.388   35.193  -27.966 0   72.86  ? 987  MET   A HE1  1 1 
ATOM   4625 H  HE2  . MET   A 1 297 ? 4.555   36.293  -26.571 0   74.26  ? 987  MET   A HE2  1 1 
ATOM   4626 H  HE3  . MET   A 1 297 ? 5.357   36.684  -28.114 0   74.89  ? 987  MET   A HE3  1 1 
ATOM   4627 N  N    . HIS   A 1 298 ? 9.964   36.315  -22.349 1   65.31  ? 988  HIS   A N    1 1 
ATOM   4628 C  CA   . HIS   A 1 298 ? 10.821  35.777  -21.297 1   65.57  ? 988  HIS   A CA   1 1 
ATOM   4629 C  C    . HIS   A 1 298 ? 10.006  35.074  -20.212 1   65.38  ? 988  HIS   A C    1 1 
ATOM   4630 O  O    . HIS   A 1 298 ? 8.906   35.515  -19.883 1   65.27  ? 988  HIS   A O    1 1 
ATOM   4631 C  CB   . HIS   A 1 298 ? 11.649  36.926  -20.68  1   66.48  ? 988  HIS   A CB   1 1 
ATOM   4632 C  CG   . HIS   A 1 298 ? 12.504  36.514  -19.521 1   68.82  ? 988  HIS   A CG   1 1 
ATOM   4633 N  ND1  . HIS   A 1 298 ? 12.051  36.624  -18.217 1   70.69  ? 988  HIS   A ND1  1 1 
ATOM   4634 C  CD2  . HIS   A 1 298 ? 13.755  36      -19.508 1   69.94  ? 988  HIS   A CD2  1 1 
ATOM   4635 C  CE1  . HIS   A 1 298 ? 13.037  36.177  -17.454 1   71.19  ? 988  HIS   A CE1  1 1 
ATOM   4636 N  NE2  . HIS   A 1 298 ? 14.083  35.793  -18.187 1   71.09  ? 988  HIS   A NE2  1 1 
ATOM   4637 H  H    . HIS   A 1 298 ? 9.096   36.711  -22.003 0   76.59  ? 988  HIS   A H    1 1 
ATOM   4638 H  HA   . HIS   A 1 298 ? 11.517  35.049  -21.711 0   76.75  ? 988  HIS   A HA   1 1 
ATOM   4639 H  HB2  . HIS   A 1 298 ? 12.305  37.333  -21.448 0   81.09  ? 988  HIS   A HB2  1 1 
ATOM   4640 H  HB3  . HIS   A 1 298 ? 10.969  37.701  -20.33  0   80.63  ? 988  HIS   A HB3  1 1 
ATOM   4641 H  HD2  . HIS   A 1 298 ? 14.375  35.796  -20.364 0   84.77  ? 988  HIS   A HD2  1 1 
ATOM   4642 H  HE1  . HIS   A 1 298 ? 12.997  36.135  -16.379 0   85.91  ? 988  HIS   A HE1  1 1 
ATOM   4643 H  HE2  . HIS   A 1 298 ? 14.96   35.422  -17.837 0   86.52  ? 988  HIS   A HE2  1 1 
ATOM   4644 N  N    . LEU   A 1 299 ? 10.565  33.988  -19.65  1   65.21  ? 989  LEU   A N    1 1 
ATOM   4645 C  CA   . LEU   A 1 299 ? 9.965   33.232  -18.549 1   65.76  ? 989  LEU   A CA   1 1 
ATOM   4646 C  C    . LEU   A 1 299 ? 11.065  32.984  -17.485 1   66.18  ? 989  LEU   A C    1 1 
ATOM   4647 O  O    . LEU   A 1 299 ? 12.219  32.782  -17.875 1   66.1   ? 989  LEU   A O    1 1 
ATOM   4648 C  CB   . LEU   A 1 299 ? 9.374   31.891  -19.043 1   65.95  ? 989  LEU   A CB   1 1 
ATOM   4649 C  CG   . LEU   A 1 299 ? 8.236   31.961  -20.083 1   67.43  ? 989  LEU   A CG   1 1 
ATOM   4650 C  CD1  . LEU   A 1 299 ? 7.981   30.604  -20.69  1   67.91  ? 989  LEU   A CD1  1 1 
ATOM   4651 C  CD2  . LEU   A 1 299 ? 6.93    32.482  -19.479 1   68.2   ? 989  LEU   A CD2  1 1 
ATOM   4652 H  H    . LEU   A 1 299 ? 11.456  33.601  -19.944 0   75.13  ? 989  LEU   A H    1 1 
ATOM   4653 H  HA   . LEU   A 1 299 ? 9.164   33.83   -18.12  0   74.54  ? 989  LEU   A HA   1 1 
ATOM   4654 H  HB2  . LEU   A 1 299 ? 10.185  31.316  -19.488 0   72.78  ? 989  LEU   A HB2  1 1 
ATOM   4655 H  HB3  . LEU   A 1 299 ? 8.985   31.354  -18.178 0   72.27  ? 989  LEU   A HB3  1 1 
ATOM   4656 H  HG   . LEU   A 1 299 ? 8.524   32.634  -20.89  0   74.21  ? 989  LEU   A HG   1 1 
ATOM   4657 H  HD11 . LEU   A 1 299 ? 7.168   30.685  -21.41  0   72.05  ? 989  LEU   A HD11 1 1 
ATOM   4658 H  HD12 . LEU   A 1 299 ? 8.887   30.266  -21.191 0   72.7   ? 989  LEU   A HD12 1 1 
ATOM   4659 H  HD13 . LEU   A 1 299 ? 7.708   29.905  -19.901 0   71.93  ? 989  LEU   A HD13 1 1 
ATOM   4660 H  HD21 . LEU   A 1 299 ? 6.163   32.485  -20.253 0   73.65  ? 989  LEU   A HD21 1 1 
ATOM   4661 H  HD22 . LEU   A 1 299 ? 6.624   31.832  -18.662 0   73.52  ? 989  LEU   A HD22 1 1 
ATOM   4662 H  HD23 . LEU   A 1 299 ? 7.072   33.496  -19.109 0   75.27  ? 989  LEU   A HD23 1 1 
ATOM   4663 N  N    . PRO   A 1 300 ? 10.773  33.002  -16.156 1   66.51  ? 990  PRO   A N    1 1 
ATOM   4664 C  CA   . PRO   A 1 300 ? 11.86   32.805  -15.17  1   66.87  ? 990  PRO   A CA   1 1 
ATOM   4665 C  C    . PRO   A 1 300 ? 12.673  31.523  -15.343 1   67.38  ? 990  PRO   A C    1 1 
ATOM   4666 O  O    . PRO   A 1 300 ? 12.12   30.508  -15.743 1   67.45  ? 990  PRO   A O    1 1 
ATOM   4667 C  CB   . PRO   A 1 300 ? 11.131  32.811  -13.824 1   67.54  ? 990  PRO   A CB   1 1 
ATOM   4668 C  CG   . PRO   A 1 300 ? 9.864   33.517  -14.073 1   67.92  ? 990  PRO   A CG   1 1 
ATOM   4669 C  CD   . PRO   A 1 300 ? 9.478   33.239  -15.481 1   66.15  ? 990  PRO   A CD   1 1 
ATOM   4670 H  HA   . PRO   A 1 300 ? 12.534  33.66   -15.196 0   78.64  ? 990  PRO   A HA   1 1 
ATOM   4671 H  HB2  . PRO   A 1 300 ? 10.948  31.789  -13.494 0   76.63  ? 990  PRO   A HB2  1 1 
ATOM   4672 H  HB3  . PRO   A 1 300 ? 11.73   33.355  -13.096 0   78.83  ? 990  PRO   A HB3  1 1 
ATOM   4673 H  HG2  . PRO   A 1 300 ? 9.105   33.14   -13.389 0   77.1   ? 990  PRO   A HG2  1 1 
ATOM   4674 H  HG3  . PRO   A 1 300 ? 10.015  34.586  -13.931 0   79.05  ? 990  PRO   A HG3  1 1 
ATOM   4675 H  HD2  . PRO   A 1 300 ? 8.852   32.349  -15.53  0   73.85  ? 990  PRO   A HD2  1 1 
ATOM   4676 H  HD3  . PRO   A 1 300 ? 8.964   34.116  -15.872 0   75.55  ? 990  PRO   A HD3  1 1 
ATOM   4677 N  N    . SER   A 1 301 ? 13.986  31.571  -15.048 1   67.43  ? 991  SER   A N    1 1 
ATOM   4678 C  CA   . SER   A 1 301 ? 14.885  30.416  -15.195 1   67.89  ? 991  SER   A CA   1 1 
ATOM   4679 C  C    . SER   A 1 301 ? 15.738  30.242  -13.934 1   67.85  ? 991  SER   A C    1 1 
ATOM   4680 O  O    . SER   A 1 301 ? 16.152  31.264  -13.388 1   68.04  ? 991  SER   A O    1 1 
ATOM   4681 C  CB   . SER   A 1 301 ? 15.832  30.631  -16.373 1   69.5   ? 991  SER   A CB   1 1 
ATOM   4682 O  OG   . SER   A 1 301 ? 15.17   31.127  -17.525 1   72.04  ? 991  SER   A OG   1 1 
ATOM   4683 H  H    . SER   A 1 301 ? 14.455  32.402  -14.701 0   79.78  ? 991  SER   A H    1 1 
ATOM   4684 H  HA   . SER   A 1 301 ? 14.306  29.517  -15.395 0   77.28  ? 991  SER   A HA   1 1 
ATOM   4685 H  HB2  . SER   A 1 301 ? 16.596  31.347  -16.075 0   82.68  ? 991  SER   A HB2  1 1 
ATOM   4686 H  HB3  . SER   A 1 301 ? 16.298  29.679  -16.621 0   80.78  ? 991  SER   A HB3  1 1 
ATOM   4687 H  HG   . SER   A 1 301 ? 15.825  31.254  -18.261 0   83.89  ? 991  SER   A HG   1 1 
ATOM   4688 N  N    . PRO   A 1 302 ? 16.095  29.012  -13.467 1   67.6   ? 992  PRO   A N    1 1 
ATOM   4689 C  CA   . PRO   A 1 302 ? 16.984  28.918  -12.289 1   67.66  ? 992  PRO   A CA   1 1 
ATOM   4690 C  C    . PRO   A 1 302 ? 18.344  29.598  -12.471 1   68.01  ? 992  PRO   A C    1 1 
ATOM   4691 O  O    . PRO   A 1 302 ? 19.031  29.815  -11.478 1   67.94  ? 992  PRO   A O    1 1 
ATOM   4692 C  CB   . PRO   A 1 302 ? 17.142  27.409  -12.068 1   68.18  ? 992  PRO   A CB   1 1 
ATOM   4693 C  CG   . PRO   A 1 302 ? 16.028  26.796  -12.785 1   68.54  ? 992  PRO   A CG   1 1 
ATOM   4694 C  CD   . PRO   A 1 302 ? 15.745  27.666  -13.963 1   66.99  ? 992  PRO   A CD   1 1 
ATOM   4695 H  HA   . PRO   A 1 302 ? 16.491  29.341  -11.415 0   80.14  ? 992  PRO   A HA   1 1 
ATOM   4696 H  HB2  . PRO   A 1 302 ? 18.097  27.071  -12.47  0   80.2   ? 992  PRO   A HB2  1 1 
ATOM   4697 H  HB3  . PRO   A 1 302 ? 17.072  27.192  -11.003 0   79.55  ? 992  PRO   A HB3  1 1 
ATOM   4698 H  HG2  . PRO   A 1 302 ? 16.305  25.792  -13.103 0   77.58  ? 992  PRO   A HG2  1 1 
ATOM   4699 H  HG3  . PRO   A 1 302 ? 15.163  26.776  -12.122 0   77.32  ? 992  PRO   A HG3  1 1 
ATOM   4700 H  HD2  . PRO   A 1 302 ? 16.38   27.388  -14.803 0   76.82  ? 992  PRO   A HD2  1 1 
ATOM   4701 H  HD3  . PRO   A 1 302 ? 14.687  27.585  -14.207 0   75.49  ? 992  PRO   A HD3  1 1 
ATOM   4702 N  N    . THR   A 1 303 ? 18.731  29.944  -13.72  1   68.33  ? 993  THR   A N    1 1 
ATOM   4703 C  CA   . THR   A 1 303 ? 19.99   30.645  -14.002 1   69.12  ? 993  THR   A CA   1 1 
ATOM   4704 C  C    . THR   A 1 303 ? 19.858  32.12   -13.571 1   69.47  ? 993  THR   A C    1 1 
ATOM   4705 O  O    . THR   A 1 303 ? 20.827  32.689  -13.068 1   69.58  ? 993  THR   A O    1 1 
ATOM   4706 C  CB   . THR   A 1 303 ? 20.375  30.548  -15.499 1   70.44  ? 993  THR   A CB   1 1 
ATOM   4707 O  OG1  . THR   A 1 303 ? 19.434  31.275  -16.284 1   71.51  ? 993  THR   A OG1  1 1 
ATOM   4708 C  CG2  . THR   A 1 303 ? 20.484  29.103  -16.006 1   70.74  ? 993  THR   A CG2  1 1 
ATOM   4709 H  H    . THR   A 1 303 ? 18.169  29.789  -14.551 0   82.12  ? 993  THR   A H    1 1 
ATOM   4710 H  HA   . THR   A 1 303 ? 20.796  30.194  -13.425 0   86.74  ? 993  THR   A HA   1 1 
ATOM   4711 H  HB   . THR   A 1 303 ? 21.353  31.008  -15.631 0   89.15  ? 993  THR   A HB   1 1 
ATOM   4712 H  HG1  . THR   A 1 303 ? 19.641  31.168  -17.249 0   87.73  ? 993  THR   A HG1  1 1 
ATOM   4713 H  HG21 . THR   A 1 303 ? 20.778  29.096  -17.055 0   86.63  ? 993  THR   A HG21 1 1 
ATOM   4714 H  HG22 . THR   A 1 303 ? 21.229  28.562  -15.426 0   87.1   ? 993  THR   A HG22 1 1 
ATOM   4715 H  HG23 . THR   A 1 303 ? 19.523  28.599  -15.92  0   84.87  ? 993  THR   A HG23 1 1 
ATOM   4716 N  N    . ASP   A 1 304 ? 18.66   32.728  -13.759 1   69.38  ? 994  ASP   A N    1 1 
ATOM   4717 C  CA   . ASP   A 1 304 ? 18.385  34.119  -13.385 1   69.7   ? 994  ASP   A CA   1 1 
ATOM   4718 C  C    . ASP   A 1 304 ? 18.528  34.312  -11.878 1   69.92  ? 994  ASP   A C    1 1 
ATOM   4719 O  O    . ASP   A 1 304 ? 18.2    33.413  -11.105 1   69.88  ? 994  ASP   A O    1 1 
ATOM   4720 C  CB   . ASP   A 1 304 ? 16.95   34.528  -13.781 1   71.04  ? 994  ASP   A CB   1 1 
ATOM   4721 C  CG   . ASP   A 1 304 ? 16.624  34.45   -15.258 1   74.86  ? 994  ASP   A CG   1 1 
ATOM   4722 O  OD1  . ASP   A 1 304 ? 17.567  34.447  -16.074 1   75.73  ? 994  ASP   A OD1  1 1 
ATOM   4723 O  OD2  . ASP   A 1 304 ? 15.424  34.392  -15.597 1   76.58  ? 994  ASP   A OD2  1 1 
ATOM   4724 H  H    . ASP   A 1 304 ? 17.855  32.267  -14.171 0   85.27  ? 994  ASP   A H    1 1 
ATOM   4725 H  HA   . ASP   A 1 304 ? 19.089  34.777  -13.892 0   89.85  ? 994  ASP   A HA   1 1 
ATOM   4726 H  HB2  . ASP   A 1 304 ? 16.252  33.878  -13.256 0   87.1   ? 994  ASP   A HB2  1 1 
ATOM   4727 H  HB3  . ASP   A 1 304 ? 16.791  35.558  -13.465 0   89.52  ? 994  ASP   A HB3  1 1 
ATOM   4728 N  N    . SER   A 1 305 ? 18.981  35.499  -11.46  1   70     ? 995  SER   A N    1 1 
ATOM   4729 C  CA   . SER   A 1 305 ? 19.127  35.815  -10.042 1   70.5   ? 995  SER   A CA   1 1 
ATOM   4730 C  C    . SER   A 1 305 ? 17.775  36.007  -9.336  1   70.83  ? 995  SER   A C    1 1 
ATOM   4731 O  O    . SER   A 1 305 ? 17.727  35.869  -8.121  1   70.83  ? 995  SER   A O    1 1 
ATOM   4732 C  CB   . SER   A 1 305 ? 19.984  37.063  -9.859  1   71.71  ? 995  SER   A CB   1 1 
ATOM   4733 O  OG   . SER   A 1 305 ? 21.323  36.844  -10.274 1   73.6   ? 995  SER   A OG   1 1 
ATOM   4734 H  H    . SER   A 1 305 ? 19.253  36.254  -12.081 0   92.62  ? 995  SER   A H    1 1 
ATOM   4735 H  HA   . SER   A 1 305 ? 19.64   34.991  -9.549  0   92.68  ? 995  SER   A HA   1 1 
ATOM   4736 H  HB2  . SER   A 1 305 ? 19.556  37.87   -10.451 0   97.3   ? 995  SER   A HB2  1 1 
ATOM   4737 H  HB3  . SER   A 1 305 ? 19.981  37.335  -8.805  0   97.6   ? 995  SER   A HB3  1 1 
ATOM   4738 H  HG   . SER   A 1 305 ? 21.871  37.652  -10.094 0   102.03 ? 995  SER   A HG   1 1 
ATOM   4739 N  N    . ASN   A 1 306 ? 16.685  36.308  -10.082 1   70.97  ? 996  ASN   A N    1 1 
ATOM   4740 C  CA   . ASN   A 1 306 ? 15.345  36.493  -9.511  1   71.54  ? 996  ASN   A CA   1 1 
ATOM   4741 C  C    . ASN   A 1 306 ? 14.46   35.229  -9.617  1   71.57  ? 996  ASN   A C    1 1 
ATOM   4742 O  O    . ASN   A 1 306 ? 13.239  35.366  -9.564  1   71.69  ? 996  ASN   A O    1 1 
ATOM   4743 C  CB   . ASN   A 1 306 ? 14.637  37.682  -10.196 1   72.93  ? 996  ASN   A CB   1 1 
ATOM   4744 C  CG   . ASN   A 1 306 ? 15.109  39.04   -9.747  1   76.56  ? 996  ASN   A CG   1 1 
ATOM   4745 O  OD1  . ASN   A 1 306 ? 15.701  39.208  -8.675  1   77.89  ? 996  ASN   A OD1  1 1 
ATOM   4746 N  ND2  . ASN   A 1 306 ? 14.841  40.06   -10.554 1   77.46  ? 996  ASN   A ND2  1 1 
ATOM   4747 H  H    . ASN   A 1 306 ? 16.701  36.435  -11.088 0   91.09  ? 996  ASN   A H    1 1 
ATOM   4748 H  HA   . ASN   A 1 306 ? 15.422  36.725  -8.45   0   91.44  ? 996  ASN   A HA   1 1 
ATOM   4749 H  HB2  . ASN   A 1 306 ? 14.785  37.615  -11.273 0   92.44  ? 996  ASN   A HB2  1 1 
ATOM   4750 H  HB3  . ASN   A 1 306 ? 13.57   37.657  -9.982  0   91.64  ? 996  ASN   A HB3  1 1 
ATOM   4751 H  HD21 . ASN   A 1 306 ? 15.138  40.996  -10.297 0   102.37 ? 996  ASN   A HD21 1 1 
ATOM   4752 H  HD22 . ASN   A 1 306 ? 14.347  39.914  -11.429 0   99.64  ? 996  ASN   A HD22 1 1 
ATOM   4753 N  N    . PHE   A 1 307 ? 15.043  34.013  -9.735  1   71.37  ? 997  PHE   A N    1 1 
ATOM   4754 C  CA   . PHE   A 1 307 ? 14.22   32.803  -9.83   1   71.79  ? 997  PHE   A CA   1 1 
ATOM   4755 C  C    . PHE   A 1 307 ? 13.519  32.47   -8.509  1   71.52  ? 997  PHE   A C    1 1 
ATOM   4756 O  O    . PHE   A 1 307 ? 12.407  31.946  -8.535  1   71.59  ? 997  PHE   A O    1 1 
ATOM   4757 C  CB   . PHE   A 1 307 ? 15.018  31.594  -10.336 1   72.09  ? 997  PHE   A CB   1 1 
ATOM   4758 C  CG   . PHE   A 1 307 ? 14.131  30.401  -10.635 1   73.03  ? 997  PHE   A CG   1 1 
ATOM   4759 C  CD1  . PHE   A 1 307 ? 13.222  30.436  -11.679 1   73.9   ? 997  PHE   A CD1  1 1 
ATOM   4760 C  CD2  . PHE   A 1 307 ? 14.177  29.266  -9.846  1   73.85  ? 997  PHE   A CD2  1 1 
ATOM   4761 C  CE1  . PHE   A 1 307 ? 12.402  29.35   -11.944 1   74.64  ? 997  PHE   A CE1  1 1 
ATOM   4762 C  CE2  . PHE   A 1 307 ? 13.347  28.185  -10.108 1   74.54  ? 997  PHE   A CE2  1 1 
ATOM   4763 C  CZ   . PHE   A 1 307 ? 12.47   28.232  -11.158 1   74.38  ? 997  PHE   A CZ   1 1 
ATOM   4764 H  H    . PHE   A 1 307 ? 16.041  33.831  -9.755  0   88.11  ? 997  PHE   A H    1 1 
ATOM   4765 H  HA   . PHE   A 1 307 ? 13.437  33.003  -10.56  0   84.89  ? 997  PHE   A HA   1 1 
ATOM   4766 H  HB2  . PHE   A 1 307 ? 15.532  31.87   -11.256 0   85.84  ? 997  PHE   A HB2  1 1 
ATOM   4767 H  HB3  . PHE   A 1 307 ? 15.743  31.306  -9.576  0   85.94  ? 997  PHE   A HB3  1 1 
ATOM   4768 H  HD1  . PHE   A 1 307 ? 13.165  31.308  -12.31  0   84.59  ? 997  PHE   A HD1  1 1 
ATOM   4769 H  HD2  . PHE   A 1 307 ? 14.864  29.216  -9.019  0   85.1   ? 997  PHE   A HD2  1 1 
ATOM   4770 H  HE1  . PHE   A 1 307 ? 11.707  29.391  -12.766 0   82.33  ? 997  PHE   A HE1  1 1 
ATOM   4771 H  HE2  . PHE   A 1 307 ? 13.401  27.304  -9.491  0   82.84  ? 997  PHE   A HE2  1 1 
ATOM   4772 H  HZ   . PHE   A 1 307 ? 11.824  27.394  -11.361 0   80.99  ? 997  PHE   A HZ   1 1 
ATOM   4773 N  N    . TYR   A 1 308 ? 14.142  32.785  -7.363  1   71.06  ? 998  TYR   A N    1 1 
ATOM   4774 C  CA   . TYR   A 1 308 ? 13.518  32.558  -6.055  1   71.19  ? 998  TYR   A CA   1 1 
ATOM   4775 C  C    . TYR   A 1 308 ? 12.211  33.366  -5.881  1   71.43  ? 998  TYR   A C    1 1 
ATOM   4776 O  O    . TYR   A 1 308 ? 11.378  32.989  -5.059  1   71.43  ? 998  TYR   A O    1 1 
ATOM   4777 C  CB   . TYR   A 1 308 ? 14.502  32.884  -4.918  1   71.08  ? 998  TYR   A CB   1 1 
ATOM   4778 C  CG   . TYR   A 1 308 ? 14.774  34.362  -4.734  1   71.61  ? 998  TYR   A CG   1 1 
ATOM   4779 C  CD1  . TYR   A 1 308 ? 14.126  35.091  -3.749  1   72.32  ? 998  TYR   A CD1  1 1 
ATOM   4780 C  CD2  . TYR   A 1 308 ? 15.703  35.022  -5.524  1   72.31  ? 998  TYR   A CD2  1 1 
ATOM   4781 C  CE1  . TYR   A 1 308 ? 14.379  36.443  -3.568  1   73.09  ? 998  TYR   A CE1  1 1 
ATOM   4782 C  CE2  . TYR   A 1 308 ? 15.983  36.369  -5.337  1   73.08  ? 998  TYR   A CE2  1 1 
ATOM   4783 C  CZ   . TYR   A 1 308 ? 15.324  37.076  -4.352  1   73.89  ? 998  TYR   A CZ   1 1 
ATOM   4784 O  OH   . TYR   A 1 308 ? 15.579  38.414  -4.187  1   75.32  ? 998  TYR   A OH   1 1 
ATOM   4785 H  H    . TYR   A 1 308 ? 15.077  33.174  -7.306  0   86.83  ? 998  TYR   A H    1 1 
ATOM   4786 H  HA   . TYR   A 1 308 ? 13.264  31.503  -5.971  0   83.99  ? 998  TYR   A HA   1 1 
ATOM   4787 H  HB2  . TYR   A 1 308 ? 14.087  32.507  -3.985  0   86.29  ? 998  TYR   A HB2  1 1 
ATOM   4788 H  HB3  . TYR   A 1 308 ? 15.452  32.391  -5.117  0   87.07  ? 998  TYR   A HB3  1 1 
ATOM   4789 H  HD1  . TYR   A 1 308 ? 13.399  34.603  -3.124  0   89.53  ? 998  TYR   A HD1  1 1 
ATOM   4790 H  HD2  . TYR   A 1 308 ? 16.236  34.472  -6.282  0   90.99  ? 998  TYR   A HD2  1 1 
ATOM   4791 H  HE1  . TYR   A 1 308 ? 13.859  36.98   -2.793  0   93.72  ? 998  TYR   A HE1  1 1 
ATOM   4792 H  HE2  . TYR   A 1 308 ? 16.706  36.861  -5.965  0   95.32  ? 998  TYR   A HE2  1 1 
ATOM   4793 H  HH   . TYR   A 1 308 ? 14.863  38.831  -3.638  0   99.14  ? 998  TYR   A HH   1 1 
ATOM   4794 N  N    . ARG   A 1 309 ? 12.04   34.472  -6.64   1   71.43  ? 999  ARG   A N    1 1 
ATOM   4795 C  CA   . ARG   A 1 309 ? 10.829  35.291  -6.593  1   71.94  ? 999  ARG   A CA   1 1 
ATOM   4796 C  C    . ARG   A 1 309 ? 9.675   34.507  -7.223  1   72.42  ? 999  ARG   A C    1 1 
ATOM   4797 O  O    . ARG   A 1 309 ? 8.573   34.508  -6.685  1   72.6   ? 999  ARG   A O    1 1 
ATOM   4798 C  CB   . ARG   A 1 309 ? 11.021  36.62   -7.355  1   72.95  ? 999  ARG   A CB   1 1 
ATOM   4799 C  CG   . ARG   A 1 309 ? 12.101  37.549  -6.809  1   75.04  ? 999  ARG   A CG   1 1 
ATOM   4800 C  CD   . ARG   A 1 309 ? 11.654  38.302  -5.578  1   77.13  ? 999  ARG   A CD   1 1 
ATOM   4801 N  NE   . ARG   A 1 309 ? 12.682  39.234  -5.13   1   79.07  ? 999  ARG   A NE   1 1 
ATOM   4802 C  CZ   . ARG   A 1 309 ? 12.575  40.039  -4.079  1   80.66  ? 999  ARG   A CZ   1 1 
ATOM   4803 N  NH1  . ARG   A 1 309 ? 11.468  40.04   -3.341  1   80.03  ? 999  ARG   A NH1  1 1 
ATOM   4804 N  NH2  . ARG   A 1 309 ? 13.571  40.851  -3.755  1   80.42  ? 999  ARG   A NH2  1 1 
ATOM   4805 H  H    . ARG   A 1 309 ? 12.723  34.81   -7.311  0   86.82  ? 999  ARG   A H    1 1 
ATOM   4806 H  HA   . ARG   A 1 309 ? 10.568  35.504  -5.557  0   87.05  ? 999  ARG   A HA   1 1 
ATOM   4807 H  HB2  . ARG   A 1 309 ? 11.283  36.391  -8.387  0   88.65  ? 999  ARG   A HB2  1 1 
ATOM   4808 H  HB3  . ARG   A 1 309 ? 10.08   37.167  -7.331  0   89.05  ? 999  ARG   A HB3  1 1 
ATOM   4809 H  HG2  . ARG   A 1 309 ? 12.993  36.979  -6.553  0   93.51  ? 999  ARG   A HG2  1 1 
ATOM   4810 H  HG3  . ARG   A 1 309 ? 12.346  38.283  -7.575  0   94.31  ? 999  ARG   A HG3  1 1 
ATOM   4811 H  HD2  . ARG   A 1 309 ? 10.752  38.869  -5.805  0   96.5   ? 999  ARG   A HD2  1 1 
ATOM   4812 H  HD3  . ARG   A 1 309 ? 11.464  37.605  -4.763  0   95.74  ? 999  ARG   A HD3  1 1 
ATOM   4813 H  HE   . ARG   A 1 309 ? 13.545  39.265  -5.665  0   101.45 ? 999  ARG   A HE   1 1 
ATOM   4814 H  HH11 . ARG   A 1 309 ? 10.673  39.444  -3.541  0   100.98 ? 999  ARG   A HH11 1 1 
ATOM   4815 H  HH12 . ARG   A 1 309 ? 11.41   40.667  -2.544  0   103.72 ? 999  ARG   A HH12 1 1 
ATOM   4816 H  HH21 . ARG   A 1 309 ? 14.419  40.852  -4.315  0   106.44 ? 999  ARG   A HH21 1 1 
ATOM   4817 H  HH22 . ARG   A 1 309 ? 13.498  41.469  -2.954  0   106.98 ? 999  ARG   A HH22 1 1 
ATOM   4818 N  N    . ALA   A 1 310 ? 9.929   33.84   -8.361  1   72.53  ? 1000 ALA   A N    1 1 
ATOM   4819 C  CA   . ALA   A 1 310 ? 8.925   33.03   -9.04   1   73.14  ? 1000 ALA   A CA   1 1 
ATOM   4820 C  C    . ALA   A 1 310 ? 8.728   31.709  -8.299  1   73.5   ? 1000 ALA   A C    1 1 
ATOM   4821 O  O    . ALA   A 1 310 ? 7.595   31.31   -8.038  1   73.62  ? 1000 ALA   A O    1 1 
ATOM   4822 C  CB   . ALA   A 1 310 ? 9.366   32.759  -10.467 1   73.37  ? 1000 ALA   A CB   1 1 
ATOM   4823 H  H    . ALA   A 1 310 ? 10.819  33.86   -8.849  0   84.88  ? 1000 ALA   A H    1 1 
ATOM   4824 H  HA   . ALA   A 1 310 ? 7.974   33.56   -9.071  0   83.25  ? 1000 ALA   A HA   1 1 
ATOM   4825 H  HB1  . ALA   A 1 310 ? 8.605   32.159  -10.965 0   81.89  ? 1000 ALA   A HB1  1 1 
ATOM   4826 H  HB2  . ALA   A 1 310 ? 9.488   33.71   -10.984 0   83.99  ? 1000 ALA   A HB2  1 1 
ATOM   4827 H  HB3  . ALA   A 1 310 ? 10.311  32.218  -10.454 0   83.21  ? 1000 ALA   A HB3  1 1 
ATOM   4828 N  N    . GLU   A 1 325 ? -13.799 14.358  -20.008 1   53.4   ? 1015 GLU   A N    1 1 
ATOM   4829 C  CA   . GLU   A 1 325 ? -12.574 13.977  -20.705 1   53.84  ? 1015 GLU   A CA   1 1 
ATOM   4830 C  C    . GLU   A 1 325 ? -12.47  12.455  -20.769 1   53.86  ? 1015 GLU   A C    1 1 
ATOM   4831 O  O    . GLU   A 1 325 ? -12.061 11.924  -21.798 1   53.99  ? 1015 GLU   A O    1 1 
ATOM   4832 C  CB   . GLU   A 1 325 ? -11.327 14.541  -19.996 1   56.13  ? 1015 GLU   A CB   1 1 
ATOM   4833 C  CG   . GLU   A 1 325 ? -11.395 16.019  -19.647 1   60.47  ? 1015 GLU   A CG   1 1 
ATOM   4834 C  CD   . GLU   A 1 325 ? -10.251 16.496  -18.773 1   66.15  ? 1015 GLU   A CD   1 1 
ATOM   4835 O  OE1  . GLU   A 1 325 ? -9.894  15.779  -17.809 1   66.63  ? 1015 GLU   A OE1  1 1 
ATOM   4836 O  OE2  . GLU   A 1 325 ? -9.715  17.594  -19.047 1   68.25  ? 1015 GLU   A OE2  1 1 
ATOM   4837 H  HA   . GLU   A 1 325 ? -12.601 14.363  -21.722 0   54.99  ? 1015 GLU   A HA   1 1 
ATOM   4838 H  HB2  . GLU   A 1 325 ? -11.175 13.972  -19.08  0   56.68  ? 1015 GLU   A HB2  1 1 
ATOM   4839 H  HB3  . GLU   A 1 325 ? -10.472 14.403  -20.657 0   55.93  ? 1015 GLU   A HB3  1 1 
ATOM   4840 H  HG2  . GLU   A 1 325 ? -11.371 16.596  -20.57  0   60.62  ? 1015 GLU   A HG2  1 1 
ATOM   4841 H  HG3  . GLU   A 1 325 ? -12.316 16.236  -19.107 0   61.52  ? 1015 GLU   A HG3  1 1 
ATOM   4842 N  N    . TYR   A 1 326 ? -12.81  11.763  -19.658 1   53.46  ? 1016 TYR   A N    1 1 
ATOM   4843 C  CA   . TYR   A 1 326 ? -12.766 10.305  -19.549 1   53.74  ? 1016 TYR   A CA   1 1 
ATOM   4844 C  C    . TYR   A 1 326 ? -14.183 9.769   -19.678 1   54.04  ? 1016 TYR   A C    1 1 
ATOM   4845 O  O    . TYR   A 1 326 ? -15.094 10.302  -19.045 1   53.75  ? 1016 TYR   A O    1 1 
ATOM   4846 C  CB   . TYR   A 1 326 ? -12.164 9.889   -18.202 1   53.79  ? 1016 TYR   A CB   1 1 
ATOM   4847 C  CG   . TYR   A 1 326 ? -10.778 10.445  -17.961 1   54.59  ? 1016 TYR   A CG   1 1 
ATOM   4848 C  CD1  . TYR   A 1 326 ? -9.648  9.701   -18.261 1   55.48  ? 1016 TYR   A CD1  1 1 
ATOM   4849 C  CD2  . TYR   A 1 326 ? -10.598 11.703  -17.404 1   55.49  ? 1016 TYR   A CD2  1 1 
ATOM   4850 C  CE1  . TYR   A 1 326 ? -8.373  10.204  -18.04  1   56.33  ? 1016 TYR   A CE1  1 1 
ATOM   4851 C  CE2  . TYR   A 1 326 ? -9.328  12.224  -17.193 1   56.32  ? 1016 TYR   A CE2  1 1 
ATOM   4852 C  CZ   . TYR   A 1 326 ? -8.216  11.458  -17.478 1   57.24  ? 1016 TYR   A CZ   1 1 
ATOM   4853 O  OH   . TYR   A 1 326 ? -6.961  11.971  -17.247 1   58.58  ? 1016 TYR   A OH   1 1 
ATOM   4854 H  H    . TYR   A 1 326 ? -13.109 12.196  -18.791 0   55.96  ? 1016 TYR   A H    1 1 
ATOM   4855 H  HA   . TYR   A 1 326 ? -12.147 9.876   -20.335 0   56.11  ? 1016 TYR   A HA   1 1 
ATOM   4856 H  HB2  . TYR   A 1 326 ? -12.813 10.23   -17.397 0   57     ? 1016 TYR   A HB2  1 1 
ATOM   4857 H  HB3  . TYR   A 1 326 ? -12.082 8.804   -18.176 0   56.97  ? 1016 TYR   A HB3  1 1 
ATOM   4858 H  HD1  . TYR   A 1 326 ? -9.759  8.717   -18.683 0   56.99  ? 1016 TYR   A HD1  1 1 
ATOM   4859 H  HD2  . TYR   A 1 326 ? -11.46  12.302  -17.165 0   57     ? 1016 TYR   A HD2  1 1 
ATOM   4860 H  HE1  . TYR   A 1 326 ? -7.515  9.6     -18.276 0   56.24  ? 1016 TYR   A HE1  1 1 
ATOM   4861 H  HE2  . TYR   A 1 326 ? -9.214  13.2    -16.751 0   56.22  ? 1016 TYR   A HE2  1 1 
ATOM   4862 H  HH   . TYR   A 1 326 ? -6.296  11.501  -17.814 0   57.3   ? 1016 TYR   A HH   1 1 
ATOM   4863 N  N    . LEU   A 1 327 ? -14.382 8.744   -20.523 1   54.36  ? 1017 LEU   A N    1 1 
ATOM   4864 C  CA   . LEU   A 1 327 ? -15.707 8.179   -20.773 1   55.16  ? 1017 LEU   A CA   1 1 
ATOM   4865 C  C    . LEU   A 1 327 ? -15.701 6.666   -20.795 1   56.04  ? 1017 LEU   A C    1 1 
ATOM   4866 O  O    . LEU   A 1 327 ? -14.674 6.055   -21.086 1   55.89  ? 1017 LEU   A O    1 1 
ATOM   4867 C  CB   . LEU   A 1 327 ? -16.239 8.687   -22.122 1   55.28  ? 1017 LEU   A CB   1 1 
ATOM   4868 C  CG   . LEU   A 1 327 ? -16.232 10.229  -22.34  1   56.81  ? 1017 LEU   A CG   1 1 
ATOM   4869 C  CD1  . LEU   A 1 327 ? -15.011 10.67   -23.173 1   57.33  ? 1017 LEU   A CD1  1 1 
ATOM   4870 C  CD2  . LEU   A 1 327 ? -17.534 10.698  -22.943 1   57.45  ? 1017 LEU   A CD2  1 1 
ATOM   4871 H  H    . LEU   A 1 327 ? -13.645 8.285   -21.048 0   58.62  ? 1017 LEU   A H    1 1 
ATOM   4872 H  HA   . LEU   A 1 327 ? -16.409 8.493   -20.002 0   62     ? 1017 LEU   A HA   1 1 
ATOM   4873 H  HB2  . LEU   A 1 327 ? -15.642 8.22    -22.905 0   61.19  ? 1017 LEU   A HB2  1 1 
ATOM   4874 H  HB3  . LEU   A 1 327 ? -17.26  8.316   -22.205 0   62.85  ? 1017 LEU   A HB3  1 1 
ATOM   4875 H  HG   . LEU   A 1 327 ? -16.149 10.748  -21.385 0   62.18  ? 1017 LEU   A HG   1 1 
ATOM   4876 H  HD11 . LEU   A 1 327 ? -15.037 11.749  -23.318 0   60.99  ? 1017 LEU   A HD11 1 1 
ATOM   4877 H  HD12 . LEU   A 1 327 ? -14.105 10.39   -22.639 0   60.77  ? 1017 LEU   A HD12 1 1 
ATOM   4878 H  HD13 . LEU   A 1 327 ? -15.039 10.167  -24.138 0   61.54  ? 1017 LEU   A HD13 1 1 
ATOM   4879 H  HD21 . LEU   A 1 327 ? -17.467 11.755  -23.198 0   63.54  ? 1017 LEU   A HD21 1 1 
ATOM   4880 H  HD22 . LEU   A 1 327 ? -17.739 10.094  -23.825 0   64.32  ? 1017 LEU   A HD22 1 1 
ATOM   4881 H  HD23 . LEU   A 1 327 ? -18.326 10.535  -22.214 0   65.14  ? 1017 LEU   A HD23 1 1 
ATOM   4882 N  N    . ILE   A 1 328 ? -16.867 6.062   -20.522 1   56.76  ? 1018 ILE   A N    1 1 
ATOM   4883 C  CA   . ILE   A 1 328 ? -17.037 4.61    -20.561 1   57.84  ? 1018 ILE   A CA   1 1 
ATOM   4884 C  C    . ILE   A 1 328 ? -16.947 4.209   -22.053 1   58.14  ? 1018 ILE   A C    1 1 
ATOM   4885 O  O    . ILE   A 1 328 ? -17.653 4.817   -22.862 1   58.39  ? 1018 ILE   A O    1 1 
ATOM   4886 C  CB   . ILE   A 1 328 ? -18.412 4.187   -19.928 1   58.82  ? 1018 ILE   A CB   1 1 
ATOM   4887 C  CG1  . ILE   A 1 328 ? -18.419 4.348   -18.371 1   60.14  ? 1018 ILE   A CG1  1 1 
ATOM   4888 C  CG2  . ILE   A 1 328 ? -18.838 2.766   -20.346 1   59.3   ? 1018 ILE   A CG2  1 1 
ATOM   4889 C  CD1  . ILE   A 1 328 ? -17.574 3.289   -17.486 1   61.49  ? 1018 ILE   A CD1  1 1 
ATOM   4890 H  H    . ILE   A 1 328 ? -17.716 6.569   -20.293 0   66.14  ? 1018 ILE   A H    1 1 
ATOM   4891 H  HA   . ILE   A 1 328 ? -16.231 4.162   -19.983 0   67.49  ? 1018 ILE   A HA   1 1 
ATOM   4892 H  HB   . ILE   A 1 328 ? -19.185 4.85    -20.316 0   71.04  ? 1018 ILE   A HB   1 1 
ATOM   4893 H  HG12 . ILE   A 1 328 ? -18.026 5.335   -18.133 0   71.02  ? 1018 ILE   A HG12 1 1 
ATOM   4894 H  HG13 . ILE   A 1 328 ? -19.452 4.289   -18.032 0   73.47  ? 1018 ILE   A HG13 1 1 
ATOM   4895 H  HG21 . ILE   A 1 328 ? -19.758 2.524   -19.816 0   74.29  ? 1018 ILE   A HG21 1 1 
ATOM   4896 H  HG22 . ILE   A 1 328 ? -19.033 2.729   -21.417 0   72.9   ? 1018 ILE   A HG22 1 1 
ATOM   4897 H  HG23 . ILE   A 1 328 ? -18.064 2.046   -20.085 0   72.64  ? 1018 ILE   A HG23 1 1 
ATOM   4898 H  HD11 . ILE   A 1 328 ? -17.634 3.581   -16.439 0   73.58  ? 1018 ILE   A HD11 1 1 
ATOM   4899 H  HD12 . ILE   A 1 328 ? -17.986 2.288   -17.602 0   74.77  ? 1018 ILE   A HD12 1 1 
ATOM   4900 H  HD13 . ILE   A 1 328 ? -16.534 3.298   -17.81  0   72.28  ? 1018 ILE   A HD13 1 1 
ATOM   4901 N  N    . PRO   A 1 329 ? -16.109 3.231   -22.463 1   58     ? 1019 PRO   A N    1 1 
ATOM   4902 C  CA   . PRO   A 1 329 ? -16.036 2.892   -23.897 1   58.12  ? 1019 PRO   A CA   1 1 
ATOM   4903 C  C    . PRO   A 1 329 ? -17.302 2.237   -24.448 1   58.42  ? 1019 PRO   A C    1 1 
ATOM   4904 O  O    . PRO   A 1 329 ? -17.938 1.439   -23.764 1   58.58  ? 1019 PRO   A O    1 1 
ATOM   4905 C  CB   . PRO   A 1 329 ? -14.84  1.944   -23.975 1   58.69  ? 1019 PRO   A CB   1 1 
ATOM   4906 C  CG   . PRO   A 1 329 ? -14.737 1.356   -22.626 1   59.11  ? 1019 PRO   A CG   1 1 
ATOM   4907 C  CD   . PRO   A 1 329 ? -15.169 2.411   -21.67  1   57.49  ? 1019 PRO   A CD   1 1 
ATOM   4908 H  HA   . PRO   A 1 329 ? -15.807 3.782   -24.482 0   67.18  ? 1019 PRO   A HA   1 1 
ATOM   4909 H  HB2  . PRO   A 1 329 ? -15.04  1.172   -24.717 0   69.17  ? 1019 PRO   A HB2  1 1 
ATOM   4910 H  HB3  . PRO   A 1 329 ? -13.942 2.506   -24.224 0   67.01  ? 1019 PRO   A HB3  1 1 
ATOM   4911 H  HG2  . PRO   A 1 329 ? -15.399 0.494   -22.56  0   70.79  ? 1019 PRO   A HG2  1 1 
ATOM   4912 H  HG3  . PRO   A 1 329 ? -13.704 1.069   -22.436 0   68.69  ? 1019 PRO   A HG3  1 1 
ATOM   4913 H  HD2  . PRO   A 1 329 ? -15.659 1.952   -20.812 0   68.13  ? 1019 PRO   A HD2  1 1 
ATOM   4914 H  HD3  . PRO   A 1 329 ? -14.314 3.014   -21.367 0   65.92  ? 1019 PRO   A HD3  1 1 
HETATM 4915 C  C    . A1IMS B 2 .   ? 1.463   10.875  -9.833  1   40.68  ? 2001 A1IMS A C    1 1 
HETATM 4916 N  N    . A1IMS B 2 .   ? 1.014   14.313  -9.667  1   39.91  ? 2001 A1IMS A N    1 1 
HETATM 4917 CL CL   . A1IMS B 2 .   ? 3.058   10.565  -6.781  1   42.79  ? 2001 A1IMS A CL   1 1 
HETATM 4918 C  C2   . A1IMS B 2 .   ? 2.155   12.035  -6.977  1   41.41  ? 2001 A1IMS A C2   1 1 
HETATM 4919 C  C3   . A1IMS B 2 .   ? 1.764   12.705  -5.839  1   41.03  ? 2001 A1IMS A C3   1 1 
HETATM 4920 C  C4   . A1IMS B 2 .   ? 1.087   13.912  -5.973  1   40.88  ? 2001 A1IMS A C4   1 1 
HETATM 4921 C  C5   . A1IMS B 2 .   ? 0.787   14.438  -7.216  1   40.67  ? 2001 A1IMS A C5   1 1 
HETATM 4922 C  C6   . A1IMS B 2 .   ? 1.196   13.766  -8.379  1   40.47  ? 2001 A1IMS A C6   1 1 
HETATM 4923 C  C1   . A1IMS B 2 .   ? 1.893   12.533  -8.238  1   40.79  ? 2001 A1IMS A C1   1 1 
HETATM 4924 O  O    . A1IMS B 2 .   ? 2.346   11.874  -9.354  1   40.79  ? 2001 A1IMS A O    1 1 
HETATM 4925 C  C7   . A1IMS B 2 .   ? 0.127   15.341  -10.032 1   39.46  ? 2001 A1IMS A C7   1 1 
HETATM 4926 C  C13  . A1IMS B 2 .   ? 0.211   16.749  -9.744  1   39.08  ? 2001 A1IMS A C13  1 1 
HETATM 4927 N  N2   . A1IMS B 2 .   ? -0.873  17.362  -10.396 1   38.97  ? 2001 A1IMS A N2   1 1 
HETATM 4928 C  C9   . A1IMS B 2 .   ? -1.587  16.421  -11.068 1   39.07  ? 2001 A1IMS A C9   1 1 
HETATM 4929 C  C10  . A1IMS B 2 .   ? -2.854  16.626  -11.802 1   39.22  ? 2001 A1IMS A C10  1 1 
HETATM 4930 C  C11  . A1IMS B 2 .   ? -3.038  15.517  -12.849 1   39.14  ? 2001 A1IMS A C11  1 1 
HETATM 4931 N  N1   . A1IMS B 2 .   ? -2.625  14.2    -12.366 1   39.24  ? 2001 A1IMS A N1   1 1 
HETATM 4932 C  C12  . A1IMS B 2 .   ? -1.583  13.986  -11.461 1   39.38  ? 2001 A1IMS A C12  1 1 
HETATM 4933 O  O1   . A1IMS B 2 .   ? -1.215  12.835  -11.239 1   39.47  ? 2001 A1IMS A O1   1 1 
HETATM 4934 C  C8   . A1IMS B 2 .   ? -0.992  15.175  -10.882 1   39.27  ? 2001 A1IMS A C8   1 1 
HETATM 4935 C  C14  . A1IMS B 2 .   ? 1.237   17.546  -9.079  1   38.52  ? 2001 A1IMS A C14  1 1 
HETATM 4936 C  C18  . A1IMS B 2 .   ? 1.076   18.916  -8.742  1   38.05  ? 2001 A1IMS A C18  1 1 
HETATM 4937 C  C17  . A1IMS B 2 .   ? 2.187   19.637  -8.234  1   38.04  ? 2001 A1IMS A C17  1 1 
HETATM 4938 N  N3   . A1IMS B 2 .   ? 3.414   19.095  -8.077  1   38.25  ? 2001 A1IMS A N3   1 1 
HETATM 4939 C  C16  . A1IMS B 2 .   ? 3.561   17.794  -8.399  1   38.33  ? 2001 A1IMS A C16  1 1 
HETATM 4940 C  C15  . A1IMS B 2 .   ? 2.513   16.999  -8.867  1   38.42  ? 2001 A1IMS A C15  1 1 
HETATM 4941 O  O2   . A1IMS B 2 .   ? -0.125  19.588  -8.931  1   37.55  ? 2001 A1IMS A O2   1 1 
HETATM 4942 C  C19  . A1IMS B 2 .   ? -0.012  20.685  -9.837  1   37.13  ? 2001 A1IMS A C19  1 1 
HETATM 4943 C  C20  . A1IMS B 2 .   ? -1.434  21.086  -10.264 1   36.76  ? 2001 A1IMS A C20  1 1 
HETATM 4944 O  O3   . A1IMS B 2 .   ? -1.992  20.029  -10.989 1   36.69  ? 2001 A1IMS A O3   1 1 
HETATM 4945 C  C23  . A1IMS B 2 .   ? -3.404  20.125  -10.895 1   36.54  ? 2001 A1IMS A C23  1 1 
HETATM 4946 C  C22  . A1IMS B 2 .   ? -3.733  20.856  -9.585  1   36.57  ? 2001 A1IMS A C22  1 1 
HETATM 4947 C  C21  . A1IMS B 2 .   ? -2.366  21.324  -9.071  1   36.67  ? 2001 A1IMS A C21  1 1 
HETATM 4948 O  O    . HOH   C 3 .   ? 9.077   32.746  -23.769 1   48.13  ? 2101 HOH   A O    1 ? 
HETATM 4949 O  O    . HOH   C 3 .   ? 19.147  28.753  -32.63  1   43.46  ? 2102 HOH   A O    1 ? 
HETATM 4950 O  O    . HOH   C 3 .   ? -8.974  9.958   -30.239 1   20.99  ? 2103 HOH   A O    1 ? 
HETATM 4951 O  O    . HOH   C 3 .   ? 0.417   25.812  -13.934 1   35.51  ? 2104 HOH   A O    1 ? 
HETATM 4952 O  O    . HOH   C 3 .   ? 5.064   3.946   -23.426 1   25.56  ? 2105 HOH   A O    1 ? 
HETATM 4953 O  O    . HOH   C 3 .   ? -18.056 7.114   -33.281 1   24.46  ? 2106 HOH   A O    1 ? 
HETATM 4954 O  O    . HOH   C 3 .   ? 3.157   32.88   -27.164 1   28.94  ? 2107 HOH   A O    1 ? 
HETATM 4955 O  O    . HOH   C 3 .   ? -6.32   7.739   -1.696  1   31.36  ? 2108 HOH   A O    1 ? 
HETATM 4956 O  O    . HOH   C 3 .   ? 12.814  12.79   -12.58  1   39.2   ? 2109 HOH   A O    1 ? 
HETATM 4957 O  O    . HOH   C 3 .   ? -9.398  -5.471  -26.394 1   35.52  ? 2110 HOH   A O    1 ? 
HETATM 4958 O  O    . HOH   C 3 .   ? -4.766  8.306   -15.158 1   35.76  ? 2111 HOH   A O    1 ? 
HETATM 4959 O  O    . HOH   C 3 .   ? -1.626  25.38   -44.034 1   16.82  ? 2112 HOH   A O    1 ? 
HETATM 4960 O  O    . HOH   C 3 .   ? -6.892  26.399  -17.003 1   37.35  ? 2113 HOH   A O    1 ? 
HETATM 4961 O  O    . HOH   C 3 .   ? 9.118   6.718   -9.516  1   33.79  ? 2114 HOH   A O    1 ? 
HETATM 4962 O  O    . HOH   C 3 .   ? -21.814 20.824  -29.728 1   19.15  ? 2115 HOH   A O    1 ? 
HETATM 4963 O  O    . HOH   C 3 .   ? -21.537 16.231  -33.68  1   30     ? 2116 HOH   A O    1 ? 
HETATM 4964 O  O    . HOH   C 3 .   ? -5.079  17.984  -21.175 1   14.59  ? 2117 HOH   A O    1 ? 
HETATM 4965 O  O    . HOH   C 3 .   ? 8.391   24.685  -42.458 1   41.17  ? 2118 HOH   A O    1 ? 
HETATM 4966 O  O    . HOH   C 3 .   ? -1.522  6.665   -16.779 1   17.07  ? 2119 HOH   A O    1 ? 
HETATM 4967 O  O    . HOH   C 3 .   ? -4.779  8.362   -23.639 1   27.29  ? 2120 HOH   A O    1 ? 
HETATM 4968 O  O    . HOH   C 3 .   ? -6.612  14.294  -34.694 1   18.2   ? 2121 HOH   A O    1 ? 
HETATM 4969 O  O    . HOH   C 3 .   ? -7.537  18.062  -20.471 1   22.68  ? 2122 HOH   A O    1 ? 
HETATM 4970 O  O    . HOH   C 3 .   ? 10.031  21.208  -5.371  1   35.75  ? 2123 HOH   A O    1 ? 
HETATM 4971 O  O    . HOH   C 3 .   ? -6.825  20.862  -23.543 1   20.93  ? 2124 HOH   A O    1 ? 
HETATM 4972 O  O    . HOH   C 3 .   ? -7.552  15.173  -43.239 1   22.83  ? 2125 HOH   A O    1 ? 
HETATM 4973 O  O    . HOH   C 3 .   ? 7.219   4.762   -29.779 1   33.13  ? 2126 HOH   A O    1 ? 
HETATM 4974 O  O    . HOH   C 3 .   ? 13.325  2.724   -27.361 1   41.89  ? 2127 HOH   A O    1 ? 
HETATM 4975 O  O    . HOH   C 3 .   ? 2.217   23.556  -8.201  1   21.39  ? 2128 HOH   A O    1 ? 
HETATM 4976 O  O    . HOH   C 3 .   ? -1.66   -0.129  -31.276 1   39.8   ? 2129 HOH   A O    1 ? 
HETATM 4977 O  O    . HOH   C 3 .   ? 1.668   33.743  -34.843 1   35.94  ? 2130 HOH   A O    1 ? 
HETATM 4978 O  O    . HOH   C 3 .   ? 7.283   -3.007  -24.588 1   34.53  ? 2131 HOH   A O    1 ? 
HETATM 4979 O  O    . HOH   C 3 .   ? 15.573  30.482  -34.712 1   35.81  ? 2132 HOH   A O    1 ? 
HETATM 4980 O  O    . HOH   C 3 .   ? 13.127  21.857  -42.373 1   33.95  ? 2133 HOH   A O    1 ? 
HETATM 4981 O  O    . HOH   C 3 .   ? -4.254  18.481  -14.485 1   34.97  ? 2134 HOH   A O    1 ? 
HETATM 4982 O  O    . HOH   C 3 .   ? 16.651  8.009   -18.345 1   26.23  ? 2135 HOH   A O    1 ? 
HETATM 4983 O  O    . HOH   C 3 .   ? 7.185   -4.491  -17.887 1   47.78  ? 2136 HOH   A O    1 ? 
HETATM 4984 O  O    . HOH   C 3 .   ? 9.451   -1.282  -25.561 1   42.81  ? 2137 HOH   A O    1 ? 
HETATM 4985 O  O    . HOH   C 3 .   ? -7.396  12.136  -30.874 1   8.93   ? 2138 HOH   A O    1 ? 
HETATM 4986 O  O    . HOH   C 3 .   ? -1.378  28.547  -32.118 1   23.69  ? 2139 HOH   A O    1 ? 
HETATM 4987 O  O    . HOH   C 3 .   ? -5.313  9.712   -10.05  1   55.51  ? 2140 HOH   A O    1 ? 
HETATM 4988 O  O    . HOH   C 3 .   ? -5.374  21.06   -14.646 1   46.61  ? 2141 HOH   A O    1 ? 
HETATM 4989 O  O    . HOH   C 3 .   ? 9.137   4.591   -4.198  1   39.28  ? 2142 HOH   A O    1 ? 
HETATM 4990 O  O    . HOH   C 3 .   ? 15.867  18.157  -23.269 1   26.71  ? 2143 HOH   A O    1 ? 
HETATM 4991 O  O    . HOH   C 3 .   ? 11.086  5.038   -28.856 1   35.2   ? 2144 HOH   A O    1 ? 
HETATM 4992 O  O    . HOH   C 3 .   ? -9.444  0.919   -19.198 1   22.47  ? 2145 HOH   A O    1 ? 
HETATM 4993 O  O    . HOH   C 3 .   ? 13.841  4.477   -37.816 1   39.37  ? 2146 HOH   A O    1 ? 
HETATM 4994 O  O    . HOH   C 3 .   ? -1.193  7.948   -23.593 1   21.8   ? 2147 HOH   A O    1 ? 
HETATM 4995 O  O    . HOH   C 3 .   ? -4.907  11.239  -22.085 1   31.05  ? 2148 HOH   A O    1 ? 
HETATM 4996 O  O    . HOH   C 3 .   ? 9.648   13.635  -8.042  1   39.49  ? 2149 HOH   A O    1 ? 
HETATM 4997 O  O    . HOH   C 3 .   ? 11.792  19.056  -40.679 1   56.45  ? 2150 HOH   A O    1 ? 
HETATM 4998 O  O    . HOH   C 3 .   ? -16.157 16.036  -20.07  1   46     ? 2151 HOH   A O    1 ? 
HETATM 4999 O  O    . HOH   C 3 .   ? 0.616   -9.046  -27.015 1   45.46  ? 2152 HOH   A O    1 ? 
HETATM 5000 O  O    . HOH   C 3 .   ? -16.497 19.114  -26.133 1   37.05  ? 2153 HOH   A O    1 ? 
HETATM 5001 O  O    . HOH   C 3 .   ? -1.332  11.832  -43.528 1   34.95  ? 2154 HOH   A O    1 ? 
HETATM 5002 O  O    . HOH   C 3 .   ? -10.702 25.468  -26.712 1   18.6   ? 2155 HOH   A O    1 ? 
HETATM 5003 O  O    . HOH   C 3 .   ? -2.25   1.734   -12.661 1   44.98  ? 2156 HOH   A O    1 ? 
HETATM 5004 O  O    . HOH   C 3 .   ? -1.761  24.117  -12.191 1   28.29  ? 2157 HOH   A O    1 ? 
HETATM 5005 O  O    . HOH   C 3 .   ? 3.064   25.555  -6.134  1   38.98  ? 2158 HOH   A O    1 ? 
HETATM 5006 O  O    . HOH   C 3 .   ? -10.834 0.933   -21.897 1   29.75  ? 2159 HOH   A O    1 ? 
HETATM 5007 O  O    . HOH   C 3 .   ? 5.509   23.631  0.189   1   43.78  ? 2160 HOH   A O    1 ? 
HETATM 5008 O  O    . HOH   C 3 .   ? -12.154 18.55   -25.167 1   32.17  ? 2161 HOH   A O    1 ? 
HETATM 5009 O  O    . HOH   C 3 .   ? -6.873  19.012  -41.728 1   23.64  ? 2162 HOH   A O    1 ? 
HETATM 5010 O  O    . HOH   C 3 .   ? 5.122   29.713  -8.93   1   38.49  ? 2163 HOH   A O    1 ? 
HETATM 5011 O  O    . HOH   C 3 .   ? 4.395   26.394  -43.33  1   28.76  ? 2164 HOH   A O    1 ? 
HETATM 5012 O  O    . HOH   C 3 .   ? -4.069  6.127   -25.878 1   50.81  ? 2165 HOH   A O    1 ? 
HETATM 5013 O  O    . HOH   C 3 .   ? 16.297  12.058  -21.193 1   31.41  ? 2166 HOH   A O    1 ? 
HETATM 5014 O  O    . HOH   C 3 .   ? -21.871 10.879  -26.013 1   33.56  ? 2167 HOH   A O    1 ? 
HETATM 5015 O  O    A HOH   C 3 .   ? -10.519 23.162  -30.903 0.5 17.31  ? 2168 HOH   A O    1 ? 
HETATM 5016 O  O    B HOH   C 3 .   ? -8.535  25.004  -31.735 0.5 20.57  ? 2168 HOH   A O    1 ? 
HETATM 5017 O  O    . HOH   C 3 .   ? 11.124  24.717  -43.587 1   51.56  ? 2169 HOH   A O    1 ? 
HETATM 5018 O  O    . HOH   C 3 .   ? 0.578   33.865  -29.823 1   40.81  ? 2170 HOH   A O    1 ? 
HETATM 5019 O  O    . HOH   C 3 .   ? 13.875  18.458  -2.83   1   30.83  ? 2171 HOH   A O    1 ? 
HETATM 5020 O  O    . HOH   C 3 .   ? -2.9    -0.411  -36.229 1   30.5   ? 2172 HOH   A O    1 ? 
HETATM 5021 O  O    . HOH   C 3 .   ? -3.487  7.592   -41.754 1   16.03  ? 2173 HOH   A O    1 ? 
HETATM 5022 O  O    . HOH   C 3 .   ? -10.904 20.898  -32.679 1   21.07  ? 2174 HOH   A O    1 ? 
HETATM 5023 O  O    . HOH   C 3 .   ? -1.796  4.493   -42.161 1   28.79  ? 2175 HOH   A O    1 ? 
HETATM 5024 O  O    . HOH   C 3 .   ? -9.394  17.201  -41.368 1   44.69  ? 2176 HOH   A O    1 ? 
HETATM 5025 O  O    . HOH   C 3 .   ? 13.359  35.458  -13.227 1   37.45  ? 2177 HOH   A O    1 ? 
HETATM 5026 O  O    . HOH   C 3 .   ? 13.663  11.577  -36.969 1   41.52  ? 2178 HOH   A O    1 ? 
HETATM 5027 O  O    . HOH   C 3 .   ? 15.162  20.472  -24.16  1   21.54  ? 2179 HOH   A O    1 ? 
HETATM 5028 O  O    . HOH   C 3 .   ? -0.812  -1.626  -13.433 1   30.02  ? 2180 HOH   A O    1 ? 
HETATM 5029 O  O    . HOH   C 3 .   ? -0.659  13.831  5.693   1   41.1   ? 2181 HOH   A O    1 ? 
HETATM 5030 O  O    . HOH   C 3 .   ? 2.307   6.561   7.443   1   40.6   ? 2182 HOH   A O    1 ? 
HETATM 5031 O  O    . HOH   C 3 .   ? 11.406  8.506   -12.866 1   25.36  ? 2183 HOH   A O    1 ? 
HETATM 5032 O  O    . HOH   C 3 .   ? 19.885  17.595  -25.936 1   35.58  ? 2184 HOH   A O    1 ? 
HETATM 5033 O  O    . HOH   C 3 .   ? -6.408  7.956   -11.871 1   33.84  ? 2185 HOH   A O    1 ? 
HETATM 5034 O  O    . HOH   C 3 .   ? 17.861  24.952  -25.619 1   38.35  ? 2186 HOH   A O    1 ? 
HETATM 5035 O  O    . HOH   C 3 .   ? 1.523   28.069  -10.383 1   37.18  ? 2187 HOH   A O    1 ? 
HETATM 5036 O  O    . HOH   C 3 .   ? -18.046 24.234  -26.177 1   48.54  ? 2188 HOH   A O    1 ? 
HETATM 5037 O  O    . HOH   C 3 .   ? -0.257  -2.356  -35.526 1   45.15  ? 2189 HOH   A O    1 ? 
HETATM 5038 O  O    A HOH   C 3 .   ? -3.306  11.2    -41.325 0.5 18.28  ? 2190 HOH   A O    1 ? 
HETATM 5039 O  O    . HOH   C 3 .   ? 8.301   4.762   -38.775 1   45.52  ? 2191 HOH   A O    1 ? 
HETATM 5040 O  O    . HOH   C 3 .   ? 3.855   15.922  -32.398 1   40.87  ? 2192 HOH   A O    1 ? 
HETATM 5041 O  O    . HOH   C 3 .   ? -8.736  19.691  -22.151 1   28     ? 2193 HOH   A O    1 ? 
HETATM 5042 O  O    . HOH   C 3 .   ? -9.609  1.849   -16.773 1   35.51  ? 2194 HOH   A O    1 ? 
HETATM 5043 O  O    . HOH   C 3 .   ? -16.512 3.14    -30.422 1   48.78  ? 2195 HOH   A O    1 ? 
HETATM 5044 O  O    . HOH   C 3 .   ? 12.857  10.314  -0.461  1   46.53  ? 2196 HOH   A O    1 ? 
HETATM 5045 O  O    . HOH   C 3 .   ? -12.261 17.426  -36.132 1   49.91  ? 2197 HOH   A O    1 ? 
HETATM 5046 O  O    . HOH   C 3 .   ? 18.214  22.867  -27.861 1   38.5   ? 2198 HOH   A O    1 ? 
HETATM 5047 O  O    . HOH   C 3 .   ? -7.57   20.08   -16.761 1   51.33  ? 2199 HOH   A O    1 ? 
HETATM 5048 O  O    . HOH   C 3 .   ? -0.257  24.876  -9.129  1   44.08  ? 2200 HOH   A O    1 ? 
HETATM 5049 O  O    . HOH   C 3 .   ? 11.39   42.982  -24.435 1   50.12  ? 2201 HOH   A O    1 ? 
HETATM 5050 O  O    . HOH   C 3 .   ? -2.187  31.292  -32.328 1   40.83  ? 2202 HOH   A O    1 ? 
HETATM 5051 O  O    . HOH   C 3 .   ? -6.427  16.986  -15.084 1   30.84  ? 2203 HOH   A O    1 ? 
HETATM 5052 O  O    . HOH   C 3 .   ? -6.261  25.711  -33.667 1   32.54  ? 2204 HOH   A O    1 ? 
HETATM 5053 O  O    . HOH   C 3 .   ? -11.256 22.907  -36.941 1   22.73  ? 2205 HOH   A O    1 ? 
HETATM 5054 O  O    . HOH   C 3 .   ? 9.381   25.576  -4.548  1   58.31  ? 2206 HOH   A O    1 ? 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N  N   . ALA   A 9   ? 0.676  0.5713 0.9246 0.2358  0.0274  0.0404  702  ALA   A N   
2    C  CA  . ALA   A 9   ? 0.6696 0.5791 0.9481 0.2119  0.0255  0.0401  702  ALA   A CA  
3    C  C   . ALA   A 9   ? 0.6821 0.5825 0.9521 0.2168  0.0258  0.0423  702  ALA   A C   
4    O  O   . ALA   A 9   ? 0.7088 0.5662 0.9471 0.2209  0.0336  0.0436  702  ALA   A O   
5    C  CB  . ALA   A 9   ? 0.6832 0.5644 0.9595 0.1897  0.0324  0.0387  702  ALA   A CB  
10   N  N   . LEU   A 10  ? 0.6625 0.6015 0.9586 0.2161  0.0173  0.0427  703  LEU   A N   
11   C  CA  . LEU   A 10  ? 0.6744 0.61   0.965  0.2215  0.0159  0.0444  703  LEU   A CA  
12   C  C   . LEU   A 10  ? 0.6673 0.6195 0.986  0.2011  0.0122  0.044   703  LEU   A C   
13   O  O   . LEU   A 10  ? 0.6496 0.6383 0.9968 0.1927  0.004   0.0429  703  LEU   A O   
14   C  CB  . LEU   A 10  ? 0.6682 0.636  0.9604 0.2419  0.0075  0.0451  703  LEU   A CB  
15   C  CG  . LEU   A 10  ? 0.7073 0.6581 0.9646 0.2699  0.0109  0.0462  703  LEU   A CG  
16   C  CD1 . LEU   A 10  ? 0.6949 0.6943 0.9639 0.2864  0.0016  0.0464  703  LEU   A CD1 
17   C  CD2 . LEU   A 10  ? 0.739  0.6545 0.9656 0.2824  0.0159  0.048   703  LEU   A CD2 
29   N  N   . LEU   A 11  ? 0.6803 0.6059 0.9889 0.1941  0.0181  0.0453  704  LEU   A N   
30   C  CA  . LEU   A 11  ? 0.6756 0.6142 1.0059 0.1782  0.0153  0.0453  704  LEU   A CA  
31   C  C   . LEU   A 11  ? 0.6792 0.6223 1.0047 0.1887  0.0106  0.0467  704  LEU   A C   
32   O  O   . LEU   A 11  ? 0.6986 0.6139 0.9985 0.1992  0.0164  0.0487  704  LEU   A O   
33   C  CB  . LEU   A 11  ? 0.6917 0.603  1.0153 0.1628  0.0252  0.0462  704  LEU   A CB  
34   C  CG  . LEU   A 11  ? 0.7108 0.6177 1.0417 0.1466  0.0301  0.0445  704  LEU   A CG  
35   C  CD1 . LEU   A 11  ? 0.7246 0.6139 1.0522 0.1303  0.0385  0.0459  704  LEU   A CD1 
36   C  CD2 . LEU   A 11  ? 0.6973 0.64   1.0598 0.1371  0.0223  0.0421  704  LEU   A CD2 
48   N  N   . ARG   A 12  ? 0.6605 0.6357 1.008  0.1849  0       0.0457  705  ARG   A N   
49   C  CA  . ARG   A 12  ? 0.6679 0.6472 1.0111 0.1926  -0.0056 0.0466  705  ARG   A CA  
50   C  C   . ARG   A 12  ? 0.6768 0.6376 1.0182 0.1828  -0.0008 0.0477  705  ARG   A C   
51   O  O   . ARG   A 12  ? 0.6729 0.6369 1.029  0.1671  0.0013  0.047   705  ARG   A O   
52   C  CB  . ARG   A 12  ? 0.6698 0.6868 1.0348 0.1883  -0.019  0.045   705  ARG   A CB  
53   C  CG  . ARG   A 12  ? 0.7078 0.7518 1.0748 0.1999  -0.0254 0.0446  705  ARG   A CG  
54   C  CD  . ARG   A 12  ? 0.7339 0.8154 1.1205 0.1927  -0.0389 0.0435  705  ARG   A CD  
55   N  NE  . ARG   A 12  ? 0.7724 0.8504 1.1533 0.1936  -0.045  0.0435  705  ARG   A NE  
56   C  CZ  . ARG   A 12  ? 0.8045 0.8831 1.17   0.2096  -0.048  0.0442  705  ARG   A CZ  
57   N  NH1 . ARG   A 12  ? 0.8013 0.8751 1.1618 0.2087  -0.0538 0.0439  705  ARG   A NH1 
58   N  NH2 . ARG   A 12  ? 0.8073 0.8903 1.1602 0.228   -0.0452 0.0451  705  ARG   A NH2 
72   N  N   . ILE   A 13  ? 0.6862 0.6298 1.0095 0.1931  0.0012  0.0497  706  ILE   A N   
73   C  CA  . ILE   A 13  ? 0.6956 0.6256 1.0168 0.186   0.0054  0.0513  706  ILE   A CA  
74   C  C   . ILE   A 13  ? 0.6893 0.6357 1.0169 0.1893  -0.0058 0.0504  706  ILE   A C   
75   O  O   . ILE   A 13  ? 0.6965 0.6405 1.0105 0.2038  -0.0097 0.0509  706  ILE   A O   
76   C  CB  . ILE   A 13  ? 0.7249 0.6201 1.0187 0.1932  0.0171  0.0547  706  ILE   A CB  
77   C  CG1 . ILE   A 13  ? 0.75   0.6227 1.029  0.1919  0.0271  0.0554  706  ILE   A CG1 
78   C  CG2 . ILE   A 13  ? 0.7334 0.6215 1.029  0.1837  0.0222  0.0568  706  ILE   A CG2 
79   C  CD1 . ILE   A 13  ? 0.7591 0.6365 1.0542 0.1723  0.0314  0.0541  706  ILE   A CD1 
91   N  N   . LEU   A 14  ? 0.6751 0.6369 1.0211 0.1764  -0.0115 0.0489  707  LEU   A N   
92   C  CA  . LEU   A 14  ? 0.6731 0.6467 1.0224 0.1771  -0.023  0.0477  707  LEU   A CA  
93   C  C   . LEU   A 14  ? 0.6864 0.6411 1.0234 0.1798  -0.0187 0.0497  707  LEU   A C   
94   O  O   . LEU   A 14  ? 0.6904 0.639  1.0313 0.1716  -0.0111 0.0509  707  LEU   A O   
95   C  CB  . LEU   A 14  ? 0.6608 0.6562 1.0311 0.1626  -0.0316 0.0452  707  LEU   A CB  
96   C  CG  . LEU   A 14  ? 0.6677 0.683  1.0535 0.1565  -0.0331 0.0438  707  LEU   A CG  
97   C  CD1 . LEU   A 14  ? 0.6619 0.6963 1.0653 0.1424  -0.0421 0.0418  707  LEU   A CD1 
98   C  CD2 . LEU   A 14  ? 0.6737 0.7019 1.0547 0.1684  -0.0376 0.0437  707  LEU   A CD2 
110  N  N   . LYS   A 15  ? 0.6923 0.6389 1.0135 0.1924  -0.0228 0.0504  708  LYS   A N   
111  C  CA  . LYS   A 15  ? 0.7074 0.6358 1.014  0.198   -0.0186 0.0527  708  LYS   A CA  
112  C  C   . LYS   A 15  ? 0.7073 0.6398 1.0219 0.1888  -0.0217 0.0521  708  LYS   A C   
113  O  O   . LYS   A 15  ? 0.7043 0.6509 1.0299 0.1811  -0.0321 0.0492  708  LYS   A O   
114  C  CB  . LYS   A 15  ? 0.7369 0.6596 1.0266 0.2128  -0.0259 0.0526  708  LYS   A CB  
115  C  CG  . LYS   A 15  ? 0.7969 0.7027 1.0671 0.228   -0.0181 0.055   708  LYS   A CG  
116  C  CD  . LYS   A 15  ? 0.8575 0.7568 1.1097 0.2433  -0.0248 0.055   708  LYS   A CD  
117  C  CE  . LYS   A 15  ? 0.9007 0.8203 1.1552 0.2497  -0.0368 0.0521  708  LYS   A CE  
118  N  NZ  . LYS   A 15  ? 0.9354 0.8548 1.1771 0.2594  -0.047  0.0509  708  LYS   A NZ  
132  N  N   . GLU   A 16  ? 0.7098 0.6297 1.0166 0.1902  -0.0124 0.055   709  GLU   A N   
133  C  CA  . GLU   A 16  ? 0.7085 0.6315 1.0185 0.1856  -0.0138 0.055   709  GLU   A CA  
134  C  C   . GLU   A 16  ? 0.7095 0.629  1.009  0.1921  -0.0272 0.053   709  GLU   A C   
135  O  O   . GLU   A 16  ? 0.7067 0.6326 1.0119 0.1853  -0.0354 0.0506  709  GLU   A O   
136  C  CB  . GLU   A 16  ? 0.7455 0.6589 1.0467 0.1886  -0.0006 0.0595  709  GLU   A CB  
137  C  CG  . GLU   A 16  ? 0.8146 0.7333 1.1164 0.1878  -0.0006 0.0601  709  GLU   A CG  
138  C  CD  . GLU   A 16  ? 0.9029 0.8184 1.197  0.1907  0.0129  0.0652  709  GLU   A CD  
139  O  OE1 . GLU   A 16  ? 0.9201 0.8357 1.2182 0.1832  0.0242  0.0676  709  GLU   A OE1 
140  O  OE2 . GLU   A 16  ? 0.933  0.8453 1.2153 0.2003  0.0121  0.0668  709  GLU   A OE2 
147  N  N   . THR   A 17  ? 0.7141 0.6218 0.9964 0.205   -0.0298 0.0537  710  THR   A N   
148  C  CA  . THR   A 17  ? 0.7227 0.6242 0.9912 0.2114  -0.0429 0.0516  710  THR   A CA  
149  C  C   . THR   A 17  ? 0.7142 0.6298 0.9919 0.2016  -0.0576 0.0473  710  THR   A C   
150  O  O   . THR   A 17  ? 0.7253 0.6349 0.9917 0.2018  -0.0696 0.0452  710  THR   A O   
151  C  CB  . THR   A 17  ? 0.751  0.6393 1.0003 0.2271  -0.0423 0.0531  710  THR   A CB  
152  O  OG1 . THR   A 17  ? 0.7616 0.6563 1.0157 0.2291  -0.039  0.0532  710  THR   A OG1 
153  C  CG2 . THR   A 17  ? 0.7657 0.6373 1.0003 0.2373  -0.0304 0.0575  710  THR   A CG2 
161  N  N   . GLU   A 18  ? 0.6929 0.6262 0.989  0.1927  -0.057  0.0463  711  GLU   A N   
162  C  CA  . GLU   A 18  ? 0.6807 0.6318 0.9871 0.1822  -0.0699 0.0431  711  GLU   A CA  
163  C  C   . GLU   A 18  ? 0.6696 0.6237 0.9841 0.1681  -0.0749 0.0414  711  GLU   A C   
164  O  O   . GLU   A 18  ? 0.6684 0.6313 0.9848 0.1586  -0.0873 0.0389  711  GLU   A O   
165  C  CB  . GLU   A 18  ? 0.6985 0.6691 1.0199 0.1805  -0.0668 0.0431  711  GLU   A CB  
166  C  CG  . GLU   A 18  ? 0.7591 0.7295 1.0694 0.1954  -0.0661 0.0439  711  GLU   A CG  
167  C  CD  . GLU   A 18  ? 0.8256 0.8091 1.1447 0.1986  -0.0602 0.0446  711  GLU   A CD  
168  O  OE1 . GLU   A 18  ? 0.8322 0.8292 1.1685 0.1875  -0.0588 0.0439  711  GLU   A OE1 
169  O  OE2 . GLU   A 18  ? 0.8529 0.8315 1.1592 0.2135  -0.057  0.0457  711  GLU   A OE2 
176  N  N   . PHE   A 19  ? 0.6588 0.6064 0.9769 0.1663  -0.0656 0.0428  712  PHE   A N   
177  C  CA  . PHE   A 19  ? 0.6516 0.6013 0.9755 0.1552  -0.0694 0.0412  712  PHE   A CA  
178  C  C   . PHE   A 19  ? 0.6542 0.5835 0.9565 0.1604  -0.0752 0.0408  712  PHE   A C   
179  O  O   . PHE   A 19  ? 0.6656 0.5816 0.9537 0.1731  -0.0696 0.0429  712  PHE   A O   
180  C  CB  . PHE   A 19  ? 0.6455 0.6032 0.9852 0.151   -0.0568 0.0427  712  PHE   A CB  
181  C  CG  . PHE   A 19  ? 0.6453 0.6185 1.003  0.1458  -0.0508 0.0429  712  PHE   A CG  
182  C  CD1 . PHE   A 19  ? 0.6463 0.6361 1.0193 0.1346  -0.0566 0.0409  712  PHE   A CD1 
183  C  CD2 . PHE   A 19  ? 0.658  0.6271 1.0148 0.1522  -0.0388 0.0454  712  PHE   A CD2 
184  C  CE1 . PHE   A 19  ? 0.6476 0.6504 1.0344 0.1321  -0.0509 0.0411  712  PHE   A CE1 
185  C  CE2 . PHE   A 19  ? 0.6605 0.6388 1.0289 0.1487  -0.0335 0.0455  712  PHE   A CE2 
186  C  CZ  . PHE   A 19  ? 0.6485 0.6438 1.0316 0.1397  -0.0397 0.0432  712  PHE   A CZ  
196  N  N   . LYS   A 20  ? 0.6421 0.5674 0.9397 0.1508  -0.086  0.0383  713  LYS   A N   
197  C  CA  . LYS   A 20  ? 0.6507 0.552  0.9228 0.1556  -0.0929 0.0375  713  LYS   A CA  
198  C  C   . LYS   A 20  ? 0.6389 0.5381 0.9121 0.1463  -0.0955 0.0361  713  LYS   A C   
199  O  O   . LYS   A 20  ? 0.6273 0.5443 0.9211 0.1336  -0.0949 0.0354  713  LYS   A O   
200  C  CB  . LYS   A 20  ? 0.6835 0.5707 0.935  0.1544  -0.1078 0.0352  713  LYS   A CB  
201  C  CG  . LYS   A 20  ? 0.7361 0.6243 0.9829 0.1652  -0.1071 0.0361  713  LYS   A CG  
202  C  CD  . LYS   A 20  ? 0.8047 0.674  1.0328 0.184   -0.0996 0.0385  713  LYS   A CD  
203  C  CE  . LYS   A 20  ? 0.8487 0.725  1.0816 0.1946  -0.0915 0.0408  713  LYS   A CE  
204  N  NZ  . LYS   A 20  ? 0.885  0.7476 1.1044 0.2108  -0.0809 0.0442  713  LYS   A NZ  
218  N  N   . LYS   A 21  ? 0.6412 0.5175 0.8898 0.1544  -0.0981 0.0359  714  LYS   A N   
219  C  CA  . LYS   A 21  ? 0.6415 0.5103 0.8839 0.1496  -0.1006 0.0347  714  LYS   A CA  
220  C  C   . LYS   A 21  ? 0.6128 0.5068 0.8831 0.1457  -0.0887 0.0359  714  LYS   A C   
221  O  O   . LYS   A 21  ? 0.6105 0.5094 0.8883 0.1345  -0.0917 0.0344  714  LYS   A O   
222  C  CB  . LYS   A 21  ? 0.672  0.5302 0.9051 0.1332  -0.1154 0.0318  714  LYS   A CB  
223  C  CG  . LYS   A 21  ? 0.7427 0.5716 0.9427 0.1346  -0.129  0.0301  714  LYS   A CG  
224  C  CD  . LYS   A 21  ? 0.8087 0.6239 0.9954 0.1159  -0.143  0.0276  714  LYS   A CD  
225  C  CE  . LYS   A 21  ? 0.8756 0.6677 1.0341 0.111   -0.1577 0.0257  714  LYS   A CE  
226  N  NZ  . LYS   A 21  ? 0.9091 0.6923 1.0572 0.088   -0.1712 0.0237  714  LYS   A NZ  
240  N  N   . ILE   A 22  ? 0.59   0.499  0.8738 0.154   -0.0752 0.0386  715  ILE   A N   
241  C  CA  . ILE   A 22  ? 0.5687 0.5012 0.8774 0.1488  -0.0643 0.0395  715  ILE   A CA  
242  C  C   . ILE   A 22  ? 0.5678 0.4963 0.865  0.1561  -0.0624 0.0396  715  ILE   A C   
243  O  O   . ILE   A 22  ? 0.5767 0.4955 0.8552 0.1712  -0.0597 0.0414  715  ILE   A O   
244  C  CB  . ILE   A 22  ? 0.563  0.5112 0.8874 0.1522  -0.0509 0.0425  715  ILE   A CB  
245  C  CG1 . ILE   A 22  ? 0.5691 0.5192 0.9011 0.1479  -0.0528 0.0423  715  ILE   A CG1 
246  C  CG2 . ILE   A 22  ? 0.5535 0.5244 0.901  0.1445  -0.0407 0.043   715  ILE   A CG2 
247  C  CD1 . ILE   A 22  ? 0.583  0.5342 0.9154 0.1557  -0.0423 0.0454  715  ILE   A CD1 
259  N  N   . LYS   A 23  ? 0.5559 0.4922 0.8628 0.1469  -0.0639 0.0379  716  LYS   A N   
260  C  CA  . LYS   A 23  ? 0.5606 0.4942 0.8561 0.1541  -0.0629 0.0376  716  LYS   A CA  
261  C  C   . LYS   A 23  ? 0.5375 0.498  0.8605 0.1443  -0.0558 0.0371  716  LYS   A C   
262  O  O   . LYS   A 23  ? 0.5309 0.5002 0.8726 0.1297  -0.058  0.0357  716  LYS   A O   
263  C  CB  . LYS   A 23  ? 0.6045 0.5071 0.8708 0.1535  -0.0769 0.0351  716  LYS   A CB  
264  C  CG  . LYS   A 23  ? 0.6703 0.5662 0.9227 0.159   -0.0777 0.0341  716  LYS   A CG  
265  C  CD  . LYS   A 23  ? 0.7523 0.6087 0.9673 0.1592  -0.0916 0.032   716  LYS   A CD  
266  C  CE  . LYS   A 23  ? 0.8045 0.6521 1.0055 0.1624  -0.093  0.0308  716  LYS   A CE  
267  N  NZ  . LYS   A 23  ? 0.858  0.6624 1.0202 0.1588  -0.1069 0.0288  716  LYS   A NZ  
281  N  N   . VAL   A 24  ? 0.5231 0.4982 0.8478 0.153   -0.0477 0.0382  717  VAL   A N   
282  C  CA  . VAL   A 24  ? 0.5055 0.5076 0.8547 0.1448  -0.0408 0.0376  717  VAL   A CA  
283  C  C   . VAL   A 24  ? 0.5014 0.4958 0.8505 0.135   -0.0493 0.0345  717  VAL   A C   
284  O  O   . VAL   A 24  ? 0.5181 0.4868 0.8411 0.1396  -0.0587 0.0333  717  VAL   A O   
285  C  CB  . VAL   A 24  ? 0.5137 0.5343 0.8601 0.158   -0.032  0.0394  717  VAL   A CB  
286  C  CG1 . VAL   A 24  ? 0.505  0.5523 0.8729 0.1501  -0.0269 0.0381  717  VAL   A CG1 
287  C  CG2 . VAL   A 24  ? 0.5145 0.5491 0.866  0.1636  -0.0217 0.0431  717  VAL   A CG2 
297  N  N   . LEU   A 25  ? 0.4791 0.494  0.8551 0.1212  -0.0458 0.0334  718  LEU   A N   
298  C  CA  . LEU   A 25  ? 0.4788 0.4916 0.8584 0.1113  -0.0519 0.031   718  LEU   A CA  
299  C  C   . LEU   A 25  ? 0.4689 0.5042 0.8607 0.1129  -0.0448 0.0303  718  LEU   A C   
300  O  O   . LEU   A 25  ? 0.4828 0.5104 0.8624 0.1158  -0.0491 0.0289  718  LEU   A O   
301  C  CB  . LEU   A 25  ? 0.4696 0.4901 0.8702 0.095   -0.0541 0.0303  718  LEU   A CB  
302  C  CG  . LEU   A 25  ? 0.4958 0.4975 0.885  0.0876  -0.0655 0.0298  718  LEU   A CG  
303  C  CD1 . LEU   A 25  ? 0.49   0.5087 0.9033 0.0752  -0.0648 0.0298  718  LEU   A CD1 
304  C  CD2 . LEU   A 25  ? 0.5169 0.5003 0.8878 0.0832  -0.0751 0.0284  718  LEU   A CD2 
316  N  N   . GLY   A 26  ? 0.4454 0.5072 0.8591 0.1106  -0.0343 0.0313  719  GLY   A N   
317  C  CA  . GLY   A 26  ? 0.4322 0.5196 0.8592 0.1108  -0.0274 0.0306  719  GLY   A CA  
318  C  C   . GLY   A 26  ? 0.4154 0.529  0.8636 0.1053  -0.0161 0.032   719  GLY   A C   
319  O  O   . GLY   A 26  ? 0.4189 0.5281 0.8717 0.1009  -0.0133 0.0336  719  GLY   A O   
323  N  N   . SER   A 27  ? 0.3952 0.5356 0.8544 0.1052  -0.0098 0.0315  720  SER   A N   
324  C  CA  . SER   A 27  ? 0.381  0.5482 0.8589 0.0973  0.0008  0.0328  720  SER   A CA  
325  C  C   . SER   A 27  ? 0.3611 0.5532 0.8568 0.0885  0.0036  0.0302  720  SER   A C   
326  O  O   . SER   A 27  ? 0.3643 0.5577 0.8556 0.0938  -0.0012 0.028   720  SER   A O   
327  C  CB  . SER   A 27  ? 0.4028 0.584  0.8715 0.1092  0.0073  0.0362  720  SER   A CB  
328  O  OG  . SER   A 27  ? 0.4489 0.6116 0.9059 0.114   0.0077  0.0391  720  SER   A OG  
334  N  N   . GLY   A 28  ? 0.3411 0.5503 0.8544 0.0749  0.0113  0.0304  721  GLY   A N   
335  C  CA  . GLY   A 28  ? 0.3239 0.5569 0.8543 0.0645  0.0142  0.0277  721  GLY   A CA  
336  C  C   . GLY   A 28  ? 0.3102 0.55   0.8543 0.0475  0.0215  0.028   721  GLY   A C   
337  O  O   . GLY   A 28  ? 0.3153 0.5497 0.855  0.0454  0.0267  0.0311  721  GLY   A O   
341  N  N   . ALA   A 29  ? 0.2937 0.542  0.8514 0.0354  0.0217  0.0248  722  ALA   A N   
342  C  CA  . ALA   A 29  ? 0.2866 0.5363 0.853  0.0184  0.028   0.0245  722  ALA   A CA  
343  C  C   . ALA   A 29  ? 0.2891 0.5076 0.8483 0.0157  0.0277  0.0259  722  ALA   A C   
344  O  O   . ALA   A 29  ? 0.2954 0.5083 0.8533 0.0052  0.0342  0.0271  722  ALA   A O   
345  C  CB  . ALA   A 29  ? 0.2838 0.5444 0.8629 0.0086  0.0267  0.0204  722  ALA   A CB  
351  N  N   . PHE   A 30  ? 0.2804 0.4785 0.8331 0.025   0.0201  0.0257  723  PHE   A N   
352  C  CA  . PHE   A 30  ? 0.2814 0.4535 0.8262 0.0261  0.0185  0.0271  723  PHE   A CA  
353  C  C   . PHE   A 30  ? 0.2881 0.4505 0.8202 0.0328  0.022   0.031   723  PHE   A C   
354  O  O   . PHE   A 30  ? 0.3015 0.4437 0.8261 0.0337  0.0222  0.0323  723  PHE   A O   
355  C  CB  . PHE   A 30  ? 0.2791 0.4387 0.8216 0.0328  0.0085  0.0258  723  PHE   A CB  
356  C  CG  . PHE   A 30  ? 0.2784 0.4378 0.8123 0.044   0.0024  0.0262  723  PHE   A CG  
357  C  CD1 . PHE   A 30  ? 0.293  0.4379 0.8122 0.0537  -0.0001 0.0286  723  PHE   A CD1 
358  C  CD2 . PHE   A 30  ? 0.279  0.4496 0.8161 0.0455  -0.0012 0.0241  723  PHE   A CD2 
359  C  CE1 . PHE   A 30  ? 0.3064 0.4463 0.8129 0.0643  -0.0061 0.0288  723  PHE   A CE1 
360  C  CE2 . PHE   A 30  ? 0.294  0.4584 0.8175 0.0567  -0.007  0.0244  723  PHE   A CE2 
361  C  CZ  . PHE   A 30  ? 0.3014 0.4494 0.8088 0.0659  -0.0095 0.0267  723  PHE   A CZ  
371  N  N   . GLY   A 31  ? 0.2792 0.4561 0.8077 0.0394  0.0245  0.0328  724  GLY   A N   
372  C  CA  . GLY   A 31  ? 0.2888 0.4588 0.8046 0.0474  0.0279  0.0368  724  GLY   A CA  
373  C  C   . GLY   A 31  ? 0.297  0.4574 0.8007 0.0634  0.0199  0.0371  724  GLY   A C   
374  O  O   . GLY   A 31  ? 0.2958 0.4659 0.7999 0.0689  0.0154  0.0353  724  GLY   A O   
378  N  N   . THR   A 32  ? 0.306  0.4449 0.7964 0.0709  0.0176  0.0391  725  THR   A N   
379  C  CA  . THR   A 32  ? 0.3189 0.4434 0.7938 0.0849  0.0092  0.0392  725  THR   A CA  
380  C  C   . THR   A 32  ? 0.3232 0.425  0.7941 0.0839  0.001   0.0379  725  THR   A C   
381  O  O   . THR   A 32  ? 0.3264 0.4195 0.7984 0.0801  0.0038  0.0389  725  THR   A O   
382  C  CB  . THR   A 32  ? 0.3463 0.4692 0.8067 0.0965  0.0134  0.043   725  THR   A CB  
383  O  OG1 . THR   A 32  ? 0.3533 0.5041 0.82   0.0957  0.0221  0.0448  725  THR   A OG1 
384  C  CG2 . THR   A 32  ? 0.3629 0.4693 0.8032 0.112   0.0046  0.0428  725  THR   A CG2 
392  N  N   . VAL   A 33  ? 0.3224 0.415  0.787  0.0872  -0.0092 0.0358  726  VAL   A N   
393  C  CA  . VAL   A 33  ? 0.3303 0.4063 0.7908 0.0853  -0.0183 0.0348  726  VAL   A CA  
394  C  C   . VAL   A 33  ? 0.3483 0.4054 0.7862 0.0961  -0.0264 0.0353  726  VAL   A C   
395  O  O   . VAL   A 33  ? 0.3503 0.4052 0.7773 0.1026  -0.029  0.0348  726  VAL   A O   
396  C  CB  . VAL   A 33  ? 0.3311 0.4131 0.8036 0.0754  -0.0235 0.032   726  VAL   A CB  
397  C  CG1 . VAL   A 33  ? 0.3425 0.4116 0.8091 0.0731  -0.034  0.0314  726  VAL   A CG1 
398  C  CG2 . VAL   A 33  ? 0.3256 0.4218 0.8171 0.0657  -0.0162 0.0314  726  VAL   A CG2 
408  N  N   . TYR   A 34  ? 0.3598 0.4022 0.7886 0.0988  -0.0304 0.0362  727  TYR   A N   
409  C  CA  . TYR   A 34  ? 0.3878 0.4092 0.7935 0.1075  -0.0393 0.0364  727  TYR   A CA  
410  C  C   . TYR   A 34  ? 0.4028 0.4156 0.8072 0.0996  -0.0501 0.0349  727  TYR   A C   
411  O  O   . TYR   A 34  ? 0.3954 0.4205 0.8172 0.0905  -0.0493 0.0343  727  TYR   A O   
412  C  CB  . TYR   A 34  ? 0.3942 0.4075 0.7883 0.1183  -0.0347 0.0391  727  TYR   A CB  
413  C  CG  . TYR   A 34  ? 0.3912 0.4185 0.7905 0.1228  -0.022  0.0417  727  TYR   A CG  
414  C  CD1 . TYR   A 34  ? 0.3921 0.4304 0.8063 0.1159  -0.0125 0.0431  727  TYR   A CD1 
415  C  CD2 . TYR   A 34  ? 0.4038 0.4315 0.7892 0.1348  -0.0197 0.0432  727  TYR   A CD2 
416  C  CE1 . TYR   A 34  ? 0.396  0.4472 0.8134 0.1171  -0.0009 0.046   727  TYR   A CE1 
417  C  CE2 . TYR   A 34  ? 0.4051 0.4509 0.796  0.1379  -0.0079 0.0462  727  TYR   A CE2 
418  C  CZ  . TYR   A 34  ? 0.4059 0.4634 0.8131 0.1276  0.0014  0.0477  727  TYR   A CZ  
419  O  OH  . TYR   A 34  ? 0.4136 0.4893 0.8248 0.1279  0.0128  0.051   727  TYR   A OH  
429  N  N   . LYS   A 35  ? 0.4244 0.4169 0.8069 0.1031  -0.0604 0.0343  728  LYS   A N   
430  C  CA  . LYS   A 35  ? 0.4412 0.4271 0.8198 0.0946  -0.0716 0.0332  728  LYS   A CA  
431  C  C   . LYS   A 35  ? 0.4669 0.4363 0.8265 0.1034  -0.076  0.034   728  LYS   A C   
432  O  O   . LYS   A 35  ? 0.4822 0.4364 0.8229 0.1155  -0.0746 0.0348  728  LYS   A O   
433  C  CB  . LYS   A 35  ? 0.4681 0.4428 0.8352 0.0861  -0.0818 0.0314  728  LYS   A CB  
434  C  CG  . LYS   A 35  ? 0.5375 0.4853 0.874  0.0956  -0.0864 0.031   728  LYS   A CG  
435  C  CD  . LYS   A 35  ? 0.6047 0.5357 0.9254 0.0854  -0.0971 0.0294  728  LYS   A CD  
436  C  CE  . LYS   A 35  ? 0.6762 0.5767 0.9624 0.0969  -0.1009 0.0288  728  LYS   A CE  
437  N  NZ  . LYS   A 35  ? 0.7273 0.6005 0.9842 0.1047  -0.1081 0.0289  728  LYS   A NZ  
451  N  N   . GLY   A 36  ? 0.469  0.4434 0.8331 0.0986  -0.081  0.0338  729  GLY   A N   
452  C  CA  . GLY   A 36  ? 0.4928 0.4538 0.84   0.1064  -0.0858 0.0343  729  GLY   A CA  
453  C  C   . GLY   A 36  ? 0.5024 0.4721 0.8533 0.0975  -0.0954 0.0334  729  GLY   A C   
454  O  O   . GLY   A 36  ? 0.4928 0.4777 0.8572 0.0845  -0.0993 0.0327  729  GLY   A O   
458  N  N   . LEU   A 37  ? 0.5197 0.4817 0.8579 0.1047  -0.0994 0.0337  730  LEU   A N   
459  C  CA  . LEU   A 37  ? 0.5328 0.507  0.8735 0.0981  -0.1088 0.033   730  LEU   A CA  
460  C  C   . LEU   A 37  ? 0.5463 0.5295 0.8929 0.1102  -0.1016 0.0344  730  LEU   A C   
461  O  O   . LEU   A 37  ? 0.5573 0.5244 0.8905 0.1235  -0.0969 0.0355  730  LEU   A O   
462  C  CB  . LEU   A 37  ? 0.55   0.5037 0.8643 0.0946  -0.123  0.0314  730  LEU   A CB  
463  C  CG  . LEU   A 37  ? 0.577  0.518  0.8797 0.0796  -0.1327 0.0298  730  LEU   A CG  
464  C  CD1 . LEU   A 37  ? 0.6072 0.5152 0.875  0.0807  -0.1441 0.0283  730  LEU   A CD1 
465  C  CD2 . LEU   A 37  ? 0.5717 0.5381 0.8903 0.0607  -0.1401 0.0295  730  LEU   A CD2 
477  N  N   . TRP   A 38  ? 0.5439 0.5519 0.9089 0.107   -0.1    0.0348  731  TRP   A N   
478  C  CA  . TRP   A 38  ? 0.558  0.5727 0.9254 0.1195  -0.0935 0.0361  731  TRP   A CA  
479  C  C   . TRP   A 38  ? 0.5838 0.6083 0.9438 0.12    -0.1052 0.0353  731  TRP   A C   
480  O  O   . TRP   A 38  ? 0.5756 0.6222 0.9455 0.1084  -0.1135 0.0344  731  TRP   A O   
481  C  CB  . TRP   A 38  ? 0.5382 0.5722 0.9261 0.1183  -0.0846 0.037   731  TRP   A CB  
482  C  CG  . TRP   A 38  ? 0.5349 0.574  0.9213 0.1316  -0.079  0.0383  731  TRP   A CG  
483  C  CD1 . TRP   A 38  ? 0.554  0.5751 0.9257 0.1457  -0.0726 0.0398  731  TRP   A CD1 
484  C  CD2 . TRP   A 38  ? 0.522  0.5843 0.9193 0.1334  -0.0788 0.0385  731  TRP   A CD2 
485  N  NE1 . TRP   A 38  ? 0.5535 0.5824 0.9245 0.1562  -0.0687 0.0407  731  TRP   A NE1 
486  C  CE2 . TRP   A 38  ? 0.5368 0.5916 0.9231 0.1499  -0.0725 0.0399  731  TRP   A CE2 
487  C  CE3 . TRP   A 38  ? 0.5133 0.6025 0.9272 0.1238  -0.0832 0.038   731  TRP   A CE3 
488  C  CZ2 . TRP   A 38  ? 0.5367 0.6086 0.9259 0.1586  -0.0711 0.0405  731  TRP   A CZ2 
489  C  CZ3 . TRP   A 38  ? 0.5138 0.6229 0.9327 0.1322  -0.0812 0.0388  731  TRP   A CZ3 
490  C  CH2 . TRP   A 38  ? 0.5226 0.6223 0.9283 0.1502  -0.0753 0.0399  731  TRP   A CH2 
501  N  N   . ILE   A 39  ? 0.6135 0.6234 0.9559 0.1327  -0.1062 0.0355  732  ILE   A N   
502  C  CA  . ILE   A 39  ? 0.6383 0.6577 0.9718 0.135   -0.1173 0.0345  732  ILE   A CA  
503  C  C   . ILE   A 39  ? 0.6578 0.6896 0.9959 0.1504  -0.1092 0.0361  732  ILE   A C   
504  O  O   . ILE   A 39  ? 0.6706 0.6829 0.9961 0.1652  -0.1015 0.0374  732  ILE   A O   
505  C  CB  . ILE   A 39  ? 0.6631 0.6548 0.9704 0.1401  -0.1244 0.0334  732  ILE   A CB  
506  C  CG1 . ILE   A 39  ? 0.6841 0.6602 0.9809 0.1249  -0.1342 0.0316  732  ILE   A CG1 
507  C  CG2 . ILE   A 39  ? 0.6691 0.6705 0.9662 0.1455  -0.1343 0.0324  732  ILE   A CG2 
508  C  CD1 . ILE   A 39  ? 0.7095 0.6637 1.0024 0.1267  -0.1261 0.0324  732  ILE   A CD1 
520  N  N   . PRO   A 40  ? 0.6586 0.7204 1.0127 0.1486  -0.1095 0.0363  733  PRO   A N   
521  C  CA  . PRO   A 40  ? 0.6738 0.7417 1.0265 0.1662  -0.1013 0.0379  733  PRO   A CA  
522  C  C   . PRO   A 40  ? 0.7058 0.7705 1.0407 0.1802  -0.1067 0.0376  733  PRO   A C   
523  O  O   . PRO   A 40  ? 0.7086 0.7828 1.0386 0.1735  -0.1201 0.0358  733  PRO   A O   
524  C  CB  . PRO   A 40  ? 0.6615 0.7647 1.0326 0.1616  -0.1031 0.038   733  PRO   A CB  
525  C  CG  . PRO   A 40  ? 0.6548 0.767  1.0397 0.1403  -0.1089 0.037   733  PRO   A CG  
526  C  CD  . PRO   A 40  ? 0.6409 0.7318 1.0121 0.1321  -0.1171 0.0356  733  PRO   A CD  
534  N  N   . GLU   A 41  ? 0.7292 0.7779 1.0521 0.1988  -0.0963 0.0394  734  GLU   A N   
535  C  CA  . GLU   A 41  ? 0.7555 0.7972 1.0591 0.2155  -0.0992 0.0394  734  GLU   A CA  
536  C  C   . GLU   A 41  ? 0.7529 0.8305 1.0595 0.2191  -0.1106 0.0381  734  GLU   A C   
537  O  O   . GLU   A 41  ? 0.7423 0.8475 1.0629 0.2183  -0.1099 0.0384  734  GLU   A O   
538  C  CB  . GLU   A 41  ? 0.8013 0.8185 1.0917 0.2336  -0.0837 0.0422  734  GLU   A CB  
539  C  CG  . GLU   A 41  ? 0.8805 0.8854 1.1483 0.2538  -0.0835 0.043   734  GLU   A CG  
540  C  CD  . GLU   A 41  ? 0.969  0.9523 1.2214 0.2553  -0.0878 0.0426  734  GLU   A CD  
541  O  OE1 . GLU   A 41  ? 0.9945 0.9505 1.2404 0.2549  -0.0783 0.0446  734  GLU   A OE1 
542  O  OE2 . GLU   A 41  ? 0.9912 0.9858 1.2369 0.2572  -0.1008 0.0403  734  GLU   A OE2 
549  N  N   . GLY   A 42  ? 0.7599 0.8387 1.0531 0.2231  -0.1212 0.0365  735  GLY   A N   
550  C  CA  . GLY   A 42  ? 0.7562 0.8718 1.0507 0.2266  -0.133  0.0351  735  GLY   A CA  
551  C  C   . GLY   A 42  ? 0.7436 0.896  1.0559 0.2045  -0.146  0.0336  735  GLY   A C   
552  O  O   . GLY   A 42  ? 0.7302 0.9219 1.0476 0.2064  -0.1546 0.033   735  GLY   A O   
556  N  N   . GLU   A 43  ? 0.7455 0.8868 1.0661 0.1835  -0.1478 0.0331  736  GLU   A N   
557  C  CA  . GLU   A 43  ? 0.7372 0.9085 1.0724 0.1599  -0.1595 0.032   736  GLU   A CA  
558  C  C   . GLU   A 43  ? 0.7485 0.8905 1.079  0.1403  -0.1632 0.0309  736  GLU   A C   
559  O  O   . GLU   A 43  ? 0.7625 0.8709 1.0886 0.1448  -0.1529 0.0316  736  GLU   A O   
560  C  CB  . GLU   A 43  ? 0.7495 0.954  1.1076 0.1582  -0.1536 0.0339  736  GLU   A CB  
561  C  CG  . GLU   A 43  ? 0.8208 1.0012 1.1838 0.1659  -0.1372 0.0355  736  GLU   A CG  
562  C  CD  . GLU   A 43  ? 0.8852 1.0944 1.2678 0.1646  -0.1318 0.037   736  GLU   A CD  
563  O  OE1 . GLU   A 43  ? 0.903  1.1064 1.2835 0.1825  -0.1201 0.0385  736  GLU   A OE1 
564  O  OE2 . GLU   A 43  ? 0.8976 1.1332 1.2955 0.1455  -0.1392 0.0369  736  GLU   A OE2 
571  N  N   . LYS   A 44  ? 0.74   0.8946 1.0694 0.1187  -0.1779 0.0292  737  LYS   A N   
572  C  CA  . LYS   A 44  ? 0.7538 0.8771 1.0724 0.1007  -0.1832 0.028   737  LYS   A CA  
573  C  C   . LYS   A 44  ? 0.7328 0.8733 1.0703 0.0807  -0.1832 0.0289  737  LYS   A C   
574  O  O   . LYS   A 44  ? 0.7246 0.895  1.0687 0.062   -0.1943 0.0287  737  LYS   A O   
575  C  CB  . LYS   A 44  ? 0.7914 0.907  1.0885 0.0886  -0.2002 0.0253  737  LYS   A CB  
576  C  CG  . LYS   A 44  ? 0.8564 0.9618 1.1351 0.1079  -0.2026 0.0241  737  LYS   A CG  
577  C  CD  . LYS   A 44  ? 0.9008 1.0383 1.175  0.099   -0.2188 0.0223  737  LYS   A CD  
578  C  CE  . LYS   A 44  ? 0.9201 1.1143 1.2174 0.104   -0.218  0.0238  737  LYS   A CE  
579  N  NZ  . LYS   A 44  ? 0.936  1.164  1.2281 0.0954  -0.2343 0.022   737  LYS   A NZ  
593  N  N   . VAL   A 45  ? 0.7203 0.8445 1.0665 0.0843  -0.1706 0.0301  738  VAL   A N   
594  C  CA  . VAL   A 45  ? 0.6992 0.8357 1.0623 0.0677  -0.169  0.031   738  VAL   A CA  
595  C  C   . VAL   A 45  ? 0.6952 0.7959 1.0551 0.0716  -0.1581 0.0312  738  VAL   A C   
596  O  O   . VAL   A 45  ? 0.6952 0.7945 1.0654 0.085   -0.1448 0.0325  738  VAL   A O   
597  C  CB  . VAL   A 45  ? 0.6859 0.8683 1.0742 0.0707  -0.1644 0.033   738  VAL   A CB  
598  C  CG1 . VAL   A 45  ? 0.6924 0.8722 1.0854 0.0956  -0.15   0.0342  738  VAL   A CG1 
599  C  CG2 . VAL   A 45  ? 0.6814 0.8792 1.0869 0.0529  -0.1638 0.034   738  VAL   A CG2 
609  N  N   . LYS   A 46  ? 0.6919 0.7622 1.0344 0.0605  -0.1642 0.0299  739  LYS   A N   
610  C  CA  . LYS   A 46  ? 0.6903 0.7288 1.0269 0.066   -0.155  0.03    739  LYS   A CA  
611  C  C   . LYS   A 46  ? 0.6582 0.7113 1.0159 0.0561  -0.1488 0.031   739  LYS   A C   
612  O  O   . LYS   A 46  ? 0.6599 0.7144 1.0163 0.0379  -0.1565 0.0306  739  LYS   A O   
613  C  CB  . LYS   A 46  ? 0.7356 0.7351 1.0419 0.0611  -0.1637 0.0282  739  LYS   A CB  
614  C  CG  . LYS   A 46  ? 0.7962 0.7821 1.08   0.0689  -0.172  0.0269  739  LYS   A CG  
615  C  CD  . LYS   A 46  ? 0.8771 0.8169 1.1276 0.0746  -0.1756 0.0255  739  LYS   A CD  
616  C  CE  . LYS   A 46  ? 0.9382 0.8571 1.1633 0.0554  -0.1916 0.0234  739  LYS   A CE  
617  N  NZ  . LYS   A 46  ? 0.9641 0.8959 1.1808 0.0453  -0.2057 0.0218  739  LYS   A NZ  
631  N  N   . ILE   A 47  ? 0.6273 0.6902 1.0026 0.0677  -0.1351 0.0323  740  ILE   A N   
632  C  CA  . ILE   A 47  ? 0.5999 0.679  0.9962 0.0605  -0.1287 0.0331  740  ILE   A CA  
633  C  C   . ILE   A 47  ? 0.5925 0.6474 0.9858 0.0608  -0.1213 0.0327  740  ILE   A C   
634  O  O   . ILE   A 47  ? 0.598  0.639  0.9886 0.0744  -0.1113 0.0332  740  ILE   A O   
635  C  CB  . ILE   A 47  ? 0.5906 0.6938 1.0051 0.0722  -0.1188 0.0345  740  ILE   A CB  
636  C  CG1 . ILE   A 47  ? 0.5899 0.7235 1.008  0.0732  -0.1265 0.0349  740  ILE   A CG1 
637  C  CG2 . ILE   A 47  ? 0.5845 0.702  1.019  0.0656  -0.1118 0.035   740  ILE   A CG2 
638  C  CD1 . ILE   A 47  ? 0.5992 0.7456 1.0228 0.0916  -0.1178 0.0361  740  ILE   A CD1 
650  N  N   . PRO   A 48  ? 0.5763 0.6284 0.9707 0.0464  -0.125  0.0322  741  PRO   A N   
651  C  CA  . PRO   A 48  ? 0.5703 0.6044 0.9631 0.0494  -0.1172 0.0319  741  PRO   A CA  
652  C  C   . PRO   A 48  ? 0.5435 0.594  0.9586 0.0566  -0.1037 0.0328  741  PRO   A C   
653  O  O   . PRO   A 48  ? 0.5301 0.6057 0.9634 0.0514  -0.1026 0.0334  741  PRO   A O   
654  C  CB  . PRO   A 48  ? 0.583  0.6148 0.9728 0.0321  -0.1248 0.0314  741  PRO   A CB  
655  C  CG  . PRO   A 48  ? 0.5924 0.6316 0.9744 0.0191  -0.138  0.0314  741  PRO   A CG  
656  C  CD  . PRO   A 48  ? 0.5625 0.6285 0.9586 0.0269  -0.1361 0.0322  741  PRO   A CD  
664  N  N   . VAL   A 49  ? 0.5345 0.5712 0.9464 0.0686  -0.0936 0.0331  742  VAL   A N   
665  C  CA  . VAL   A 49  ? 0.5158 0.5631 0.9443 0.0741  -0.0808 0.0339  742  VAL   A CA  
666  C  C   . VAL   A 49  ? 0.5069 0.5446 0.9354 0.0758  -0.073  0.0337  742  VAL   A C   
667  O  O   . VAL   A 49  ? 0.5161 0.5361 0.9283 0.0793  -0.0755 0.0334  742  VAL   A O   
668  C  CB  . VAL   A 49  ? 0.5255 0.5715 0.9514 0.0871  -0.0743 0.0352  742  VAL   A CB  
669  C  CG1 . VAL   A 49  ? 0.528  0.5905 0.9571 0.0877  -0.0803 0.0355  742  VAL   A CG1 
670  C  CG2 . VAL   A 49  ? 0.5442 0.5678 0.9505 0.0975  -0.0734 0.0358  742  VAL   A CG2 
680  N  N   . ALA   A 50  ? 0.4868 0.5368 0.9322 0.0742  -0.0637 0.0337  743  ALA   A N   
681  C  CA  . ALA   A 50  ? 0.4825 0.5302 0.9311 0.0754  -0.0552 0.0336  743  ALA   A CA  
682  C  C   . ALA   A 50  ? 0.4768 0.5243 0.9282 0.0823  -0.0437 0.0351  743  ALA   A C   
683  O  O   . ALA   A 50  ? 0.4763 0.5293 0.9337 0.0829  -0.0409 0.0356  743  ALA   A O   
684  C  CB  . ALA   A 50  ? 0.4734 0.5352 0.9379 0.0656  -0.0542 0.0323  743  ALA   A CB  
690  N  N   . ILE   A 51  ? 0.4731 0.5134 0.9174 0.0881  -0.0371 0.0362  744  ILE   A N   
691  C  CA  . ILE   A 51  ? 0.4719 0.5097 0.9151 0.0929  -0.026  0.0382  744  ILE   A CA  
692  C  C   . ILE   A 51  ? 0.4634 0.5119 0.9167 0.0878  -0.017  0.0382  744  ILE   A C   
693  O  O   . ILE   A 51  ? 0.4645 0.516  0.915  0.0894  -0.0181 0.0379  744  ILE   A O   
694  C  CB  . ILE   A 51  ? 0.4861 0.5092 0.9105 0.1043  -0.0263 0.0402  744  ILE   A CB  
695  C  CG1 . ILE   A 51  ? 0.5035 0.5167 0.9166 0.1088  -0.0369 0.0397  744  ILE   A CG1 
696  C  CG2 . ILE   A 51  ? 0.4919 0.5114 0.913  0.1084  -0.0143 0.0431  744  ILE   A CG2 
697  C  CD1 . ILE   A 51  ? 0.532  0.5293 0.9244 0.1178  -0.0428 0.0402  744  ILE   A CD1 
709  N  N   . LYS   A 52  ? 0.4539 0.5072 0.916  0.0822  -0.0083 0.0386  745  LYS   A N   
710  C  CA  . LYS   A 52  ? 0.4491 0.5148 0.9208 0.075   -0.0002 0.0384  745  LYS   A CA  
711  C  C   . LYS   A 52  ? 0.4576 0.5192 0.9239 0.0743  0.0111  0.0412  745  LYS   A C   
712  O  O   . LYS   A 52  ? 0.4655 0.5129 0.9237 0.0765  0.0139  0.0426  745  LYS   A O   
713  C  CB  . LYS   A 52  ? 0.456  0.5317 0.9428 0.065   -0.0004 0.0358  745  LYS   A CB  
714  C  CG  . LYS   A 52  ? 0.4823 0.5737 0.9798 0.0569  0.0056  0.0348  745  LYS   A CG  
715  C  CD  . LYS   A 52  ? 0.5154 0.6162 1.0266 0.0483  0.0036  0.0318  745  LYS   A CD  
716  C  CE  . LYS   A 52  ? 0.5536 0.6471 1.0657 0.0433  0.0082  0.0315  745  LYS   A CE  
717  N  NZ  . LYS   A 52  ? 0.5714 0.6756 1.0959 0.0343  0.0089  0.0287  745  LYS   A NZ  
731  N  N   . GLU   A 53  ? 0.4544 0.5291 0.9239 0.071   0.0177  0.0423  746  GLU   A N   
732  C  CA  . GLU   A 53  ? 0.464  0.5393 0.9292 0.0666  0.0291  0.0455  746  GLU   A CA  
733  C  C   . GLU   A 53  ? 0.4649 0.5648 0.9419 0.0568  0.035   0.0452  746  GLU   A C   
734  O  O   . GLU   A 53  ? 0.458  0.5734 0.9437 0.0582  0.0301  0.0429  746  GLU   A O   
735  C  CB  . GLU   A 53  ? 0.4898 0.5565 0.9396 0.0781  0.0309  0.0492  746  GLU   A CB  
736  C  CG  . GLU   A 53  ? 0.5251 0.6066 0.9732 0.0864  0.0293  0.05    746  GLU   A CG  
737  C  CD  . GLU   A 53  ? 0.59   0.6596 1.0204 0.1006  0.0288  0.0531  746  GLU   A CD  
738  O  OE1 . GLU   A 53  ? 0.6158 0.6645 1.036  0.1054  0.0263  0.0537  746  GLU   A OE1 
739  O  OE2 . GLU   A 53  ? 0.6012 0.6834 1.027  0.1083  0.0307  0.055   746  GLU   A OE2 
746  N  N   . LEU   A 54  ? 0.473  0.5765 0.949  0.0464  0.0453  0.0475  747  LEU   A N   
747  C  CA  . LEU   A 54  ? 0.4754 0.6062 0.9628 0.0351  0.0513  0.0475  747  LEU   A CA  
748  C  C   . LEU   A 54  ? 0.4825 0.6303 0.965  0.0383  0.0583  0.0521  747  LEU   A C   
749  O  O   . LEU   A 54  ? 0.4969 0.6311 0.9658 0.0481  0.0597  0.0554  747  LEU   A O   
750  C  CB  . LEU   A 54  ? 0.4837 0.6088 0.9731 0.017   0.0576  0.0467  747  LEU   A CB  
751  C  CG  . LEU   A 54  ? 0.5168 0.6236 1.0079 0.0146  0.0522  0.0428  747  LEU   A CG  
752  C  CD1 . LEU   A 54  ? 0.5343 0.6245 1.0174 -0.0001 0.0593  0.0429  747  LEU   A CD1 
753  C  CD2 . LEU   A 54  ? 0.5167 0.6425 1.0245 0.0135  0.0455  0.0385  747  LEU   A CD2 
765  N  N   . ALA   A 62  ? 0.6539 0.7177 1.079  -0.0599 0.1046  0.0615  755  ALA   A N   
766  C  CA  . ALA   A 62  ? 0.6572 0.7197 1.0944 -0.0503 0.0946  0.0555  755  ALA   A CA  
767  C  C   . ALA   A 62  ? 0.6714 0.7032 1.0978 -0.0297 0.0885  0.0546  755  ALA   A C   
768  O  O   . ALA   A 62  ? 0.6715 0.7019 1.1067 -0.0223 0.0805  0.0502  755  ALA   A O   
769  C  CB  . ALA   A 62  ? 0.6394 0.7452 1.1025 -0.044  0.0889  0.0534  755  ALA   A CB  
774  N  N   . ASN   A 63  ? 0.6807 0.6895 1.0881 -0.0206 0.0921  0.0588  756  ASN   A N   
775  C  CA  . ASN   A 63  ? 0.6941 0.676  1.0903 -0.0013 0.0862  0.0579  756  ASN   A CA  
776  C  C   . ASN   A 63  ? 0.7036 0.6542 1.0857 -0.0034 0.0853  0.0549  756  ASN   A C   
777  O  O   . ASN   A 63  ? 0.7119 0.6496 1.0902 0.0126  0.0788  0.0531  756  ASN   A O   
778  C  CB  . ASN   A 63  ? 0.7227 0.6856 1.0991 0.0087  0.091   0.0629  756  ASN   A CB  
779  C  CG  . ASN   A 63  ? 0.7488 0.7342 1.1352 0.0226  0.0875  0.0648  756  ASN   A CG  
780  O  OD1 . ASN   A 63  ? 0.7478 0.7618 1.1544 0.0263  0.0811  0.0624  756  ASN   A OD1 
781  N  ND2 . ASN   A 63  ? 0.7643 0.7341 1.1335 0.0317  0.0915  0.0692  756  ASN   A ND2 
788  N  N   . LYS   A 64  ? 0.7011 0.6398 1.0737 -0.0226 0.0916  0.0545  757  LYS   A N   
789  C  CA  . LYS   A 64  ? 0.7129 0.6203 1.069  -0.0242 0.0908  0.0515  757  LYS   A CA  
790  C  C   . LYS   A 64  ? 0.6884 0.6174 1.0676 -0.0206 0.0818  0.0461  757  LYS   A C   
791  O  O   . LYS   A 64  ? 0.6988 0.6116 1.0713 -0.0085 0.0769  0.0438  757  LYS   A O   
792  C  CB  . LYS   A 64  ? 0.7499 0.6365 1.0864 -0.0481 0.0997  0.0526  757  LYS   A CB  
793  C  CG  . LYS   A 64  ? 0.8177 0.6662 1.1309 -0.0508 0.0995  0.0495  757  LYS   A CG  
794  C  CD  . LYS   A 64  ? 0.8884 0.6965 1.1733 -0.0297 0.0989  0.0504  757  LYS   A CD  
795  C  CE  . LYS   A 64  ? 0.9619 0.7251 1.2139 -0.0331 0.1011  0.0484  757  LYS   A CE  
796  N  NZ  . LYS   A 64  ? 0.9811 0.7562 1.2475 -0.0303 0.094   0.0429  757  LYS   A NZ  
810  N  N   . GLU   A 65  ? 0.6533 0.6204 1.0589 -0.0296 0.0797  0.0445  758  GLU   A N   
811  C  CA  . GLU   A 65  ? 0.6307 0.6201 1.0585 -0.0272 0.0716  0.0398  758  GLU   A CA  
812  C  C   . GLU   A 65  ? 0.6105 0.6049 1.0468 -0.0061 0.0626  0.0389  758  GLU   A C   
813  O  O   . GLU   A 65  ? 0.6087 0.6022 1.05   -0.0008 0.0567  0.0357  758  GLU   A O   
814  C  CB  . GLU   A 65  ? 0.6405 0.6701 1.092  -0.0385 0.0718  0.039   758  GLU   A CB  
815  C  CG  . GLU   A 65  ? 0.6895 0.7384 1.1595 -0.0419 0.0658  0.034   758  GLU   A CG  
816  C  CD  . GLU   A 65  ? 0.7422 0.8326 1.2348 -0.047  0.0648  0.0333  758  GLU   A CD  
817  O  OE1 . GLU   A 65  ? 0.7421 0.8505 1.2485 -0.0338 0.0582  0.0325  758  GLU   A OE1 
818  O  OE2 . GLU   A 65  ? 0.7644 0.8693 1.2589 -0.0642 0.0705  0.0337  758  GLU   A OE2 
825  N  N   . ILE   A 66  ? 0.5931 0.593  1.0299 0.0051  0.0613  0.0418  759  ILE   A N   
826  C  CA  . ILE   A 66  ? 0.5813 0.5853 1.0238 0.0227  0.0522  0.0411  759  ILE   A CA  
827  C  C   . ILE   A 66  ? 0.5809 0.5562 1.0041 0.0342  0.0513  0.0414  759  ILE   A C   
828  O  O   . ILE   A 66  ? 0.5748 0.5556 1.0041 0.0449  0.0433  0.0396  759  ILE   A O   
829  C  CB  . ILE   A 66  ? 0.585  0.6029 1.0321 0.0312  0.0501  0.0436  759  ILE   A CB  
830  C  CG1 . ILE   A 66  ? 0.5924 0.6217 1.0502 0.0437  0.0388  0.0417  759  ILE   A CG1 
831  C  CG2 . ILE   A 66  ? 0.606  0.6024 1.0324 0.0376  0.0557  0.0478  759  ILE   A CG2 
832  C  CD1 . ILE   A 66  ? 0.5939 0.6488 1.0719 0.039   0.0332  0.0386  759  ILE   A CD1 
844  N  N   . LEU   A 67  ? 0.5842 0.5296 0.9828 0.0319  0.0594  0.0438  760  LEU   A N   
845  C  CA  . LEU   A 67  ? 0.5928 0.5087 0.9684 0.0449  0.0593  0.0442  760  LEU   A CA  
846  C  C   . LEU   A 67  ? 0.576  0.4841 0.9489 0.0434  0.0576  0.0408  760  LEU   A C   
847  O  O   . LEU   A 67  ? 0.5813 0.482  0.9465 0.0586  0.0532  0.04    760  LEU   A O   
848  C  CB  . LEU   A 67  ? 0.6228 0.5049 0.9686 0.0431  0.0689  0.048   760  LEU   A CB  
849  C  CG  . LEU   A 67  ? 0.648  0.5288 0.9881 0.0546  0.0692  0.0517  760  LEU   A CG  
850  C  CD1 . LEU   A 67  ? 0.6759 0.526  0.9881 0.0486  0.0801  0.0559  760  LEU   A CD1 
851  C  CD2 . LEU   A 67  ? 0.6597 0.537  0.9949 0.0763  0.0616  0.0509  760  LEU   A CD2 
863  N  N   . ASP   A 68  ? 0.5547 0.4667 0.9336 0.0262  0.0607  0.0388  761  ASP   A N   
864  C  CA  . ASP   A 68  ? 0.5492 0.4555 0.9264 0.0249  0.0585  0.0352  761  ASP   A CA  
865  C  C   . ASP   A 68  ? 0.5208 0.4587 0.924  0.0341  0.0487  0.0327  761  ASP   A C   
866  O  O   . ASP   A 68  ? 0.5234 0.4571 0.9224 0.0431  0.0453  0.031   761  ASP   A O   
867  C  CB  . ASP   A 68  ? 0.5644 0.4709 0.9437 0.0029  0.0633  0.0333  761  ASP   A CB  
868  C  CG  . ASP   A 68  ? 0.6339 0.5053 0.9835 -0.0098 0.0729  0.0356  761  ASP   A CG  
869  O  OD1 . ASP   A 68  ? 0.6582 0.4938 0.978  0.0008  0.076   0.0376  761  ASP   A OD1 
870  O  OD2 . ASP   A 68  ? 0.658  0.5379 1.0126 -0.0306 0.0773  0.0354  761  ASP   A OD2 
875  N  N   . GLU   A 69  ? 0.4937 0.4621 0.9212 0.0319  0.0443  0.0329  762  GLU   A N   
876  C  CA  . GLU   A 69  ? 0.4741 0.4702 0.9238 0.0384  0.035   0.0312  762  GLU   A CA  
877  C  C   . GLU   A 69  ? 0.4697 0.4622 0.9121 0.056   0.0297  0.0325  762  GLU   A C   
878  O  O   . GLU   A 69  ? 0.4629 0.4675 0.9128 0.0625  0.0237  0.0311  762  GLU   A O   
879  C  CB  . GLU   A 69  ? 0.487  0.5079 0.9556 0.0333  0.0323  0.0315  762  GLU   A CB  
880  C  CG  . GLU   A 69  ? 0.5298 0.5746 1.0172 0.0381  0.0227  0.03    762  GLU   A CG  
881  C  CD  . GLU   A 69  ? 0.579  0.6447 1.0816 0.0326  0.0204  0.0296  762  GLU   A CD  
882  O  OE1 . GLU   A 69  ? 0.5894 0.6564 1.0903 0.0264  0.0263  0.0307  762  GLU   A OE1 
883  O  OE2 . GLU   A 69  ? 0.5942 0.6753 1.1089 0.0347  0.0127  0.0283  762  GLU   A OE2 
890  N  N   . ALA   A 70  ? 0.471  0.4487 0.8985 0.0637  0.032   0.0354  763  ALA   A N   
891  C  CA  . ALA   A 70  ? 0.4732 0.4481 0.8918 0.0808  0.0273  0.0367  763  ALA   A CA  
892  C  C   . ALA   A 70  ? 0.4832 0.4415 0.8841 0.0909  0.0288  0.0361  763  ALA   A C   
893  O  O   . ALA   A 70  ? 0.4806 0.4533 0.8854 0.1029  0.0222  0.0358  763  ALA   A O   
894  C  CB  . ALA   A 70  ? 0.4849 0.4437 0.888  0.0868  0.0307  0.0398  763  ALA   A CB  
900  N  N   . TYR   A 71  ? 0.4945 0.4227 0.874  0.0862  0.0372  0.0361  764  TYR   A N   
901  C  CA  . TYR   A 71  ? 0.5106 0.4164 0.8668 0.0972  0.0393  0.0355  764  TYR   A CA  
902  C  C   . TYR   A 71  ? 0.4946 0.4231 0.8672 0.0985  0.0336  0.0327  764  TYR   A C   
903  O  O   . TYR   A 71  ? 0.4975 0.4296 0.8625 0.1151  0.0303  0.0329  764  TYR   A O   
904  C  CB  . TYR   A 71  ? 0.5356 0.4005 0.8631 0.0877  0.0492  0.0357  764  TYR   A CB  
905  C  CG  . TYR   A 71  ? 0.5634 0.4034 0.8675 0.0941  0.0512  0.034   764  TYR   A CG  
906  C  CD1 . TYR   A 71  ? 0.5912 0.4123 0.8688 0.1168  0.0509  0.035   764  TYR   A CD1 
907  C  CD2 . TYR   A 71  ? 0.577  0.4111 0.8824 0.0786  0.0534  0.0312  764  TYR   A CD2 
908  C  CE1 . TYR   A 71  ? 0.6211 0.4158 0.8722 0.1252  0.053   0.0335  764  TYR   A CE1 
909  C  CE2 . TYR   A 71  ? 0.6071 0.4147 0.8873 0.0852  0.055   0.0294  764  TYR   A CE2 
910  C  CZ  . TYR   A 71  ? 0.6366 0.4238 0.889  0.1093  0.0549  0.0306  764  TYR   A CZ  
911  O  OH  . TYR   A 71  ? 0.6795 0.4382 0.903  0.1184  0.0566  0.0289  764  TYR   A OH  
921  N  N   . VAL   A 72  ? 0.4748 0.4198 0.8686 0.0821  0.0328  0.0305  765  VAL   A N   
922  C  CA  . VAL   A 72  ? 0.4632 0.4302 0.8733 0.0821  0.0278  0.0281  765  VAL   A CA  
923  C  C   . VAL   A 72  ? 0.4406 0.4412 0.8696 0.0925  0.0188  0.0291  765  VAL   A C   
924  O  O   . VAL   A 72  ? 0.4376 0.4494 0.8662 0.1036  0.0154  0.0289  765  VAL   A O   
925  C  CB  . VAL   A 72  ? 0.4637 0.4432 0.8934 0.0622  0.0286  0.0256  765  VAL   A CB  
926  C  CG1 . VAL   A 72  ? 0.4531 0.465  0.9076 0.0617  0.0216  0.0238  765  VAL   A CG1 
927  C  CG2 . VAL   A 72  ? 0.4867 0.4364 0.8965 0.0521  0.036   0.0239  765  VAL   A CG2 
937  N  N   . MET   A 73  ? 0.4245 0.4406 0.8679 0.0886  0.015   0.0302  766  MET   A N   
938  C  CA  . MET   A 73  ? 0.4098 0.4553 0.8691 0.0945  0.0059  0.0311  766  MET   A CA  
939  C  C   . MET   A 73  ? 0.4183 0.4632 0.8628 0.1132  0.0037  0.033   766  MET   A C   
940  O  O   . MET   A 73  ? 0.4067 0.4782 0.8615 0.1193  -0.003  0.0334  766  MET   A O   
941  C  CB  . MET   A 73  ? 0.4081 0.4615 0.8783 0.0872  0.0027  0.0319  766  MET   A CB  
942  C  CG  . MET   A 73  ? 0.4137 0.478  0.9017 0.0718  0.0024  0.0301  766  MET   A CG  
943  S  SD  . MET   A 73  ? 0.4134 0.486  0.9097 0.0672  -0.0022 0.031   766  MET   A SD  
944  C  CE  . MET   A 73  ? 0.3688 0.4671 0.878  0.0691  -0.0142 0.0311  766  MET   A CE  
954  N  N   . ALA   A 74  ? 0.4358 0.4524 0.8559 0.1222  0.0092  0.0344  767  ALA   A N   
955  C  CA  . ALA   A 74  ? 0.4495 0.4638 0.8521 0.1425  0.0076  0.0361  767  ALA   A CA  
956  C  C   . ALA   A 74  ? 0.4626 0.4724 0.8512 0.1551  0.0096  0.0355  767  ALA   A C   
957  O  O   . ALA   A 74  ? 0.4602 0.4891 0.8462 0.1714  0.0051  0.0367  767  ALA   A O   
958  C  CB  . ALA   A 74  ? 0.4698 0.4513 0.8475 0.1486  0.0137  0.0378  767  ALA   A CB  
964  N  N   . SER   A 75  ? 0.4756 0.461  0.8538 0.148   0.0162  0.0339  768  SER   A N   
965  C  CA  . SER   A 75  ? 0.4916 0.4674 0.8528 0.16    0.0184  0.033   768  SER   A CA  
966  C  C   . SER   A 75  ? 0.4732 0.492  0.8583 0.1631  0.0111  0.0327  768  SER   A C   
967  O  O   . SER   A 75  ? 0.4794 0.5045 0.8521 0.1816  0.0103  0.0334  768  SER   A O   
968  C  CB  . SER   A 75  ? 0.5234 0.4669 0.8721 0.1466  0.0254  0.0308  768  SER   A CB  
969  O  OG  . SER   A 75  ? 0.5708 0.4778 0.8995 0.139   0.0323  0.0315  768  SER   A OG  
975  N  N   . VAL   A 76  ? 0.4495 0.4973 0.8668 0.1459  0.0061  0.032   769  VAL   A N   
976  C  CA  . VAL   A 76  ? 0.4328 0.5213 0.874  0.1448  -0.0006 0.0321  769  VAL   A CA  
977  C  C   . VAL   A 76  ? 0.4227 0.548  0.8817 0.1464  -0.0094 0.0343  769  VAL   A C   
978  O  O   . VAL   A 76  ? 0.403  0.5625 0.8837 0.1402  -0.0153 0.0347  769  VAL   A O   
979  C  CB  . VAL   A 76  ? 0.4299 0.5248 0.8916 0.1251  -0.0006 0.0297  769  VAL   A CB  
980  C  CG1 . VAL   A 76  ? 0.4526 0.5137 0.8966 0.1219  0.0071  0.0273  769  VAL   A CG1 
981  C  CG2 . VAL   A 76  ? 0.4259 0.5262 0.9055 0.108   -0.0031 0.0294  769  VAL   A CG2 
991  N  N   . ASP   A 77  ? 0.4357 0.5547 0.8839 0.1548  -0.0105 0.0358  770  ASP   A N   
992  C  CA  . ASP   A 77  ? 0.4326 0.5842 0.8953 0.1545  -0.0195 0.0375  770  ASP   A CA  
993  C  C   . ASP   A 77  ? 0.4238 0.6128 0.8897 0.1687  -0.0248 0.0395  770  ASP   A C   
994  O  O   . ASP   A 77  ? 0.4135 0.639  0.9    0.1599  -0.0329 0.0406  770  ASP   A O   
995  C  CB  . ASP   A 77  ? 0.4759 0.6032 0.9221 0.1601  -0.0177 0.0381  770  ASP   A CB  
996  C  CG  . ASP   A 77  ? 0.5346 0.6877 0.9971 0.1522  -0.0274 0.039   770  ASP   A CG  
997  O  OD1 . ASP   A 77  ? 0.5296 0.7201 1.0062 0.1517  -0.0352 0.04    770  ASP   A OD1 
998  O  OD2 . ASP   A 77  ? 0.5761 0.7109 1.0351 0.1464  -0.0269 0.0387  770  ASP   A OD2 
1003 N  N   . ASN   A 78  A 0.4262 0.6073 0.8704 0.1903  -0.0205 0.0402  770  ASN   A N   
1004 C  CA  . ASN   A 78  A 0.4132 0.633  0.8583 0.2072  -0.0246 0.0424  770  ASN   A CA  
1005 C  C   . ASN   A 78  A 0.4023 0.6284 0.8492 0.2099  -0.0215 0.042   770  ASN   A C   
1006 O  O   . ASN   A 78  A 0.4261 0.6129 0.8508 0.2166  -0.0137 0.0403  770  ASN   A O   
1007 C  CB  . ASN   A 78  A 0.4463 0.6461 0.8602 0.2325  -0.0212 0.0433  770  ASN   A CB  
1008 C  CG  . ASN   A 78  A 0.4709 0.7197 0.8876 0.2514  -0.0268 0.046   770  ASN   A CG  
1009 O  OD1 . ASN   A 78  A 0.485  0.7469 0.8959 0.265   -0.0248 0.0468  770  ASN   A OD1 
1010 N  ND2 . ASN   A 78  A 0.4684 0.7468 0.8934 0.2527  -0.0342 0.0475  770  ASN   A ND2 
1017 N  N   . PRO   A 79  B 0.3655 0.6372 0.8359 0.204   -0.027  0.0436  770  PRO   A N   
1018 C  CA  . PRO   A 79  B 0.3351 0.6561 0.8309 0.1932  -0.0367 0.0459  770  PRO   A CA  
1019 C  C   . PRO   A 79  B 0.3268 0.6446 0.8431 0.1652  -0.041  0.0447  770  PRO   A C   
1020 O  O   . PRO   A 79  B 0.3234 0.6667 0.8524 0.1553  -0.049  0.0461  770  PRO   A O   
1021 C  CB  . PRO   A 79  B 0.3264 0.6889 0.8335 0.1983  -0.0382 0.0481  770  PRO   A CB  
1022 C  CG  . PRO   A 79  B 0.3458 0.6764 0.8454 0.1975  -0.0308 0.0457  770  PRO   A CG  
1023 C  CD  . PRO   A 79  B 0.3551 0.6307 0.8254 0.2079  -0.0235 0.0432  770  PRO   A CD  
1031 N  N   . GLY   A 80  C 0.3205 0.607  0.838  0.1531  -0.036  0.0421  770  GLY   A N   
1032 C  CA  . GLY   A 80  C 0.3051 0.5848 0.8384 0.1298  -0.0389 0.0407  770  GLY   A CA  
1033 C  C   . GLY   A 80  C 0.2699 0.5814 0.8247 0.1158  -0.0435 0.0417  770  GLY   A C   
1034 O  O   . GLY   A 80  C 0.261  0.6009 0.82   0.1237  -0.0438 0.0436  770  GLY   A O   
1038 N  N   . ASN   A 81  ? 0.2489 0.5551 0.8155 0.096   -0.0468 0.0407  771  ASN   A N   
1039 C  CA  . ASN   A 81  ? 0.2187 0.549  0.803  0.0808  -0.051  0.0417  771  ASN   A CA  
1040 C  C   . ASN   A 81  ? 0.2073 0.5364 0.7978 0.0624  -0.0583 0.0418  771  ASN   A C   
1041 O  O   . ASN   A 81  ? 0.2241 0.5231 0.8067 0.06    -0.0569 0.0397  771  ASN   A O   
1042 C  CB  . ASN   A 81  ? 0.223  0.5347 0.8092 0.0773  -0.0445 0.0392  771  ASN   A CB  
1043 C  CG  . ASN   A 81  ? 0.2261 0.5625 0.8282 0.0657  -0.0475 0.0404  771  ASN   A CG  
1044 O  OD1 . ASN   A 81  ? 0.2236 0.5533 0.833  0.0498  -0.0499 0.0395  771  ASN   A OD1 
1045 N  ND2 . ASN   A 81  ? 0.218  0.5834 0.824  0.0744  -0.0471 0.0428  771  ASN   A ND2 
1052 N  N   . PRO   A 82  ? 0.1779 0.5366 0.7799 0.0487  -0.066  0.0444  772  PRO   A N   
1053 C  CA  . PRO   A 82  ? 0.1707 0.5192 0.7723 0.031   -0.0731 0.0441  772  PRO   A CA  
1054 C  C   . PRO   A 82  ? 0.1754 0.4907 0.7747 0.0231  -0.0695 0.0411  772  PRO   A C   
1055 O  O   . PRO   A 82  ? 0.1828 0.4793 0.7752 0.0147  -0.0736 0.0402  772  PRO   A O   
1056 C  CB  . PRO   A 82  ? 0.1631 0.5471 0.7756 0.0162  -0.0805 0.0475  772  PRO   A CB  
1057 C  CG  . PRO   A 82  ? 0.1568 0.5776 0.7763 0.0288  -0.0785 0.0502  772  PRO   A CG  
1058 C  CD  . PRO   A 82  ? 0.1485 0.5494 0.7618 0.048   -0.0686 0.0478  772  PRO   A CD  
1066 N  N   . HIS   A 83  ? 0.1687 0.4778 0.7727 0.0264  -0.0624 0.0395  773  HIS   A N   
1067 C  CA  . HIS   A 83  ? 0.1736 0.4579 0.7772 0.0196  -0.0589 0.0366  773  HIS   A CA  
1068 C  C   . HIS   A 83  ? 0.1924 0.4493 0.7883 0.0292  -0.0506 0.0336  773  HIS   A C   
1069 O  O   . HIS   A 83  ? 0.1923 0.4364 0.7903 0.0258  -0.0462 0.0312  773  HIS   A O   
1070 C  CB  . HIS   A 83  ? 0.1651 0.4634 0.7793 0.0137  -0.0576 0.0369  773  HIS   A CB  
1071 C  CG  . HIS   A 83  ? 0.1736 0.5016 0.7951 0.0035  -0.0647 0.0406  773  HIS   A CG  
1072 N  ND1 . HIS   A 83  ? 0.1979 0.5237 0.8154 -0.011  -0.0726 0.042   773  HIS   A ND1 
1073 C  CD2 . HIS   A 83  ? 0.1714 0.532  0.8019 0.006   -0.0649 0.0435  773  HIS   A CD2 
1074 C  CE1 . HIS   A 83  ? 0.1895 0.5469 0.8143 -0.0193 -0.0775 0.0458  773  HIS   A CE1 
1075 N  NE2 . HIS   A 83  ? 0.1756 0.5571 0.8098 -0.0091 -0.0728 0.047   773  HIS   A NE2 
1083 N  N   . VAL   A 84  ? 0.2054 0.4539 0.7918 0.0404  -0.0485 0.0338  774  VAL   A N   
1084 C  CA  . VAL   A 84  ? 0.2282 0.4493 0.8044 0.0477  -0.0406 0.0316  774  VAL   A CA  
1085 C  C   . VAL   A 84  ? 0.2462 0.4549 0.8122 0.0507  -0.043  0.0323  774  VAL   A C   
1086 O  O   . VAL   A 84  ? 0.2385 0.4597 0.8013 0.0565  -0.0476 0.0343  774  VAL   A O   
1087 C  CB  . VAL   A 84  ? 0.2408 0.4586 0.81   0.0608  -0.034  0.0314  774  VAL   A CB  
1088 C  CG1 . VAL   A 84  ? 0.263  0.4498 0.8169 0.067   -0.0267 0.0299  774  VAL   A CG1 
1089 C  CG2 . VAL   A 84  ? 0.2422 0.4667 0.8191 0.0581  -0.031  0.0301  774  VAL   A CG2 
1099 N  N   . CYS   A 85  ? 0.2651 0.4517 0.8258 0.0473  -0.0402 0.0308  775  CYS   A N   
1100 C  CA  . CYS   A 85  ? 0.2907 0.4633 0.8404 0.0508  -0.0418 0.0314  775  CYS   A CA  
1101 C  C   . CYS   A 85  ? 0.3063 0.4717 0.8448 0.0641  -0.0378 0.0324  775  CYS   A C   
1102 O  O   . CYS   A 85  ? 0.3123 0.4675 0.8462 0.0695  -0.0301 0.0317  775  CYS   A O   
1103 C  CB  . CYS   A 85  ? 0.3167 0.4698 0.8625 0.0469  -0.0377 0.0299  775  CYS   A CB  
1104 S  SG  . CYS   A 85  ? 0.3902 0.5399 0.9331 0.039   -0.0462 0.03    775  CYS   A SG  
1110 N  N   . ARG   A 86  ? 0.3144 0.4828 0.8459 0.0695  -0.0432 0.0339  776  ARG   A N   
1111 C  CA  . ARG   A 86  ? 0.3341 0.4962 0.8527 0.0842  -0.0402 0.035   776  ARG   A CA  
1112 C  C   . ARG   A 86  ? 0.3524 0.4893 0.8577 0.0877  -0.0371 0.035   776  ARG   A C   
1113 O  O   . ARG   A 86  ? 0.3569 0.4919 0.8617 0.0825  -0.0426 0.0351  776  ARG   A O   
1114 C  CB  . ARG   A 86  ? 0.347  0.5344 0.8666 0.0896  -0.0487 0.0368  776  ARG   A CB  
1115 C  CG  . ARG   A 86  ? 0.3813 0.6014 0.9162 0.0818  -0.055  0.0376  776  ARG   A CG  
1116 C  CD  . ARG   A 86  ? 0.4138 0.6624 0.9487 0.0871  -0.063  0.0397  776  ARG   A CD  
1117 N  NE  . ARG   A 86  ? 0.4547 0.7115 0.9822 0.1059  -0.0584 0.0407  776  ARG   A NE  
1118 C  CZ  . ARG   A 86  ? 0.488  0.7665 1.0216 0.1116  -0.0565 0.0417  776  ARG   A CZ  
1119 N  NH1 . ARG   A 86  ? 0.4836 0.7798 1.033  0.0984  -0.0587 0.0419  776  ARG   A NH1 
1120 N  NH2 . ARG   A 86  ? 0.4912 0.7724 1.0127 0.1318  -0.0523 0.0425  776  ARG   A NH2 
1134 N  N   . LEU   A 87  ? 0.3626 0.4789 0.8543 0.097   -0.0284 0.0353  777  LEU   A N   
1135 C  CA  . LEU   A 87  ? 0.3826 0.4757 0.8602 0.1012  -0.0244 0.036   777  LEU   A CA  
1136 C  C   . LEU   A 87  ? 0.3919 0.4888 0.8594 0.113   -0.0299 0.0375  777  LEU   A C   
1137 O  O   . LEU   A 87  ? 0.3934 0.4941 0.8529 0.1252  -0.029  0.0382  777  LEU   A O   
1138 C  CB  . LEU   A 87  ? 0.3994 0.4676 0.8636 0.105   -0.013  0.0362  777  LEU   A CB  
1139 C  CG  . LEU   A 87  ? 0.436  0.4788 0.8832 0.1091  -0.0068 0.0377  777  LEU   A CG  
1140 C  CD1 . LEU   A 87  ? 0.4435 0.4845 0.8978 0.0983  -0.0058 0.0375  777  LEU   A CD1 
1141 C  CD2 . LEU   A 87  ? 0.4621 0.4799 0.8925 0.1121  0.0036  0.0381  777  LEU   A CD2 
1153 N  N   . LEU   A 88  ? 0.3958 0.4912 0.8615 0.1106  -0.0358 0.0377  778  LEU   A N   
1154 C  CA  . LEU   A 88  ? 0.4082 0.5066 0.8633 0.1212  -0.0414 0.0388  778  LEU   A CA  
1155 C  C   . LEU   A 88  ? 0.4348 0.5067 0.8701 0.1342  -0.0325 0.0401  778  LEU   A C   
1156 O  O   . LEU   A 88  ? 0.4437 0.5165 0.8677 0.1482  -0.0323 0.041   778  LEU   A O   
1157 C  CB  . LEU   A 88  ? 0.4077 0.5078 0.863  0.1145  -0.0507 0.0384  778  LEU   A CB  
1158 C  CG  . LEU   A 88  ? 0.4113 0.5338 0.8802 0.101   -0.0611 0.0375  778  LEU   A CG  
1159 C  CD1 . LEU   A 88  ? 0.4253 0.5368 0.8873 0.0941  -0.0684 0.0369  778  LEU   A CD1 
1160 C  CD2 . LEU   A 88  ? 0.4059 0.5578 0.8793 0.1037  -0.0689 0.0382  778  LEU   A CD2 
1172 N  N   . GLY   A 89  ? 0.4455 0.4953 0.8759 0.1296  -0.0247 0.0404  779  GLY   A N   
1173 C  CA  . GLY   A 89  ? 0.4699 0.4926 0.8809 0.1384  -0.0151 0.0421  779  GLY   A CA  
1174 C  C   . GLY   A 89  ? 0.4834 0.4909 0.8939 0.1293  -0.0078 0.0428  779  GLY   A C   
1175 O  O   . GLY   A 89  ? 0.4774 0.4954 0.9028 0.1174  -0.0094 0.0415  779  GLY   A O   
1179 N  N   . ILE   A 90  ? 0.4989 0.4828 0.8913 0.1351  0.0006  0.045   780  ILE   A N   
1180 C  CA  . ILE   A 90  ? 0.5114 0.484  0.9019 0.1271  0.0085  0.0465  780  ILE   A CA  
1181 C  C   . ILE   A 90  ? 0.5272 0.4883 0.9036 0.136   0.0088  0.0488  780  ILE   A C   
1182 O  O   . ILE   A 90  ? 0.5372 0.4919 0.9009 0.1489  0.0054  0.0494  780  ILE   A O   
1183 C  CB  . ILE   A 90  ? 0.5281 0.4833 0.9105 0.1202  0.0206  0.0475  780  ILE   A CB  
1184 C  CG1 . ILE   A 90  ? 0.5577 0.4852 0.9134 0.1316  0.027   0.0496  780  ILE   A CG1 
1185 C  CG2 . ILE   A 90  ? 0.5281 0.4951 0.9246 0.1111  0.0196  0.0448  780  ILE   A CG2 
1186 C  CD1 . ILE   A 90  ? 0.5859 0.4876 0.9255 0.1228  0.04    0.0519  780  ILE   A CD1 
1198 N  N   . CYS   A 91  ? 0.5271 0.4877 0.9055 0.1303  0.0125  0.0502  781  CYS   A N   
1199 C  CA  . CYS   A 91  ? 0.5429 0.4933 0.9077 0.1388  0.0134  0.0527  781  CYS   A CA  
1200 C  C   . CYS   A 91  ? 0.5527 0.4932 0.9107 0.133   0.0261  0.056   781  CYS   A C   
1201 O  O   . CYS   A 91  ? 0.5458 0.4973 0.9162 0.1206  0.0303  0.0557  781  CYS   A O   
1202 C  CB  . CYS   A 91  ? 0.5475 0.5106 0.9194 0.1398  0.0031  0.0511  781  CYS   A CB  
1203 S  SG  . CYS   A 91  ? 0.6047 0.5541 0.957  0.1536  0.0013  0.0535  781  CYS   A SG  
1209 N  N   . LEU   A 92  ? 0.5667 0.4881 0.9048 0.1416  0.0323  0.0595  782  LEU   A N   
1210 C  CA  . LEU   A 92  ? 0.5798 0.4919 0.909  0.1352  0.045   0.0636  782  LEU   A CA  
1211 C  C   . LEU   A 92  ? 0.5875 0.5039 0.9121 0.1419  0.0453  0.0663  782  LEU   A C   
1212 O  O   . LEU   A 92  ? 0.5988 0.4991 0.9051 0.1535  0.0472  0.069   782  LEU   A O   
1213 C  CB  . LEU   A 92  ? 0.5976 0.4806 0.9032 0.1391  0.0534  0.0662  782  LEU   A CB  
1214 C  CG  . LEU   A 92  ? 0.6179 0.4912 0.9209 0.1372  0.053   0.0637  782  LEU   A CG  
1215 C  CD1 . LEU   A 92  ? 0.6453 0.4866 0.9189 0.1487  0.0583  0.066   782  LEU   A CD1 
1216 C  CD2 . LEU   A 92  ? 0.6204 0.4972 0.9323 0.1184  0.0595  0.0631  782  LEU   A CD2 
1228 N  N   . THR   A 93  ? 0.5795 0.5173 0.919  0.1361  0.0435  0.0657  783  THR   A N   
1229 C  CA  . THR   A 93  ? 0.5878 0.5326 0.9228 0.1436  0.0435  0.068   783  THR   A CA  
1230 C  C   . THR   A 93  ? 0.5924 0.5441 0.9264 0.134   0.0577  0.0728  783  THR   A C   
1231 O  O   . THR   A 93  ? 0.6082 0.5427 0.9292 0.1308  0.0665  0.0759  783  THR   A O   
1232 C  CB  . THR   A 93  ? 0.5942 0.5554 0.9419 0.145   0.0321  0.0641  783  THR   A CB  
1233 O  OG1 . THR   A 93  ? 0.5946 0.5744 0.9606 0.1309  0.0349  0.0626  783  THR   A OG1 
1234 C  CG2 . THR   A 93  ? 0.601  0.555  0.9475 0.1512  0.0189  0.0602  783  THR   A CG2 
1242 N  N   . SER   A 94  ? 0.5791 0.5553 0.9242 0.1293  0.0602  0.0737  784  SER   A N   
1243 C  CA  . SER   A 94  ? 0.5774 0.567  0.9244 0.117   0.0732  0.0782  784  SER   A CA  
1244 C  C   . SER   A 94  ? 0.5705 0.5655 0.9306 0.0975  0.0765  0.0759  784  SER   A C   
1245 O  O   . SER   A 94  ? 0.5756 0.5689 0.9315 0.0836  0.0873  0.0791  784  SER   A O   
1246 C  CB  . SER   A 94  ? 0.5828 0.6011 0.9365 0.1214  0.0741  0.0799  784  SER   A CB  
1247 O  OG  . SER   A 94  ? 0.602  0.6356 0.9704 0.1221  0.0648  0.0751  784  SER   A OG  
1253 N  N   . THR   A 95  ? 0.5574 0.5581 0.9318 0.0959  0.0671  0.0704  785  THR   A N   
1254 C  CA  . THR   A 95  ? 0.5505 0.5543 0.9365 0.0804  0.068   0.0673  785  THR   A CA  
1255 C  C   . THR   A 95  ? 0.5461 0.5295 0.929  0.086   0.06    0.0635  785  THR   A C   
1256 O  O   . THR   A 95  ? 0.5564 0.529  0.9311 0.1005  0.053   0.0631  785  THR   A O   
1257 C  CB  . THR   A 95  ? 0.5561 0.5906 0.9628 0.0753  0.064   0.0645  785  THR   A CB  
1258 O  OG1 . THR   A 95  ? 0.5688 0.6044 0.9783 0.0887  0.0521  0.0614  785  THR   A OG1 
1259 C  CG2 . THR   A 95  ? 0.555  0.6161 0.9657 0.0711  0.0718  0.0682  785  THR   A CG2 
1267 N  N   . VAL   A 96  ? 0.5275 0.5075 0.9162 0.0751  0.0606  0.0608  786  VAL   A N   
1268 C  CA  . VAL   A 96  ? 0.5202 0.487  0.9073 0.0811  0.0534  0.0575  786  VAL   A CA  
1269 C  C   . VAL   A 96  ? 0.4926 0.4815 0.8997 0.082   0.0427  0.0535  786  VAL   A C   
1270 O  O   . VAL   A 96  ? 0.482  0.4895 0.904  0.0716  0.0436  0.0519  786  VAL   A O   
1271 C  CB  . VAL   A 96  ? 0.5361 0.4863 0.916  0.0708  0.0593  0.0568  786  VAL   A CB  
1272 C  CG1 . VAL   A 96  ? 0.5445 0.4844 0.9214 0.0804  0.052   0.0538  786  VAL   A CG1 
1273 C  CG2 . VAL   A 96  ? 0.5584 0.4832 0.9147 0.067   0.0707  0.0612  786  VAL   A CG2 
1283 N  N   . GLN   A 97  ? 0.4806 0.4678 0.8871 0.0936  0.0326  0.0518  787  GLN   A N   
1284 C  CA  . GLN   A 97  ? 0.4643 0.4687 0.8859 0.0933  0.022   0.0484  787  GLN   A CA  
1285 C  C   . GLN   A 97  ? 0.4566 0.4607 0.8828 0.0941  0.0155  0.0457  787  GLN   A C   
1286 O  O   . GLN   A 97  ? 0.4704 0.4611 0.8849 0.1022  0.0153  0.0465  787  GLN   A O   
1287 C  CB  . GLN   A 97  ? 0.4827 0.4869 0.898  0.1042  0.0142  0.0488  787  GLN   A CB  
1288 C  CG  . GLN   A 97  ? 0.5185 0.524  0.9266 0.1079  0.0196  0.0518  787  GLN   A CG  
1289 C  CD  . GLN   A 97  ? 0.5707 0.5708 0.9682 0.1202  0.0109  0.0518  787  GLN   A CD  
1290 O  OE1 . GLN   A 97  ? 0.5902 0.5794 0.9797 0.1271  0.0036  0.0509  787  GLN   A OE1 
1291 N  NE2 . GLN   A 97  ? 0.5743 0.582  0.9696 0.1238  0.0111  0.0527  787  GLN   A NE2 
1300 N  N   . LEU   A 98  ? 0.4341 0.4545 0.8765 0.0873  0.0098  0.0428  788  LEU   A N   
1301 C  CA  . LEU   A 98  ? 0.4244 0.4504 0.8733 0.0879  0.003   0.0406  788  LEU   A CA  
1302 C  C   . LEU   A 98  ? 0.412  0.4466 0.8635 0.0918  -0.0089 0.0396  788  LEU   A C   
1303 O  O   . LEU   A 98  ? 0.4112 0.4495 0.8643 0.0901  -0.0121 0.0393  788  LEU   A O   
1304 C  CB  . LEU   A 98  ? 0.4163 0.4543 0.8801 0.0771  0.0043  0.0383  788  LEU   A CB  
1305 C  CG  . LEU   A 98  ? 0.4373 0.4681 0.8992 0.0691  0.0149  0.0385  788  LEU   A CG  
1306 C  CD1 . LEU   A 98  ? 0.4343 0.4782 0.9109 0.0598  0.0139  0.0356  788  LEU   A CD1 
1307 C  CD2 . LEU   A 98  ? 0.4593 0.4676 0.9031 0.0747  0.0207  0.04    788  LEU   A CD2 
1319 N  N   . ILE   A 99  ? 0.4016 0.4393 0.8517 0.0969  -0.0155 0.0392  789  ILE   A N   
1320 C  CA  . ILE   A 99  ? 0.3957 0.4418 0.8465 0.098   -0.0275 0.0384  789  ILE   A CA  
1321 C  C   . ILE   A 99  ? 0.377  0.442  0.841  0.0925  -0.0335 0.0369  789  ILE   A C   
1322 O  O   . ILE   A 99  ? 0.3786 0.4474 0.8436 0.0965  -0.0303 0.0371  789  ILE   A O   
1323 C  CB  . ILE   A 99  ? 0.4131 0.45   0.8484 0.1098  -0.0309 0.0397  789  ILE   A CB  
1324 C  CG1 . ILE   A 99  ? 0.4377 0.4546 0.8582 0.1172  -0.0221 0.042   789  ILE   A CG1 
1325 C  CG2 . ILE   A 99  ? 0.4176 0.4603 0.8506 0.1084  -0.0439 0.0388  789  ILE   A CG2 
1326 C  CD1 . ILE   A 99  ? 0.4564 0.4678 0.8733 0.1157  -0.0214 0.0426  789  ILE   A CD1 
1338 N  N   . THR   A 100 ? 0.3584 0.434  0.8299 0.0841  -0.0419 0.0357  790  THR   A N   
1339 C  CA  . THR   A 100 ? 0.3447 0.4406 0.8285 0.0773  -0.0483 0.0349  790  THR   A CA  
1340 C  C   . THR   A 100 ? 0.3446 0.445  0.8254 0.0708  -0.0606 0.0346  790  THR   A C   
1341 O  O   . THR   A 100 ? 0.3564 0.4413 0.8252 0.0717  -0.0634 0.0344  790  THR   A O   
1342 C  CB  . THR   A 100 ? 0.3436 0.4466 0.8411 0.0691  -0.0435 0.0337  790  THR   A CB  
1343 O  OG1 . THR   A 100 ? 0.3366 0.4602 0.8451 0.0645  -0.0484 0.0335  790  THR   A OG1 
1344 C  CG2 . THR   A 100 ? 0.347  0.445  0.8454 0.0618  -0.045  0.0326  790  THR   A CG2 
1352 N  N   . GLN   A 101 ? 0.3287 0.4498 0.8184 0.0637  -0.0678 0.0346  791  GLN   A N   
1353 C  CA  . GLN   A 101 ? 0.333  0.4575 0.8182 0.0537  -0.0797 0.0345  791  GLN   A CA  
1354 C  C   . GLN   A 101 ? 0.3302 0.4414 0.8135 0.0453  -0.0799 0.0333  791  GLN   A C   
1355 O  O   . GLN   A 101 ? 0.3261 0.4422 0.8207 0.0428  -0.0737 0.0328  791  GLN   A O   
1356 C  CB  . GLN   A 101 ? 0.3518 0.506  0.8487 0.0462  -0.0861 0.0354  791  GLN   A CB  
1357 C  CG  . GLN   A 101 ? 0.4134 0.5734 0.9033 0.0343  -0.0992 0.0357  791  GLN   A CG  
1358 C  CD  . GLN   A 101 ? 0.4745 0.6692 0.9781 0.0249  -0.1045 0.0373  791  GLN   A CD  
1359 O  OE1 . GLN   A 101 ? 0.4871 0.6935 1.0034 0.0187  -0.1014 0.0377  791  GLN   A OE1 
1360 N  NE2 . GLN   A 101 ? 0.4894 0.7041 0.991  0.0237  -0.1125 0.0384  791  GLN   A NE2 
1369 N  N   . LEU   A 102 ? 0.3309 0.4231 0.7972 0.0435  -0.0864 0.0329  792  LEU   A N   
1370 C  CA  . LEU   A 102 ? 0.3359 0.4124 0.7949 0.0391  -0.0869 0.0319  792  LEU   A CA  
1371 C  C   . LEU   A 102 ? 0.3262 0.414  0.7926 0.0249  -0.0922 0.0318  792  LEU   A C   
1372 O  O   . LEU   A 102 ? 0.3255 0.4246 0.7919 0.0153  -0.1008 0.0326  792  LEU   A O   
1373 C  CB  . LEU   A 102 ? 0.3537 0.4041 0.7874 0.042   -0.0939 0.0315  792  LEU   A CB  
1374 C  CG  . LEU   A 102 ? 0.3832 0.4122 0.8009 0.0402  -0.0963 0.0305  792  LEU   A CG  
1375 C  CD1 . LEU   A 102 ? 0.3904 0.4165 0.8116 0.051   -0.0852 0.0303  792  LEU   A CD1 
1376 C  CD2 . LEU   A 102 ? 0.4093 0.4111 0.7978 0.0421  -0.1057 0.0301  792  LEU   A CD2 
1388 N  N   . MET   A 103 ? 0.3153 0.4028 0.7885 0.0232  -0.0868 0.031   793  MET   A N   
1389 C  CA  . MET   A 103 ? 0.3059 0.4009 0.7841 0.0107  -0.0907 0.031   793  MET   A CA  
1390 C  C   . MET   A 103 ? 0.3121 0.3786 0.766  0.0087  -0.0966 0.0302  793  MET   A C   
1391 O  O   . MET   A 103 ? 0.3174 0.3715 0.7654 0.0177  -0.0909 0.0291  793  MET   A O   
1392 C  CB  . MET   A 103 ? 0.3014 0.4106 0.7987 0.0122  -0.0813 0.0302  793  MET   A CB  
1393 C  CG  . MET   A 103 ? 0.3133 0.4438 0.8284 0.0166  -0.0752 0.0308  793  MET   A CG  
1394 S  SD  . MET   A 103 ? 0.3678 0.5264 0.8941 0.0074  -0.0819 0.0328  793  MET   A SD  
1395 C  CE  . MET   A 103 ? 0.3326 0.494  0.8521 0.0155  -0.0851 0.034   793  MET   A CE  
1405 N  N   . PRO   A 104 ? 0.3123 0.3663 0.7481 -0.0013 -0.1079 0.0308  794  PRO   A N   
1406 C  CA  . PRO   A 104 ? 0.3285 0.3475 0.7336 -0.0006 -0.1137 0.0299  794  PRO   A CA  
1407 C  C   . PRO   A 104 ? 0.3329 0.339  0.7303 -0.0006 -0.1116 0.029   794  PRO   A C   
1408 O  O   . PRO   A 104 ? 0.3553 0.3351 0.7297 0.0093  -0.1116 0.028   794  PRO   A O   
1409 C  CB  . PRO   A 104 ? 0.3435 0.3546 0.7325 -0.0163 -0.1267 0.0308  794  PRO   A CB  
1410 C  CG  . PRO   A 104 ? 0.3313 0.3737 0.7413 -0.0196 -0.1271 0.032   794  PRO   A CG  
1411 C  CD  . PRO   A 104 ? 0.2925 0.3632 0.7322 -0.0136 -0.1162 0.0323  794  PRO   A CD  
1419 N  N   . PHE   A 105 ? 0.3113 0.3354 0.7253 -0.0104 -0.1099 0.0295  795  PHE   A N   
1420 C  CA  . PHE   A 105 ? 0.3112 0.3244 0.7178 -0.0102 -0.1079 0.0287  795  PHE   A CA  
1421 C  C   . PHE   A 105 ? 0.3009 0.3255 0.7226 0.0044  -0.0963 0.0272  795  PHE   A C   
1422 O  O   . PHE   A 105 ? 0.3043 0.3242 0.722  0.0067  -0.0939 0.0263  795  PHE   A O   
1423 C  CB  . PHE   A 105 ? 0.2996 0.3267 0.7158 -0.0274 -0.1113 0.0302  795  PHE   A CB  
1424 C  CG  . PHE   A 105 ? 0.319  0.3312 0.7144 -0.0446 -0.1234 0.0319  795  PHE   A CG  
1425 C  CD1 . PHE   A 105 ? 0.318  0.351  0.7243 -0.0545 -0.1282 0.0335  795  PHE   A CD1 
1426 C  CD2 . PHE   A 105 ? 0.3516 0.3285 0.7143 -0.051  -0.13   0.0318  795  PHE   A CD2 
1427 C  CE1 . PHE   A 105 ? 0.3387 0.3605 0.7256 -0.0725 -0.1398 0.0351  795  PHE   A CE1 
1428 C  CE2 . PHE   A 105 ? 0.3723 0.333  0.7131 -0.0697 -0.1414 0.0335  795  PHE   A CE2 
1429 C  CZ  . PHE   A 105 ? 0.3584 0.3431 0.7124 -0.0814 -0.1464 0.0351  795  PHE   A CZ  
1439 N  N   . GLY   A 106 ? 0.2855 0.3235 0.7217 0.0139  -0.0895 0.027   796  GLY   A N   
1440 C  CA  . GLY   A 106 ? 0.2781 0.3266 0.7261 0.0253  -0.0789 0.0258  796  GLY   A CA  
1441 C  C   . GLY   A 106 ? 0.2586 0.3327 0.733  0.0212  -0.072  0.0251  796  GLY   A C   
1442 O  O   . GLY   A 106 ? 0.2488 0.3391 0.7394 0.013   -0.0725 0.0259  796  GLY   A O   
1446 N  N   . CYS   A 107 ? 0.2537 0.3327 0.7318 0.028   -0.0654 0.0236  797  CYS   A N   
1447 C  CA  . CYS   A 107 ? 0.2385 0.3395 0.7389 0.0249  -0.0586 0.0224  797  CYS   A CA  
1448 C  C   . CYS   A 107 ? 0.2245 0.3254 0.7237 0.0175  -0.0627 0.022   797  CYS   A C   
1449 O  O   . CYS   A 107 ? 0.239  0.3215 0.7174 0.0199  -0.0673 0.0218  797  CYS   A O   
1450 C  CB  . CYS   A 107 ? 0.2564 0.3656 0.7606 0.0343  -0.0502 0.021   797  CYS   A CB  
1451 S  SG  . CYS   A 107 ? 0.3082 0.4422 0.8357 0.0298  -0.0429 0.0188  797  CYS   A SG  
1457 N  N   . LEU   A 108 ? 0.196  0.3155 0.715  0.0097  -0.0607 0.0219  798  LEU   A N   
1458 C  CA  . LEU   A 108 ? 0.1858 0.3079 0.7059 0.0022  -0.0637 0.0219  798  LEU   A CA  
1459 C  C   . LEU   A 108 ? 0.1808 0.3013 0.6964 0.0085  -0.0603 0.0196  798  LEU   A C   
1460 O  O   . LEU   A 108 ? 0.1865 0.2962 0.6895 0.0055  -0.0647 0.0199  798  LEU   A O   
1461 C  CB  . LEU   A 108 ? 0.1678 0.3125 0.7101 -0.0052 -0.0615 0.0224  798  LEU   A CB  
1462 C  CG  . LEU   A 108 ? 0.1775 0.3289 0.7234 -0.0135 -0.0638 0.023   798  LEU   A CG  
1463 C  CD1 . LEU   A 108 ? 0.1977 0.3348 0.7261 -0.0234 -0.073  0.0257  798  LEU   A CD1 
1464 C  CD2 . LEU   A 108 ? 0.1683 0.3437 0.7358 -0.017  -0.0604 0.0235  798  LEU   A CD2 
1476 N  N   . LEU   A 109 ? 0.174  0.305  0.6976 0.0171  -0.053  0.0177  799  LEU   A N   
1477 C  CA  . LEU   A 109 ? 0.1787 0.3129 0.6978 0.0244  -0.0501 0.0155  799  LEU   A CA  
1478 C  C   . LEU   A 109 ? 0.211  0.3205 0.7003 0.033   -0.0553 0.016   799  LEU   A C   
1479 O  O   . LEU   A 109 ? 0.2239 0.3248 0.7004 0.0352  -0.0578 0.0154  799  LEU   A O   
1480 C  CB  . LEU   A 109 ? 0.1637 0.3176 0.6967 0.0301  -0.0415 0.0137  799  LEU   A CB  
1481 C  CG  . LEU   A 109 ? 0.1686 0.3322 0.6974 0.0393  -0.0384 0.0115  799  LEU   A CG  
1482 C  CD1 . LEU   A 109 ? 0.1665 0.338  0.7017 0.0355  -0.0391 0.0097  799  LEU   A CD1 
1483 C  CD2 . LEU   A 109 ? 0.1651 0.3509 0.7077 0.0417  -0.0303 0.0103  799  LEU   A CD2 
1495 N  N   . ASP   A 110 ? 0.2251 0.3203 0.7003 0.0386  -0.0572 0.0173  800  ASP   A N   
1496 C  CA  . ASP   A 110 ? 0.2517 0.3184 0.6936 0.048   -0.0627 0.0178  800  ASP   A CA  
1497 C  C   . ASP   A 110 ? 0.2689 0.3096 0.6916 0.0375  -0.0721 0.0192  800  ASP   A C   
1498 O  O   . ASP   A 110 ? 0.294  0.3083 0.6868 0.043   -0.0768 0.0192  800  ASP   A O   
1499 C  CB  . ASP   A 110 ? 0.2827 0.3405 0.7144 0.0563  -0.0625 0.0189  800  ASP   A CB  
1500 C  CG  . ASP   A 110 ? 0.3252 0.4068 0.7713 0.0659  -0.0533 0.0183  800  ASP   A CG  
1501 O  OD1 . ASP   A 110 ? 0.331  0.4226 0.7734 0.0762  -0.0496 0.017   800  ASP   A OD1 
1502 O  OD2 . ASP   A 110 ? 0.3473 0.4382 0.8071 0.0631  -0.0497 0.0193  800  ASP   A OD2 
1507 N  N   . TYR   A 111 ? 0.2548 0.3024 0.692  0.0225  -0.075  0.0207  801  TYR   A N   
1508 C  CA  . TYR   A 111 ? 0.2688 0.2979 0.6908 0.0089  -0.0838 0.0226  801  TYR   A CA  
1509 C  C   . TYR   A 111 ? 0.269  0.2966 0.6877 0.0047  -0.084  0.0223  801  TYR   A C   
1510 O  O   . TYR   A 111 ? 0.2939 0.2919 0.6828 0.0013  -0.0905 0.0232  801  TYR   A O   
1511 C  CB  . TYR   A 111 ? 0.2565 0.3036 0.6992 -0.005  -0.0857 0.0245  801  TYR   A CB  
1512 C  CG  . TYR   A 111 ? 0.2816 0.3115 0.7064 -0.0203 -0.0957 0.027   801  TYR   A CG  
1513 C  CD1 . TYR   A 111 ? 0.3118 0.3173 0.7126 -0.0215 -0.1029 0.0277  801  TYR   A CD1 
1514 C  CD2 . TYR   A 111 ? 0.2884 0.3268 0.7191 -0.0347 -0.0981 0.0287  801  TYR   A CD2 
1515 C  CE1 . TYR   A 111 ? 0.3348 0.3241 0.7173 -0.0382 -0.1128 0.0298  801  TYR   A CE1 
1516 C  CE2 . TYR   A 111 ? 0.3116 0.3356 0.7247 -0.0515 -0.1073 0.0313  801  TYR   A CE2 
1517 C  CZ  . TYR   A 111 ? 0.3417 0.3409 0.7304 -0.0541 -0.1149 0.0318  801  TYR   A CZ  
1518 O  OH  . TYR   A 111 ? 0.3738 0.3583 0.7432 -0.0733 -0.1247 0.0343  801  TYR   A OH  
1528 N  N   . VAL   A 112 ? 0.2429 0.299  0.6888 0.0048  -0.0772 0.0211  802  VAL   A N   
1529 C  CA  . VAL   A 112 ? 0.2465 0.3025 0.6899 0.0017  -0.0771 0.0207  802  VAL   A CA  
1530 C  C   . VAL   A 112 ? 0.2695 0.3047 0.6858 0.0164  -0.077  0.019   802  VAL   A C   
1531 O  O   . VAL   A 112 ? 0.2768 0.2949 0.6747 0.014   -0.0801 0.0195  802  VAL   A O   
1532 C  CB  . VAL   A 112 ? 0.2269 0.3167 0.7035 -0.0017 -0.0706 0.0196  802  VAL   A CB  
1533 C  CG1 . VAL   A 112 ? 0.2187 0.3266 0.7165 -0.0145 -0.0714 0.0218  802  VAL   A CG1 
1534 C  CG2 . VAL   A 112 ? 0.2135 0.3235 0.7068 0.0104  -0.0625 0.0164  802  VAL   A CG2 
1544 N  N   . ARG   A 113 ? 0.2804 0.3173 0.6925 0.0322  -0.0733 0.0173  803  ARG   A N   
1545 C  CA  . ARG   A 113 ? 0.311  0.3324 0.6964 0.0497  -0.0728 0.0158  803  ARG   A CA  
1546 C  C   . ARG   A 113 ? 0.3638 0.3396 0.7052 0.0527  -0.0811 0.0173  803  ARG   A C   
1547 O  O   . ARG   A 113 ? 0.3838 0.3351 0.6949 0.061   -0.0836 0.0169  803  ARG   A O   
1548 C  CB  . ARG   A 113 ? 0.3077 0.3517 0.7046 0.0651  -0.0659 0.0141  803  ARG   A CB  
1549 C  CG  . ARG   A 113 ? 0.3043 0.3892 0.738  0.0627  -0.0579 0.0121  803  ARG   A CG  
1550 C  CD  . ARG   A 113 ? 0.3161 0.4239 0.7614 0.073   -0.0512 0.0111  803  ARG   A CD  
1551 N  NE  . ARG   A 113 ? 0.3103 0.454  0.7837 0.0713  -0.0441 0.0088  803  ARG   A NE  
1552 C  CZ  . ARG   A 113 ? 0.3014 0.4719 0.7925 0.0734  -0.0374 0.008   803  ARG   A CZ  
1553 N  NH1 . ARG   A 113 ? 0.3012 0.468  0.7864 0.0786  -0.036  0.0098  803  ARG   A NH1 
1554 N  NH2 . ARG   A 113 ? 0.2668 0.4672 0.7806 0.0693  -0.032  0.0057  803  ARG   A NH2 
1568 N  N   . GLU   A 114 ? 0.3869 0.3489 0.7216 0.0466  -0.0856 0.0189  804  GLU   A N   
1569 C  CA  . GLU   A 114 ? 0.4376 0.3533 0.7279 0.0481  -0.0942 0.02    804  GLU   A CA  
1570 C  C   . GLU   A 114 ? 0.4646 0.3557 0.7379 0.0283  -0.1019 0.0221  804  GLU   A C   
1571 O  O   . GLU   A 114 ? 0.4996 0.3513 0.732  0.0316  -0.1069 0.0223  804  GLU   A O   
1572 C  CB  . GLU   A 114 ? 0.4749 0.385  0.7629 0.0486  -0.0967 0.0208  804  GLU   A CB  
1573 C  CG  . GLU   A 114 ? 0.5554 0.4751 0.8425 0.0708  -0.0907 0.0196  804  GLU   A CG  
1574 C  CD  . GLU   A 114 ? 0.6426 0.5753 0.9456 0.071   -0.089  0.0203  804  GLU   A CD  
1575 O  OE1 . GLU   A 114 ? 0.6411 0.5931 0.9537 0.086   -0.0819 0.0197  804  GLU   A OE1 
1576 O  OE2 . GLU   A 114 ? 0.688  0.6133 0.9935 0.056   -0.0946 0.0215  804  GLU   A OE2 
1583 N  N   . HIS   A 115 ? 0.4508 0.3644 0.7527 0.008   -0.1028 0.0237  805  HIS   A N   
1584 C  CA  . HIS   A 115 ? 0.4697 0.366  0.7581 -0.0134 -0.1099 0.0264  805  HIS   A CA  
1585 C  C   . HIS   A 115 ? 0.4684 0.3789 0.7693 -0.02   -0.1066 0.027   805  HIS   A C   
1586 O  O   . HIS   A 115 ? 0.4666 0.3821 0.7736 -0.0405 -0.1102 0.0298  805  HIS   A O   
1587 C  CB  . HIS   A 115 ? 0.4655 0.3794 0.774  -0.0316 -0.1138 0.0285  805  HIS   A CB  
1588 C  CG  . HIS   A 115 ? 0.5027 0.4001 0.7962 -0.0264 -0.1179 0.0281  805  HIS   A CG  
1589 N  ND1 . HIS   A 115 ? 0.5124 0.4327 0.8284 -0.0125 -0.1118 0.0265  805  HIS   A ND1 
1590 C  CD2 . HIS   A 115 ? 0.5394 0.3981 0.7957 -0.0333 -0.1275 0.029   805  HIS   A CD2 
1591 C  CE1 . HIS   A 115 ? 0.533  0.4296 0.8264 -0.0102 -0.1176 0.0266  805  HIS   A CE1 
1592 N  NE2 . HIS   A 115 ? 0.554  0.4129 0.8109 -0.0223 -0.1274 0.0279  805  HIS   A NE2 
1600 N  N   A LYS   A 116 ? 0.4665 0.3841 0.7698 -0.0032 -0.1003 0.0245  806  LYS   A N   
1601 N  N   B LYS   A 116 ? 0.4661 0.3831 0.7686 -0.0029 -0.1003 0.0245  806  LYS   A N   
1602 C  CA  A LYS   A 116 ? 0.4675 0.3979 0.7812 -0.0069 -0.0969 0.0246  806  LYS   A CA  
1603 C  CA  B LYS   A 116 ? 0.4658 0.3963 0.7797 -0.0073 -0.0969 0.0247  806  LYS   A CA  
1604 C  C   A LYS   A 116 ? 0.4959 0.3916 0.7771 -0.0224 -0.1037 0.0277  806  LYS   A C   
1605 C  C   B LYS   A 116 ? 0.4949 0.3907 0.7763 -0.0228 -0.1038 0.0278  806  LYS   A C   
1606 O  O   A LYS   A 116 ? 0.4859 0.399  0.7846 -0.0381 -0.1031 0.0299  806  LYS   A O   
1607 O  O   B LYS   A 116 ? 0.4851 0.3979 0.7836 -0.0387 -0.1033 0.03    806  LYS   A O   
1608 C  CB  A LYS   A 116 ? 0.4895 0.4267 0.8014 0.0162  -0.0905 0.0212  806  LYS   A CB  
1609 C  CB  B LYS   A 116 ? 0.4859 0.4227 0.7975 0.0142  -0.0906 0.0214  806  LYS   A CB  
1610 C  CG  A LYS   A 116 ? 0.5398 0.4773 0.848  0.0168  -0.0884 0.0209  806  LYS   A CG  
1611 C  CG  B LYS   A 116 ? 0.5228 0.4769 0.8439 0.0351  -0.0851 0.0183  806  LYS   A CG  
1612 C  CD  A LYS   A 116 ? 0.5889 0.5426 0.901  0.0394  -0.0821 0.0172  806  LYS   A CD  
1613 C  CD  B LYS   A 116 ? 0.5667 0.5331 0.8874 0.0524  -0.0796 0.0155  806  LYS   A CD  
1614 C  CE  A LYS   A 116 ? 0.6474 0.587  0.9398 0.0441  -0.0819 0.0169  806  LYS   A CE  
1615 C  CE  B LYS   A 116 ? 0.6003 0.5833 0.9234 0.0741  -0.0746 0.0129  806  LYS   A CE  
1616 N  NZ  A LYS   A 116 ? 0.6607 0.6195 0.9778 0.0265  -0.0806 0.0185  806  LYS   A NZ  
1617 N  NZ  B LYS   A 116 ? 0.5935 0.6228 0.9617 0.0714  -0.0676 0.0113  806  LYS   A NZ  
1644 N  N   . ASP   A 117 ? 0.5295 0.3754 0.7616 -0.018  -0.1099 0.028   807  ASP   A N   
1645 C  CA  . ASP   A 117 ? 0.5654 0.3702 0.7586 -0.0331 -0.1165 0.031   807  ASP   A CA  
1646 C  C   . ASP   A 117 ? 0.5687 0.3709 0.763  -0.0631 -0.1237 0.0351  807  ASP   A C   
1647 O  O   . ASP   A 117 ? 0.5976 0.3625 0.7558 -0.079  -0.1301 0.0379  807  ASP   A O   
1648 C  CB  . ASP   A 117 ? 0.63   0.3772 0.7646 -0.0173 -0.121  0.0299  807  ASP   A CB  
1649 C  CG  . ASP   A 117 ? 0.7008 0.4537 0.8318 0.0134  -0.1142 0.0263  807  ASP   A CG  
1650 O  OD1 . ASP   A 117 ? 0.6937 0.4786 0.8517 0.0289  -0.109  0.0237  807  ASP   A OD1 
1651 O  OD2 . ASP   A 117 ? 0.7563 0.483  0.8569 0.0215  -0.114  0.0262  807  ASP   A OD2 
1657 N  N   . ASN   A 118 ? 0.5366 0.3787 0.7704 -0.071  -0.1228 0.0355  808  ASN   A N   
1658 C  CA  . ASN   A 118 ? 0.5323 0.3837 0.7733 -0.098  -0.129  0.0393  808  ASN   A CA  
1659 C  C   . ASN   A 118 ? 0.4807 0.3928 0.7771 -0.1039 -0.1237 0.0402  808  ASN   A C   
1660 O  O   . ASN   A 118 ? 0.4694 0.3985 0.7767 -0.1233 -0.1283 0.0432  808  ASN   A O   
1661 C  CB  . ASN   A 118 ? 0.5771 0.3986 0.7907 -0.1018 -0.1374 0.0391  808  ASN   A CB  
1662 C  CG  . ASN   A 118 ? 0.6717 0.4437 0.8364 -0.1226 -0.1479 0.0419  808  ASN   A CG  
1663 O  OD1 . ASN   A 118 ? 0.7074 0.463  0.8543 -0.1355 -0.1491 0.0445  808  ASN   A OD1 
1664 N  ND2 . ASN   A 118 ? 0.7056 0.4509 0.8453 -0.1274 -0.1559 0.0416  808  ASN   A ND2 
1671 N  N   . ILE   A 119 ? 0.4479 0.3923 0.7766 -0.0881 -0.1143 0.0377  809  ILE   A N   
1672 C  CA  . ILE   A 119 ? 0.4117 0.4078 0.7873 -0.0916 -0.1091 0.0383  809  ILE   A CA  
1673 C  C   . ILE   A 119 ? 0.3935 0.4059 0.7796 -0.1024 -0.1067 0.041   809  ILE   A C   
1674 O  O   . ILE   A 119 ? 0.3976 0.404  0.7797 -0.0921 -0.1022 0.0393  809  ILE   A O   
1675 C  CB  . ILE   A 119 ? 0.4015 0.422  0.8048 -0.0703 -0.1007 0.0341  809  ILE   A CB  
1676 C  CG1 . ILE   A 119 ? 0.4166 0.4287 0.815  -0.0626 -0.1027 0.0326  809  ILE   A CG1 
1677 C  CG2 . ILE   A 119 ? 0.3789 0.4462 0.8244 -0.0731 -0.0948 0.0347  809  ILE   A CG2 
1678 C  CD1 . ILE   A 119 ? 0.4238 0.4454 0.8345 -0.0413 -0.0954 0.0287  809  ILE   A CD1 
1690 N  N   . GLY   A 120 ? 0.3699 0.4052 0.7693 -0.1223 -0.1097 0.0453  810  GLY   A N   
1691 C  CA  . GLY   A 120 ? 0.3552 0.4102 0.7657 -0.1337 -0.1075 0.0487  810  GLY   A CA  
1692 C  C   . GLY   A 120 ? 0.3165 0.4193 0.7696 -0.1249 -0.0996 0.0479  810  GLY   A C   
1693 O  O   . GLY   A 120 ? 0.3057 0.4264 0.7798 -0.1122 -0.0961 0.0449  810  GLY   A O   
1697 N  N   . SER   A 121 ? 0.2978 0.4193 0.7612 -0.1323 -0.0968 0.0508  811  SER   A N   
1698 C  CA  . SER   A 121 ? 0.2681 0.4319 0.7673 -0.1247 -0.0897 0.0504  811  SER   A CA  
1699 C  C   . SER   A 121 ? 0.2448 0.4462 0.7695 -0.1284 -0.0901 0.0524  811  SER   A C   
1700 O  O   . SER   A 121 ? 0.2369 0.4636 0.7868 -0.1149 -0.0843 0.05    811  SER   A O   
1701 C  CB  . SER   A 121 ? 0.2817 0.4552 0.7815 -0.1337 -0.0877 0.054   811  SER   A CB  
1702 O  OG  . SER   A 121 ? 0.3207 0.4946 0.8078 -0.1574 -0.0937 0.0603  811  SER   A OG  
1708 N  N   . GLN   A 122 ? 0.2359 0.4406 0.7521 -0.1468 -0.0971 0.0569  812  GLN   A N   
1709 C  CA  . GLN   A 122 ? 0.21   0.4522 0.7476 -0.1503 -0.0985 0.0592  812  GLN   A CA  
1710 C  C   . GLN   A 122 ? 0.1982 0.4368 0.7435 -0.133  -0.0967 0.0544  812  GLN   A C   
1711 O  O   . GLN   A 122 ? 0.1792 0.4486 0.7486 -0.1227 -0.0924 0.0538  812  GLN   A O   
1712 C  CB  . GLN   A 122 ? 0.2397 0.4814 0.7618 -0.1748 -0.1077 0.0644  812  GLN   A CB  
1713 C  CG  . GLN   A 122 ? 0.2595 0.5467 0.8033 -0.18   -0.1099 0.0676  812  GLN   A CG  
1714 C  CD  . GLN   A 122 ? 0.2781 0.6131 0.8457 -0.1836 -0.1058 0.0722  812  GLN   A CD  
1715 O  OE1 . GLN   A 122 ? 0.2897 0.6384 0.8521 -0.2048 -0.1094 0.078   812  GLN   A OE1 
1716 N  NE2 . GLN   A 122 ? 0.2688 0.6295 0.861  -0.1632 -0.0982 0.0701  812  GLN   A NE2 
1725 N  N   . TYR   A 123 ? 0.2125 0.4124 0.7353 -0.1288 -0.0997 0.0512  813  TYR   A N   
1726 C  CA  . TYR   A 123 ? 0.2154 0.4092 0.7426 -0.1129 -0.0977 0.047   813  TYR   A CA  
1727 C  C   . TYR   A 123 ? 0.1953 0.3998 0.742  -0.0938 -0.0884 0.0429  813  TYR   A C   
1728 O  O   . TYR   A 123 ? 0.1839 0.4061 0.7477 -0.084  -0.0848 0.0415  813  TYR   A O   
1729 C  CB  . TYR   A 123 ? 0.2484 0.3974 0.7443 -0.1111 -0.1024 0.0447  813  TYR   A CB  
1730 C  CG  . TYR   A 123 ? 0.2808 0.4164 0.7564 -0.128  -0.1122 0.0477  813  TYR   A CG  
1731 C  CD1 . TYR   A 123 ? 0.2931 0.4336 0.7715 -0.1254 -0.1152 0.047   813  TYR   A CD1 
1732 C  CD2 . TYR   A 123 ? 0.3095 0.4296 0.7632 -0.1483 -0.1185 0.0514  813  TYR   A CD2 
1733 C  CE1 . TYR   A 123 ? 0.3196 0.4497 0.7795 -0.1418 -0.1249 0.0494  813  TYR   A CE1 
1734 C  CE2 . TYR   A 123 ? 0.3365 0.4448 0.7704 -0.1668 -0.1281 0.0541  813  TYR   A CE2 
1735 C  CZ  . TYR   A 123 ? 0.3489 0.4628 0.7864 -0.1633 -0.1316 0.0528  813  TYR   A CZ  
1736 O  OH  . TYR   A 123 ? 0.3948 0.499  0.813  -0.1821 -0.1417 0.0552  813  TYR   A OH  
1746 N  N   . LEU   A 124 ? 0.1926 0.3853 0.7347 -0.0889 -0.0846 0.041   814  LEU   A N   
1747 C  CA  . LEU   A 124 ? 0.1795 0.3815 0.738  -0.0728 -0.0765 0.0367  814  LEU   A CA  
1748 C  C   . LEU   A 124 ? 0.1596 0.3972 0.7445 -0.0706 -0.0719 0.0377  814  LEU   A C   
1749 O  O   . LEU   A 124 ? 0.1561 0.4026 0.7543 -0.059  -0.0668 0.0348  814  LEU   A O   
1750 C  CB  . LEU   A 124 ? 0.1842 0.37   0.732  -0.0689 -0.0743 0.0347  814  LEU   A CB  
1751 C  CG  . LEU   A 124 ? 0.217  0.3674 0.7382 -0.0624 -0.0765 0.0321  814  LEU   A CG  
1752 C  CD1 . LEU   A 124 ? 0.2354 0.3674 0.7381 -0.0629 -0.077  0.0321  814  LEU   A CD1 
1753 C  CD2 . LEU   A 124 ? 0.2141 0.3662 0.7435 -0.0462 -0.0712 0.0274  814  LEU   A CD2 
1765 N  N   . LEU   A 125 ? 0.1477 0.4048 0.7378 -0.0816 -0.0736 0.0422  815  LEU   A N   
1766 C  CA  . LEU   A 125 ? 0.1263 0.4181 0.7387 -0.0775 -0.0694 0.0436  815  LEU   A CA  
1767 C  C   . LEU   A 125 ? 0.1069 0.4163 0.7271 -0.0749 -0.0706 0.0451  815  LEU   A C   
1768 O  O   . LEU   A 125 ? 0.1025 0.422  0.7304 -0.0617 -0.065  0.0437  815  LEU   A O   
1769 C  CB  . LEU   A 125 ? 0.122  0.4321 0.737  -0.0889 -0.0702 0.0484  815  LEU   A CB  
1770 C  CG  . LEU   A 125 ? 0.1454 0.4386 0.752  -0.0884 -0.0678 0.0468  815  LEU   A CG  
1771 C  CD1 . LEU   A 125 ? 0.1502 0.4538 0.7523 -0.1036 -0.0701 0.0526  815  LEU   A CD1 
1772 C  CD2 . LEU   A 125 ? 0.1388 0.4405 0.7599 -0.0727 -0.0604 0.0423  815  LEU   A CD2 
1784 N  N   . ASN   A 126 ? 0.1022 0.4038 0.7093 -0.0846 -0.0772 0.0477  816  ASN   A N   
1785 C  CA  . ASN   A 126 ? 0.0916 0.4044 0.6994 -0.0798 -0.0782 0.0489  816  ASN   A CA  
1786 C  C   . ASN   A 126 ? 0.0952 0.3778 0.6894 -0.0614 -0.0725 0.0443  816  ASN   A C   
1787 O  O   . ASN   A 126 ? 0.0901 0.3843 0.6902 -0.051  -0.0687 0.0439  816  ASN   A O   
1788 C  CB  . ASN   A 126 ? 0.1057 0.4249 0.7105 -0.0981 -0.0884 0.052   816  ASN   A CB  
1789 C  CG  . ASN   A 126 ? 0.1391 0.4885 0.7484 -0.1151 -0.0925 0.0581  816  ASN   A CG  
1790 O  OD1 . ASN   A 126 ? 0.1331 0.5157 0.7593 -0.1114 -0.0883 0.0604  816  ASN   A OD1 
1791 N  ND2 . ASN   A 126 ? 0.1564 0.495  0.749  -0.1346 -0.1007 0.0609  816  ASN   A ND2 
1798 N  N   . TRP   A 127 ? 0.1023 0.3466 0.6772 -0.0571 -0.0713 0.0409  817  TRP   A N   
1799 C  CA  . TRP   A 127 ? 0.1064 0.3248 0.6698 -0.0424 -0.0654 0.0367  817  TRP   A CA  
1800 C  C   . TRP   A 127 ? 0.0981 0.3034 0.651  -0.0301 -0.0556 0.0344  817  TRP   A C   
1801 O  O   . TRP   A 127 ? 0.098  0.302  0.652  -0.0224 -0.0519 0.0329  817  TRP   A O   
1802 C  CB  . TRP   A 127 ? 0.1183 0.3147 0.6749 -0.0418 -0.0668 0.0337  817  TRP   A CB  
1803 C  CG  . TRP   A 127 ? 0.1273 0.3257 0.6866 -0.0534 -0.0769 0.0349  817  TRP   A CG  
1804 C  CD1 . TRP   A 127 ? 0.1331 0.3459 0.6987 -0.0617 -0.084  0.0371  817  TRP   A CD1 
1805 C  CD2 . TRP   A 127 ? 0.138  0.3158 0.685  -0.0573 -0.0813 0.0335  817  TRP   A CD2 
1806 N  NE1 . TRP   A 127 ? 0.1527 0.338  0.6945 -0.0687 -0.0909 0.0375  817  TRP   A NE1 
1807 C  CE2 . TRP   A 127 ? 0.1586 0.3203 0.6873 -0.065  -0.0892 0.0353  817  TRP   A CE2 
1808 C  CE3 . TRP   A 127 ? 0.1525 0.3151 0.6912 -0.052  -0.0784 0.031   817  TRP   A CE3 
1809 C  CZ2 . TRP   A 127 ? 0.1839 0.3109 0.6839 -0.0669 -0.0941 0.0348  817  TRP   A CZ2 
1810 C  CZ3 . TRP   A 127 ? 0.18   0.311  0.6913 -0.0524 -0.083  0.0307  817  TRP   A CZ3 
1811 C  CH2 . TRP   A 127 ? 0.1932 0.3048 0.6841 -0.0598 -0.0907 0.0326  817  TRP   A CH2 
1822 N  N   . CYS   A 128 ? 0.0921 0.2843 0.6305 -0.0289 -0.0517 0.0342  818  CYS   A N   
1823 C  CA  . CYS   A 128 ? 0.0899 0.278  0.6255 -0.0211 -0.0446 0.0317  818  CYS   A CA  
1824 C  C   . CYS   A 128 ? 0.0779 0.2824 0.6157 -0.0177 -0.0432 0.0341  818  CYS   A C   
1825 O  O   . CYS   A 128 ? 0.0774 0.2707 0.6083 -0.01   -0.0382 0.0314  818  CYS   A O   
1826 C  CB  . CYS   A 128 ? 0.0945 0.2918 0.6377 -0.0239 -0.044  0.0314  818  CYS   A CB  
1827 S  SG  . CYS   A 128 ? 0.1191 0.3214 0.6815 -0.0271 -0.0461 0.0274  818  CYS   A SG  
1833 N  N   . VAL   A 129 ? 0.0676 0.2968 0.6108 -0.0238 -0.0477 0.0392  819  VAL   A N   
1834 C  CA  . VAL   A 129 ? 0.059  0.3242 0.6179 -0.0206 -0.0481 0.0421  819  VAL   A CA  
1835 C  C   . VAL   A 129 ? 0.0595 0.3261 0.6239 -0.0141 -0.0483 0.0405  819  VAL   A C   
1836 O  O   . VAL   A 129 ? 0.058  0.3318 0.6258 -0.0038 -0.0443 0.0394  819  VAL   A O   
1837 C  CB  . VAL   A 129 ? 0.0521 0.3567 0.6255 -0.0321 -0.0548 0.0483  819  VAL   A CB  
1838 C  CG1 . VAL   A 129 ? 0.0476 0.404  0.647  -0.0278 -0.0569 0.0514  819  VAL   A CG1 
1839 C  CG2 . VAL   A 129 ? 0.0492 0.362  0.6232 -0.0385 -0.0542 0.0507  819  VAL   A CG2 
1849 N  N   . GLN   A 130 ? 0.0623 0.3173 0.6229 -0.0192 -0.0527 0.0405  820  GLN   A N   
1850 C  CA  . GLN   A 130 ? 0.0636 0.3203 0.6287 -0.0141 -0.0539 0.0395  820  GLN   A CA  
1851 C  C   . GLN   A 130 ? 0.0751 0.3111 0.6385 -0.0047 -0.0476 0.0349  820  GLN   A C   
1852 O  O   . GLN   A 130 ? 0.0785 0.3292 0.6542 0.004   -0.0465 0.0345  820  GLN   A O   
1853 C  CB  . GLN   A 130 ? 0.0746 0.3446 0.656  -0.0245 -0.0631 0.0404  820  GLN   A CB  
1854 C  CG  . GLN   A 130 ? 0.0845 0.42   0.7087 -0.0413 -0.0753 0.0449  820  GLN   A CG  
1855 C  CD  . GLN   A 130 ? 0.1466 0.4659 0.7601 -0.0546 -0.0834 0.0453  820  GLN   A CD  
1856 O  OE1 . GLN   A 130 ? 0.1741 0.4649 0.7765 -0.0501 -0.0833 0.0423  820  GLN   A OE1 
1857 N  NE2 . GLN   A 130 ? 0.1463 0.4791 0.7572 -0.0714 -0.0904 0.0491  820  GLN   A NE2 
1866 N  N   . ILE   A 131 ? 0.0779 0.2791 0.6231 -0.0057 -0.0432 0.0317  821  ILE   A N   
1867 C  CA  . ILE   A 131 ? 0.0826 0.2586 0.6178 0       -0.0367 0.0276  821  ILE   A CA  
1868 C  C   . ILE   A 131 ? 0.0777 0.2614 0.6147 0.0059  -0.0321 0.0268  821  ILE   A C   
1869 O  O   . ILE   A 131 ? 0.0779 0.2557 0.6132 0.0119  -0.0284 0.0253  821  ILE   A O   
1870 C  CB  . ILE   A 131 ? 0.0891 0.2401 0.6137 -0.0029 -0.0346 0.0244  821  ILE   A CB  
1871 C  CG1 . ILE   A 131 ? 0.097  0.2484 0.6263 -0.0065 -0.0398 0.0251  821  ILE   A CG1 
1872 C  CG2 . ILE   A 131 ? 0.0954 0.2355 0.6208 0.0007  -0.0286 0.0204  821  ILE   A CG2 
1873 C  CD1 . ILE   A 131 ? 0.1105 0.2691 0.6527 -0.0101 -0.0415 0.0232  821  ILE   A CD1 
1885 N  N   . ALA   A 132 ? 0.0733 0.2712 0.6138 0.0047  -0.0324 0.0282  822  ALA   A N   
1886 C  CA  . ALA   A 132 ? 0.0737 0.2909 0.6257 0.0125  -0.0291 0.0277  822  ALA   A CA  
1887 C  C   . ALA   A 132 ? 0.0684 0.3128 0.6308 0.0223  -0.03   0.0305  822  ALA   A C   
1888 O  O   . ALA   A 132 ? 0.0674 0.3101 0.6265 0.0324  -0.0258 0.029   822  ALA   A O   
1889 C  CB  . ALA   A 132 ? 0.0687 0.3003 0.6241 0.0098  -0.0297 0.0294  822  ALA   A CB  
1895 N  N   . LYS   A 133 ? 0.0628 0.3293 0.6334 0.02    -0.0355 0.0343  823  LYS   A N   
1896 C  CA  . LYS   A 133 ? 0.0598 0.3669 0.6508 0.0322  -0.038  0.0371  823  LYS   A CA  
1897 C  C   . LYS   A 133 ? 0.0738 0.3771 0.6747 0.0435  -0.0363 0.0348  823  LYS   A C   
1898 O  O   . LYS   A 133 ? 0.073  0.3842 0.6733 0.0597  -0.0334 0.0351  823  LYS   A O   
1899 C  CB  . LYS   A 133 ? 0.0531 0.3975 0.6612 0.0251  -0.0463 0.0417  823  LYS   A CB  
1900 C  CG  . LYS   A 133 ? 0.053  0.4468 0.6877 0.0195  -0.0504 0.0458  823  LYS   A CG  
1901 C  CD  . LYS   A 133 ? 0.0782 0.5181 0.7364 0.0086  -0.06   0.0505  823  LYS   A CD  
1902 C  CE  . LYS   A 133 ? 0.0873 0.5683 0.7564 0.004   -0.0616 0.0554  823  LYS   A CE  
1903 N  NZ  . LYS   A 133 ? 0.0947 0.5997 0.7679 -0.0148 -0.07   0.0598  823  LYS   A NZ  
1917 N  N   . GLY   A 134 ? 0.0865 0.3731 0.6903 0.0362  -0.0375 0.0329  824  GLY   A N   
1918 C  CA  . GLY   A 134 ? 0.1052 0.3815 0.7125 0.0451  -0.035  0.0311  824  GLY   A CA  
1919 C  C   . GLY   A 134 ? 0.1278 0.3815 0.7264 0.0515  -0.0272 0.0278  824  GLY   A C   
1920 O  O   . GLY   A 134 ? 0.1452 0.3831 0.7294 0.0627  -0.0231 0.0274  824  GLY   A O   
1924 N  N   . MET   A 135 ? 0.1232 0.3749 0.7283 0.0444  -0.0252 0.0254  825  MET   A N   
1925 C  CA  . MET   A 135 ? 0.1384 0.3695 0.7346 0.0478  -0.0186 0.0219  825  MET   A CA  
1926 C  C   . MET   A 135 ? 0.1483 0.383  0.7351 0.0619  -0.0162 0.0227  825  MET   A C   
1927 O  O   . MET   A 135 ? 0.1631 0.3729 0.7328 0.0691  -0.0109 0.0206  825  MET   A O   
1928 C  CB  . MET   A 135 ? 0.1378 0.3693 0.7437 0.0369  -0.018  0.0191  825  MET   A CB  
1929 C  CG  . MET   A 135 ? 0.1578 0.38   0.7675 0.0262  -0.0186 0.0174  825  MET   A CG  
1930 S  SD  . MET   A 135 ? 0.2132 0.4082 0.8091 0.0272  -0.0136 0.016   825  MET   A SD  
1931 C  CE  . MET   A 135 ? 0.2419 0.4196 0.829  0.0262  -0.0068 0.012   825  MET   A CE  
1941 N  N   . ASN   A 136 ? 0.1382 0.4031 0.7338 0.0663  -0.0198 0.026   826  ASN   A N   
1942 C  CA  . ASN   A 136 ? 0.1475 0.4205 0.7331 0.0831  -0.0177 0.0274  826  ASN   A CA  
1943 C  C   . ASN   A 136 ? 0.1657 0.4283 0.7341 0.0976  -0.0164 0.0287  826  ASN   A C   
1944 O  O   . ASN   A 136 ? 0.1821 0.4251 0.73   0.112   -0.0118 0.0276  826  ASN   A O   
1945 C  CB  . ASN   A 136 ? 0.1395 0.4534 0.7399 0.0836  -0.0221 0.0315  826  ASN   A CB  
1946 C  CG  . ASN   A 136 ? 0.1706 0.4986 0.7612 0.103   -0.0199 0.0335  826  ASN   A CG  
1947 O  OD1 . ASN   A 136 ? 0.1963 0.5079 0.7758 0.1105  -0.0155 0.0309  826  ASN   A OD1 
1948 N  ND2 . ASN   A 136 ? 0.1631 0.5221 0.7558 0.1124  -0.023  0.0379  826  ASN   A ND2 
1955 N  N   . TYR   A 137 ? 0.1647 0.4364 0.7383 0.094   -0.0205 0.0308  827  TYR   A N   
1956 C  CA  . TYR   A 137 ? 0.1848 0.4461 0.7421 0.1075  -0.0196 0.032   827  TYR   A CA  
1957 C  C   . TYR   A 137 ? 0.2139 0.4296 0.7506 0.1094  -0.0129 0.0285  827  TYR   A C   
1958 O  O   . TYR   A 137 ? 0.2347 0.432  0.7486 0.1256  -0.0091 0.0286  827  TYR   A O   
1959 C  CB  . TYR   A 137 ? 0.1818 0.4587 0.749  0.1003  -0.0257 0.0343  827  TYR   A CB  
1960 C  CG  . TYR   A 137 ? 0.2092 0.4715 0.7591 0.1131  -0.0246 0.0349  827  TYR   A CG  
1961 C  CD1 . TYR   A 137 ? 0.2239 0.4992 0.7616 0.1335  -0.0242 0.0372  827  TYR   A CD1 
1962 C  CD2 . TYR   A 137 ? 0.2364 0.4701 0.7797 0.107   -0.0229 0.0332  827  TYR   A CD2 
1963 C  CE1 . TYR   A 137 ? 0.2504 0.509  0.769  0.1472  -0.0226 0.0376  827  TYR   A CE1 
1964 C  CE2 . TYR   A 137 ? 0.2627 0.4802 0.7881 0.1194  -0.0212 0.0339  827  TYR   A CE2 
1965 C  CZ  . TYR   A 137 ? 0.2769 0.506  0.7897 0.1395  -0.0212 0.036   827  TYR   A CZ  
1966 O  OH  . TYR   A 137 ? 0.3141 0.5255 0.8066 0.1535  -0.0192 0.0366  827  TYR   A OH  
1976 N  N   . LEU   A 138 ? 0.2167 0.4148 0.7594 0.0931  -0.0115 0.0257  828  LEU   A N   
1977 C  CA  . LEU   A 138 ? 0.2401 0.3991 0.7651 0.0908  -0.0051 0.0229  828  LEU   A CA  
1978 C  C   . LEU   A 138 ? 0.2655 0.4037 0.7732 0.0971  0       0.0205  828  LEU   A C   
1979 O  O   . LEU   A 138 ? 0.2884 0.393  0.7705 0.1035  0.005   0.0194  828  LEU   A O   
1980 C  CB  . LEU   A 138 ? 0.2337 0.3869 0.7715 0.0721  -0.005  0.0208  828  LEU   A CB  
1981 C  CG  . LEU   A 138 ? 0.2335 0.3985 0.7829 0.0659  -0.0097 0.0226  828  LEU   A CG  
1982 C  CD1 . LEU   A 138 ? 0.2349 0.3956 0.7944 0.0507  -0.0092 0.0205  828  LEU   A CD1 
1983 C  CD2 . LEU   A 138 ? 0.248  0.3975 0.7817 0.0748  -0.0083 0.0243  828  LEU   A CD2 
1995 N  N   . GLU   A 139 ? 0.2629 0.4184 0.7812 0.0956  -0.0015 0.0197  829  GLU   A N   
1996 C  CA  . GLU   A 139 ? 0.2886 0.4246 0.7888 0.1027  0.0025  0.0173  829  GLU   A CA  
1997 C  C   . GLU   A 139 ? 0.3137 0.4417 0.789  0.1263  0.0042  0.0194  829  GLU   A C   
1998 O  O   . GLU   A 139 ? 0.3393 0.43   0.7851 0.1337  0.009   0.0173  829  GLU   A O   
1999 C  CB  . GLU   A 139 ? 0.2976 0.4579 0.8156 0.0979  0.0002  0.0165  829  GLU   A CB  
2000 C  CG  . GLU   A 139 ? 0.3586 0.498  0.8568 0.1056  0.0038  0.0137  829  GLU   A CG  
2001 C  CD  . GLU   A 139 ? 0.4069 0.5637 0.9207 0.0987  0.0023  0.012   829  GLU   A CD  
2002 O  OE1 . GLU   A 139 ? 0.4049 0.5923 0.9454 0.0886  -0.0017 0.0135  829  GLU   A OE1 
2003 O  OE2 . GLU   A 139 ? 0.4405 0.5776 0.9372 0.1036  0.0049  0.0091  829  GLU   A OE2 
2010 N  N   . ASP   A 140 ? 0.3054 0.4675 0.7899 0.1381  0.0001  0.0235  830  ASP   A N   
2011 C  CA  . ASP   A 140 ? 0.3227 0.4839 0.7842 0.1633  0.0012  0.0259  830  ASP   A CA  
2012 C  C   . ASP   A 140 ? 0.3475 0.4687 0.7805 0.1707  0.0053  0.0253  830  ASP   A C   
2013 O  O   . ASP   A 140 ? 0.3645 0.4616 0.7655 0.1908  0.0088  0.0255  830  ASP   A O   
2014 C  CB  . ASP   A 140 ? 0.3227 0.5352 0.8037 0.1708  -0.0046 0.0306  830  ASP   A CB  
2015 C  CG  . ASP   A 140 ? 0.369  0.6223 0.8707 0.1692  -0.0078 0.0325  830  ASP   A CG  
2016 O  OD1 . ASP   A 140 ? 0.3885 0.6297 0.8892 0.1646  -0.0053 0.0299  830  ASP   A OD1 
2017 O  OD2 . ASP   A 140 ? 0.374  0.672  0.8926 0.1719  -0.0127 0.0367  830  ASP   A OD2 
2022 N  N   . ARG   A 141 ? 0.3459 0.4578 0.7877 0.1553  0.005   0.0249  831  ARG   A N   
2023 C  CA  . ARG   A 141 ? 0.3715 0.4454 0.7878 0.1596  0.0092  0.0247  831  ARG   A CA  
2024 C  C   . ARG   A 141 ? 0.3871 0.4141 0.7841 0.1469  0.0155  0.0209  831  ARG   A C   
2025 O  O   . ARG   A 141 ? 0.4046 0.4016 0.7859 0.1423  0.0192  0.0208  831  ARG   A O   
2026 C  CB  . ARG   A 141 ? 0.3865 0.4753 0.8211 0.1498  0.0058  0.0264  831  ARG   A CB  
2027 C  CG  . ARG   A 141 ? 0.4203 0.5573 0.8773 0.1551  -0.0016 0.0297  831  ARG   A CG  
2028 C  CD  . ARG   A 141 ? 0.4812 0.6319 0.9221 0.1808  -0.0025 0.0325  831  ARG   A CD  
2029 N  NE  . ARG   A 141 ? 0.5564 0.6703 0.9651 0.1952  0.002   0.0326  831  ARG   A NE  
2030 C  CZ  . ARG   A 141 ? 0.594  0.7061 1.001  0.1965  0.0006  0.034   831  ARG   A CZ  
2031 N  NH1 . ARG   A 141 ? 0.5727 0.7176 1.0075 0.1844  -0.006  0.0352  831  ARG   A NH1 
2032 N  NH2 . ARG   A 141 ? 0.6199 0.6949 0.9944 0.2104  0.0055  0.0342  831  ARG   A NH2 
2046 N  N   . ARG   A 142 ? 0.379  0.4008 0.7763 0.1406  0.0165  0.0181  832  ARG   A N   
2047 C  CA  . ARG   A 142 ? 0.3963 0.3789 0.7768 0.1262  0.0214  0.0143  832  ARG   A CA  
2048 C  C   . ARG   A 142 ? 0.3846 0.3637 0.7801 0.1033  0.0226  0.0134  832  ARG   A C   
2049 O  O   . ARG   A 142 ? 0.4058 0.3482 0.78   0.0937  0.0278  0.0118  832  ARG   A O   
2050 C  CB  . ARG   A 142 ? 0.449  0.381  0.7822 0.1403  0.0268  0.0137  832  ARG   A CB  
2051 C  CG  . ARG   A 142 ? 0.4919 0.427  0.8056 0.1679  0.0259  0.015   832  ARG   A CG  
2052 C  CD  . ARG   A 142 ? 0.5641 0.4418 0.8246 0.1828  0.0313  0.014   832  ARG   A CD  
2053 N  NE  . ARG   A 142 ? 0.6184 0.4536 0.8588 0.1653  0.0348  0.0098  832  ARG   A NE  
2054 C  CZ  . ARG   A 142 ? 0.6515 0.4833 0.8888 0.1632  0.034   0.0067  832  ARG   A CZ  
2055 N  NH1 . ARG   A 142 ? 0.6285 0.4981 0.8823 0.1783  0.0302  0.0078  832  ARG   A NH1 
2056 N  NH2 . ARG   A 142 ? 0.6753 0.4674 0.8928 0.1451  0.0368  0.0027  832  ARG   A NH2 
2070 N  N   . LEU   A 143 ? 0.3476 0.3648 0.7778 0.0944  0.018   0.0146  833  LEU   A N   
2071 C  CA  . LEU   A 143 ? 0.3336 0.352  0.778  0.0764  0.0188  0.0142  833  LEU   A CA  
2072 C  C   . LEU   A 143 ? 0.3101 0.3483 0.7791 0.0594  0.0169  0.0115  833  LEU   A C   
2073 O  O   . LEU   A 143 ? 0.2948 0.3643 0.7854 0.0608  0.012   0.0119  833  LEU   A O   
2074 C  CB  . LEU   A 143 ? 0.3209 0.3623 0.78   0.0814  0.0146  0.0176  833  LEU   A CB  
2075 C  CG  . LEU   A 143 ? 0.3319 0.3726 0.8002 0.0689  0.0154  0.0183  833  LEU   A CG  
2076 C  CD1 . LEU   A 143 ? 0.3182 0.3853 0.8149 0.0542  0.0119  0.017   833  LEU   A CD1 
2077 C  CD2 . LEU   A 143 ? 0.3612 0.3654 0.8069 0.0615  0.0228  0.0174  833  LEU   A CD2 
2089 N  N   . VAL   A 144 ? 0.3025 0.3236 0.7673 0.043   0.021   0.0089  834  VAL   A N   
2090 C  CA  . VAL   A 144 ? 0.2803 0.3208 0.7669 0.0274  0.0196  0.0061  834  VAL   A CA  
2091 C  C   . VAL   A 144 ? 0.2537 0.3094 0.7568 0.0189  0.019   0.0077  834  VAL   A C   
2092 O  O   . VAL   A 144 ? 0.2654 0.3033 0.7567 0.0133  0.0234  0.0085  834  VAL   A O   
2093 C  CB  . VAL   A 144 ? 0.3038 0.3209 0.7754 0.0146  0.0239  0.0022  834  VAL   A CB  
2094 C  CG1 . VAL   A 144 ? 0.2956 0.3379 0.7907 0.0012  0.0217  -0.0009 834  VAL   A CG1 
2095 C  CG2 . VAL   A 144 ? 0.3306 0.3227 0.7767 0.0258  0.025   0.0009  834  VAL   A CG2 
2105 N  N   . HIS   A 145 ? 0.2156 0.3021 0.7429 0.019   0.0135  0.0085  835  HIS   A N   
2106 C  CA  . HIS   A 145 ? 0.1947 0.2946 0.735  0.014   0.012   0.01    835  HIS   A CA  
2107 C  C   . HIS   A 145 ? 0.1811 0.2818 0.7254 -0.0007 0.0157  0.0079  835  HIS   A C   
2108 O  O   . HIS   A 145 ? 0.1786 0.2767 0.721  -0.0038 0.018   0.0095  835  HIS   A O   
2109 C  CB  . HIS   A 145 ? 0.1817 0.3094 0.7418 0.0168  0.0049  0.0111  835  HIS   A CB  
2110 C  CG  . HIS   A 145 ? 0.1837 0.3204 0.7514 0.0154  0.0021  0.013   835  HIS   A CG  
2111 N  ND1 . HIS   A 145 ? 0.1927 0.3356 0.7674 0.0068  0.0033  0.0117  835  HIS   A ND1 
2112 C  CD2 . HIS   A 145 ? 0.1909 0.332  0.7586 0.0222  -0.0023 0.016   835  HIS   A CD2 
2113 C  CE1 . HIS   A 145 ? 0.1975 0.3448 0.7741 0.0098  0       0.014   835  HIS   A CE1 
2114 N  NE2 . HIS   A 145 ? 0.1979 0.3434 0.7706 0.0181  -0.0038 0.0164  835  HIS   A NE2 
2122 N  N   . ARG   A 146 ? 0.1696 0.2773 0.7201 -0.0092 0.0161  0.0044  836  ARG   A N   
2123 C  CA  . ARG   A 146 ? 0.165  0.2799 0.7207 -0.0237 0.0193  0.002   836  ARG   A CA  
2124 C  C   . ARG   A 146 ? 0.1473 0.2876 0.7203 -0.0256 0.017   0.0028  836  ARG   A C   
2125 O  O   . ARG   A 146 ? 0.139  0.2928 0.7188 -0.0355 0.0189  0.0007  836  ARG   A O   
2126 C  CB  . ARG   A 146 ? 0.1954 0.2863 0.732  -0.0328 0.026   0.0022  836  ARG   A CB  
2127 C  CG  . ARG   A 146 ? 0.2545 0.3141 0.7677 -0.0319 0.0285  0.0008  836  ARG   A CG  
2128 C  CD  . ARG   A 146 ? 0.3058 0.3361 0.7953 -0.0425 0.0352  0.0012  836  ARG   A CD  
2129 N  NE  . ARG   A 146 ? 0.3246 0.3682 0.8213 -0.0621 0.0381  -0.0007 836  ARG   A NE  
2130 C  CZ  . ARG   A 146 ? 0.3499 0.3968 0.8453 -0.0729 0.0427  0.0014  836  ARG   A CZ  
2131 N  NH1 . ARG   A 146 ? 0.3523 0.3859 0.8379 -0.066  0.0453  0.0056  836  ARG   A NH1 
2132 N  NH2 . ARG   A 146 ? 0.3385 0.4043 0.8422 -0.0906 0.0447  -0.0004 836  ARG   A NH2 
2146 N  N   . ASP   A 147 ? 0.1371 0.2847 0.7159 -0.0159 0.0126  0.0056  837  ASP   A N   
2147 C  CA  . ASP   A 147 ? 0.1322 0.2982 0.7216 -0.0157 0.0102  0.0063  837  ASP   A CA  
2148 C  C   . ASP   A 147 ? 0.1269 0.2993 0.7206 -0.0081 0.0029  0.0073  837  ASP   A C   
2149 O  O   . ASP   A 147 ? 0.1299 0.3065 0.7242 -0.0042 -0.0001 0.0092  837  ASP   A O   
2150 C  CB  . ASP   A 147 ? 0.1602 0.3188 0.7417 -0.0142 0.0132  0.0092  837  ASP   A CB  
2151 C  CG  . ASP   A 147 ? 0.2082 0.3845 0.7961 -0.016  0.0138  0.0095  837  ASP   A CG  
2152 O  OD1 . ASP   A 147 ? 0.2009 0.3954 0.7989 -0.0177 0.0117  0.0072  837  ASP   A OD1 
2153 O  OD2 . ASP   A 147 ? 0.2431 0.4153 0.8245 -0.0139 0.0165  0.0121  837  ASP   A OD2 
2158 N  N   . LEU   A 148 ? 0.1247 0.2835 0.7057 -0.0062 0       0.0062  838  LEU   A N   
2159 C  CA  . LEU   A 148 ? 0.1248 0.276  0.6947 -0.0021 -0.0062 0.0077  838  LEU   A CA  
2160 C  C   . LEU   A 148 ? 0.1207 0.2668 0.6792 -0.0038 -0.008  0.0061  838  LEU   A C   
2161 O  O   . LEU   A 148 ? 0.1151 0.2619 0.6711 -0.0068 -0.006  0.0031  838  LEU   A O   
2162 C  CB  . LEU   A 148 ? 0.1244 0.277  0.6953 -0.0002 -0.0079 0.0076  838  LEU   A CB  
2163 C  CG  . LEU   A 148 ? 0.1319 0.3003 0.7126 0.0015  -0.0141 0.0097  838  LEU   A CG  
2164 C  CD1 . LEU   A 148 ? 0.1316 0.2969 0.7071 0.0038  -0.0184 0.0132  838  LEU   A CD1 
2165 C  CD2 . LEU   A 148 ? 0.1342 0.3197 0.7284 0.0047  -0.0146 0.0101  838  LEU   A CD2 
2177 N  N   . ALA   A 149 ? 0.1193 0.255  0.6646 -0.0012 -0.0117 0.0082  839  ALA   A N   
2178 C  CA  . ALA   A 149 ? 0.1203 0.2607 0.6632 -0.0007 -0.014  0.0072  839  ALA   A CA  
2179 C  C   . ALA   A 149 ? 0.1231 0.2575 0.6597 0.0019  -0.0197 0.0101  839  ALA   A C   
2180 O  O   . ALA   A 149 ? 0.1246 0.2564 0.6626 0.003   -0.0213 0.0125  839  ALA   A O   
2181 C  CB  . ALA   A 149 ? 0.1175 0.2702 0.6657 -0.0007 -0.0098 0.0058  839  ALA   A CB  
2187 N  N   . ALA   A 150 ? 0.121  0.2505 0.6475 0.0028  -0.023  0.0098  840  ALA   A N   
2188 C  CA  . ALA   A 150 ? 0.1263 0.2569 0.654  0.0044  -0.0297 0.0123  840  ALA   A CA  
2189 C  C   . ALA   A 150 ? 0.127  0.2549 0.6519 0.0083  -0.0298 0.0136  840  ALA   A C   
2190 O  O   . ALA   A 150 ? 0.1278 0.2474 0.647  0.0083  -0.0348 0.0159  840  ALA   A O   
2191 C  CB  . ALA   A 150 ? 0.1288 0.2663 0.6576 0.006   -0.0335 0.0115  840  ALA   A CB  
2197 N  N   . ARG   A 151 ? 0.1235 0.2566 0.6488 0.0112  -0.0243 0.0124  841  ARG   A N   
2198 C  CA  . ARG   A 151 ? 0.1242 0.2614 0.6517 0.0164  -0.0232 0.014   841  ARG   A CA  
2199 C  C   . ARG   A 151 ? 0.1269 0.2618 0.661  0.0154  -0.0227 0.0159  841  ARG   A C   
2200 O  O   . ARG   A 151 ? 0.1284 0.2599 0.6591 0.02    -0.024  0.0177  841  ARG   A O   
2201 C  CB  . ARG   A 151 ? 0.1252 0.2893 0.6694 0.0204  -0.017  0.0128  841  ARG   A CB  
2202 C  CG  . ARG   A 151 ? 0.1338 0.3303 0.7132 0.0153  -0.0109 0.0115  841  ARG   A CG  
2203 C  CD  . ARG   A 151 ? 0.1415 0.3614 0.7313 0.0147  -0.0041 0.0106  841  ARG   A CD  
2204 N  NE  . ARG   A 151 ? 0.1383 0.3644 0.7381 0.0039  0.0011  0.0088  841  ARG   A NE  
2205 C  CZ  . ARG   A 151 ? 0.1212 0.3594 0.7302 -0.0019 0.0016  0.0057  841  ARG   A CZ  
2206 N  NH1 . ARG   A 151 ? 0.1129 0.3355 0.6982 0.0023  -0.0022 0.004   841  ARG   A NH1 
2207 N  NH2 . ARG   A 151 ? 0.1097 0.332  0.7078 -0.0111 0.0057  0.004   841  ARG   A NH2 
2221 N  N   . ASN   A 152 ? 0.1263 0.2605 0.6657 0.0107  -0.0208 0.0155  842  ASN   A N   
2222 C  CA  . ASN   A 152 ? 0.1283 0.2649 0.6758 0.0118  -0.0203 0.0172  842  ASN   A CA  
2223 C  C   . ASN   A 152 ? 0.1311 0.2759 0.6874 0.011   -0.0267 0.0185  842  ASN   A C   
2224 O  O   . ASN   A 152 ? 0.1287 0.2765 0.6894 0.0116  -0.0253 0.0191  842  ASN   A O   
2225 C  CB  . ASN   A 152 ? 0.1266 0.2671 0.6815 0.0097  -0.013  0.016   842  ASN   A CB  
2226 C  CG  . ASN   A 152 ? 0.1313 0.2992 0.71   0.0108  -0.0074 0.0155  842  ASN   A CG  
2227 O  OD1 . ASN   A 152 ? 0.1419 0.3088 0.7165 0.0159  -0.0075 0.0173  842  ASN   A OD1 
2228 N  ND2 . ASN   A 152 ? 0.1271 0.3047 0.7139 0.0046  -0.0021 0.0132  842  ASN   A ND2 
2235 N  N   . VAL   A 153 ? 0.1348 0.2849 0.6932 0.0098  -0.0337 0.0192  843  VAL   A N   
2236 C  CA  . VAL   A 153 ? 0.1371 0.3051 0.7099 0.0069  -0.0414 0.0213  843  VAL   A CA  
2237 C  C   . VAL   A 153 ? 0.1585 0.319  0.7222 0.0073  -0.0489 0.0228  843  VAL   A C   
2238 O  O   . VAL   A 153 ? 0.1697 0.3206 0.7241 0.0088  -0.05   0.0219  843  VAL   A O   
2239 C  CB  . VAL   A 153 ? 0.139  0.3129 0.7147 0.001   -0.0428 0.0208  843  VAL   A CB  
2240 C  CG1 . VAL   A 153 ? 0.1358 0.3272 0.7216 -0.0045 -0.0504 0.0236  843  VAL   A CG1 
2241 C  CG2 . VAL   A 153 ? 0.1385 0.3142 0.7177 0.0015  -0.0357 0.0187  843  VAL   A CG2 
2251 N  N   . LEU   A 154 ? 0.1702 0.329  0.7293 0.0071  -0.0535 0.0249  844  LEU   A N   
2252 C  CA  . LEU   A 154 ? 0.1956 0.3392 0.738  0.0067  -0.0608 0.0261  844  LEU   A CA  
2253 C  C   . LEU   A 154 ? 0.2066 0.354  0.7455 -0.0037 -0.0699 0.028   844  LEU   A C   
2254 O  O   . LEU   A 154 ? 0.1977 0.3645 0.7495 -0.0088 -0.0702 0.0291  844  LEU   A O   
2255 C  CB  . LEU   A 154 ? 0.2052 0.3436 0.7429 0.0137  -0.0597 0.027   844  LEU   A CB  
2256 C  CG  . LEU   A 154 ? 0.2265 0.3609 0.7659 0.0222  -0.0503 0.0259  844  LEU   A CG  
2257 C  CD1 . LEU   A 154 ? 0.2419 0.3728 0.7775 0.0284  -0.049  0.0273  844  LEU   A CD1 
2258 C  CD2 . LEU   A 154 ? 0.2383 0.3602 0.7667 0.0267  -0.0489 0.025   844  LEU   A CD2 
2270 N  N   . VAL   A 155 ? 0.2237 0.3522 0.7431 -0.0071 -0.0775 0.0285  845  VAL   A N   
2271 C  CA  . VAL   A 155 ? 0.2352 0.3629 0.7464 -0.0203 -0.0869 0.0305  845  VAL   A CA  
2272 C  C   . VAL   A 155 ? 0.2489 0.3725 0.7499 -0.0227 -0.0942 0.0319  845  VAL   A C   
2273 O  O   . VAL   A 155 ? 0.2593 0.3585 0.7399 -0.019  -0.0978 0.0312  845  VAL   A O   
2274 C  CB  . VAL   A 155 ? 0.2561 0.3597 0.7473 -0.0241 -0.0906 0.0298  845  VAL   A CB  
2275 C  CG1 . VAL   A 155 ? 0.2653 0.3661 0.7464 -0.041  -0.0998 0.0321  845  VAL   A CG1 
2276 C  CG2 . VAL   A 155 ? 0.2498 0.3585 0.7506 -0.0188 -0.0831 0.0279  845  VAL   A CG2 
2286 N  N   . LYS   A 156 ? 0.2448 0.394  0.7592 -0.0274 -0.0962 0.0338  846  LYS   A N   
2287 C  CA  . LYS   A 156 ? 0.2633 0.4147 0.7697 -0.0305 -0.1038 0.0351  846  LYS   A CA  
2288 C  C   . LYS   A 156 ? 0.2864 0.4247 0.7741 -0.0474 -0.1148 0.0363  846  LYS   A C   
2289 O  O   . LYS   A 156 ? 0.3043 0.42   0.7707 -0.0491 -0.1216 0.0359  846  LYS   A O   
2290 C  CB  . LYS   A 156 ? 0.271  0.4582 0.7969 -0.0294 -0.1027 0.037   846  LYS   A CB  
2291 C  CG  . LYS   A 156 ? 0.3143 0.509  0.8338 -0.0302 -0.1099 0.0381  846  LYS   A CG  
2292 C  CD  . LYS   A 156 ? 0.3471 0.5798 0.8845 -0.0262 -0.1084 0.0401  846  LYS   A CD  
2293 C  CE  . LYS   A 156 ? 0.3926 0.637  0.9241 -0.0256 -0.1157 0.0411  846  LYS   A CE  
2294 N  NZ  . LYS   A 156 ? 0.4257 0.6799 0.9501 -0.0461 -0.1277 0.043   846  LYS   A NZ  
2308 N  N   . THR   A 157 ? 0.2848 0.4364 0.779  -0.0605 -0.1165 0.038   847  THR   A N   
2309 C  CA  . THR   A 157 ? 0.3073 0.4448 0.7828 -0.0793 -0.1257 0.0396  847  THR   A CA  
2310 C  C   . THR   A 157 ? 0.3097 0.4434 0.7887 -0.0812 -0.1207 0.0395  847  THR   A C   
2311 O  O   . THR   A 157 ? 0.2983 0.4539 0.8004 -0.0724 -0.1121 0.039   847  THR   A O   
2312 C  CB  . THR   A 157 ? 0.3153 0.4846 0.7988 -0.0964 -0.1333 0.0431  847  THR   A CB  
2313 O  OG1 . THR   A 157 ? 0.3109 0.5179 0.8209 -0.0969 -0.1276 0.0451  847  THR   A OG1 
2314 C  CG2 . THR   A 157 ? 0.3147 0.497  0.7997 -0.092  -0.1373 0.0431  847  THR   A CG2 
2322 N  N   . PRO   A 158 ? 0.3237 0.4305 0.7798 -0.0925 -0.1258 0.04    848  PRO   A N   
2323 C  CA  . PRO   A 158 ? 0.3248 0.4308 0.7851 -0.093  -0.1207 0.0399  848  PRO   A CA  
2324 C  C   . PRO   A 158 ? 0.3038 0.4517 0.794  -0.0978 -0.1162 0.0422  848  PRO   A C   
2325 O  O   . PRO   A 158 ? 0.3015 0.4553 0.8034 -0.0905 -0.1089 0.041   848  PRO   A O   
2326 C  CB  . PRO   A 158 ? 0.3543 0.4269 0.7818 -0.1088 -0.1292 0.0413  848  PRO   A CB  
2327 C  CG  . PRO   A 158 ? 0.3777 0.4196 0.7784 -0.1074 -0.1362 0.0401  848  PRO   A CG  
2328 C  CD  . PRO   A 158 ? 0.3404 0.4124 0.762  -0.1045 -0.1364 0.0404  848  PRO   A CD  
2336 N  N   . GLN   A 159 ? 0.2849 0.4638 0.7873 -0.1083 -0.1204 0.0453  849  GLN   A N   
2337 C  CA  . GLN   A 159 ? 0.2638 0.4856 0.7926 -0.1113 -0.1167 0.048   849  GLN   A CA  
2338 C  C   . GLN   A 159 ? 0.243  0.4924 0.7957 -0.0934 -0.1095 0.0468  849  GLN   A C   
2339 O  O   . GLN   A 159 ? 0.2334 0.5182 0.8056 -0.093  -0.1065 0.0491  849  GLN   A O   
2340 C  CB  . GLN   A 159 ? 0.2736 0.5195 0.8015 -0.1329 -0.1254 0.0527  849  GLN   A CB  
2341 C  CG  . GLN   A 159 ? 0.3383 0.5557 0.8386 -0.1547 -0.1336 0.0546  849  GLN   A CG  
2342 C  CD  . GLN   A 159 ? 0.4219 0.597  0.8913 -0.1575 -0.1412 0.0525  849  GLN   A CD  
2343 O  OE1 . GLN   A 159 ? 0.4467 0.6252 0.917  -0.1508 -0.1437 0.0512  849  GLN   A OE1 
2344 N  NE2 . GLN   A 159 ? 0.4473 0.5795 0.8858 -0.1662 -0.1451 0.0521  849  GLN   A NE2 
2353 N  N   . HIS   A 160 ? 0.234  0.4673 0.7829 -0.0788 -0.1068 0.0437  850  HIS   A N   
2354 C  CA  . HIS   A 160 ? 0.2135 0.4667 0.7794 -0.0626 -0.1002 0.0428  850  HIS   A CA  
2355 C  C   . HIS   A 160 ? 0.2138 0.4421 0.7767 -0.047  -0.0926 0.0389  850  HIS   A C   
2356 O  O   . HIS   A 160 ? 0.2306 0.4333 0.7779 -0.0441 -0.0949 0.0374  850  HIS   A O   
2357 C  CB  . HIS   A 160 ? 0.2157 0.4833 0.7801 -0.0628 -0.106  0.0444  850  HIS   A CB  
2358 C  CG  . HIS   A 160 ? 0.2227 0.5157 0.8025 -0.0474 -0.1002 0.0445  850  HIS   A CG  
2359 N  ND1 . HIS   A 160 ? 0.2247 0.557  0.8155 -0.0495 -0.1031 0.0478  850  HIS   A ND1 
2360 C  CD2 . HIS   A 160 ? 0.2373 0.5204 0.8203 -0.0298 -0.0917 0.042   850  HIS   A CD2 
2361 C  CE1 . HIS   A 160 ? 0.2255 0.5677 0.8238 -0.031  -0.0964 0.047   850  HIS   A CE1 
2362 N  NE2 . HIS   A 160 ? 0.2367 0.548  0.8298 -0.02   -0.0894 0.0435  850  HIS   A NE2 
2370 N  N   . VAL   A 161 ? 0.1936 0.4309 0.7708 -0.0373 -0.0838 0.0374  851  VAL   A N   
2371 C  CA  . VAL   A 161 ? 0.1939 0.413  0.7703 -0.0249 -0.076  0.034   851  VAL   A CA  
2372 C  C   . VAL   A 161 ? 0.1781 0.408  0.7641 -0.0123 -0.0693 0.0334  851  VAL   A C   
2373 O  O   . VAL   A 161 ? 0.1698 0.4233 0.7654 -0.0106 -0.0689 0.0352  851  VAL   A O   
2374 C  CB  . VAL   A 161 ? 0.2051 0.417  0.784  -0.0258 -0.0716 0.0319  851  VAL   A CB  
2375 C  CG1 . VAL   A 161 ? 0.2229 0.416  0.7857 -0.0351 -0.0777 0.0323  851  VAL   A CG1 
2376 C  CG2 . VAL   A 161 ? 0.1964 0.4317 0.7915 -0.0266 -0.0678 0.0326  851  VAL   A CG2 
2386 N  N   . LYS   A 162 ? 0.1723 0.384  0.7529 -0.003  -0.0639 0.0311  852  LYS   A N   
2387 C  CA  . LYS   A 162 ? 0.1664 0.38   0.75   0.0084  -0.0573 0.0306  852  LYS   A CA  
2388 C  C   . LYS   A 162 ? 0.1603 0.3591 0.7439 0.013   -0.0487 0.0277  852  LYS   A C   
2389 O  O   . LYS   A 162 ? 0.1659 0.3499 0.7431 0.012   -0.0482 0.0265  852  LYS   A O   
2390 C  CB  . LYS   A 162 ? 0.1951 0.4011 0.7685 0.0141  -0.0599 0.0316  852  LYS   A CB  
2391 C  CG  . LYS   A 162 ? 0.2388 0.4651 0.8133 0.012   -0.0673 0.0343  852  LYS   A CG  
2392 C  CD  . LYS   A 162 ? 0.3036 0.519  0.8657 0.0154  -0.0717 0.0348  852  LYS   A CD  
2393 C  CE  . LYS   A 162 ? 0.3439 0.5822 0.907  0.0174  -0.0774 0.0371  852  LYS   A CE  
2394 N  NZ  . LYS   A 162 ? 0.3804 0.622  0.9423 0.0336  -0.0715 0.0373  852  LYS   A NZ  
2408 N  N   . ILE   A 163 ? 0.1454 0.348  0.7339 0.0187  -0.042  0.0268  853  ILE   A N   
2409 C  CA  . ILE   A 163 ? 0.1493 0.339  0.7368 0.0207  -0.0339 0.0242  853  ILE   A CA  
2410 C  C   . ILE   A 163 ? 0.1604 0.3338 0.737  0.0267  -0.0306 0.0245  853  ILE   A C   
2411 O  O   . ILE   A 163 ? 0.1666 0.3393 0.7374 0.0335  -0.0315 0.0262  853  ILE   A O   
2412 C  CB  . ILE   A 163 ? 0.1512 0.3461 0.743  0.0238  -0.0286 0.0231  853  ILE   A CB  
2413 C  CG1 . ILE   A 163 ? 0.1517 0.3643 0.7545 0.0184  -0.0317 0.0231  853  ILE   A CG1 
2414 C  CG2 . ILE   A 163 ? 0.1618 0.3415 0.75   0.0231  -0.0206 0.0203  853  ILE   A CG2 
2415 C  CD1 . ILE   A 163 ? 0.1615 0.3841 0.7666 0.0241  -0.0293 0.0234  853  ILE   A CD1 
2427 N  N   . THR   A 164 ? 0.1639 0.326  0.7373 0.025   -0.0266 0.0232  854  THR   A N   
2428 C  CA  . THR   A 164 ? 0.1805 0.3277 0.7433 0.0299  -0.0226 0.0239  854  THR   A CA  
2429 C  C   . THR   A 164 ? 0.1914 0.3312 0.7533 0.0273  -0.0134 0.0222  854  THR   A C   
2430 O  O   . THR   A 164 ? 0.1841 0.3301 0.7533 0.0222  -0.0109 0.0201  854  THR   A O   
2431 C  CB  . THR   A 164 ? 0.1938 0.3362 0.7503 0.0303  -0.0278 0.0248  854  THR   A CB  
2432 O  OG1 . THR   A 164 ? 0.2112 0.3407 0.7568 0.0366  -0.0248 0.0261  854  THR   A OG1 
2433 C  CG2 . THR   A 164 ? 0.1946 0.3382 0.7531 0.0265  -0.0266 0.0232  854  THR   A CG2 
2441 N  N   . ASP   A 165 ? 0.2067 0.3339 0.7588 0.03    -0.0086 0.0233  855  ASP   A N   
2442 C  CA  . ASP   A 165 ? 0.2185 0.3399 0.7681 0.0252  -0.0001 0.0225  855  ASP   A CA  
2443 C  C   . ASP   A 165 ? 0.2318 0.3448 0.7777 0.0225  0.0052  0.0213  855  ASP   A C   
2444 O  O   . ASP   A 165 ? 0.2305 0.3514 0.7844 0.0174  0.0051  0.019   855  ASP   A O   
2445 C  CB  . ASP   A 165 ? 0.2304 0.3658 0.7893 0.019   0.0001  0.0207  855  ASP   A CB  
2446 C  CG  . ASP   A 165 ? 0.2816 0.4175 0.8375 0.015   0.0075  0.0211  855  ASP   A CG  
2447 O  OD1 . ASP   A 165 ? 0.2863 0.4117 0.8356 0.0106  0.0143  0.0214  855  ASP   A OD1 
2448 O  OD2 . ASP   A 165 ? 0.3119 0.4582 0.8699 0.0163  0.0067  0.0213  855  ASP   A OD2 
2453 N  N   . PHE   A 166 ? 0.2455 0.3396 0.7765 0.0266  0.0099  0.0229  856  PHE   A N   
2454 C  CA  . PHE   A 166 ? 0.2657 0.3432 0.7852 0.0253  0.0154  0.022   856  PHE   A CA  
2455 C  C   . PHE   A 166 ? 0.2853 0.3471 0.7932 0.0168  0.024   0.0226  856  PHE   A C   
2456 O  O   . PHE   A 166 ? 0.3052 0.3423 0.7936 0.0184  0.0292  0.0235  856  PHE   A O   
2457 C  CB  . PHE   A 166 ? 0.2716 0.3384 0.7791 0.0386  0.0133  0.0236  856  PHE   A CB  
2458 C  CG  . PHE   A 166 ? 0.2669 0.3545 0.7871 0.0438  0.0053  0.0233  856  PHE   A CG  
2459 C  CD1 . PHE   A 166 ? 0.2667 0.3701 0.7965 0.0459  -0.0019 0.0246  856  PHE   A CD1 
2460 C  CD2 . PHE   A 166 ? 0.2747 0.366  0.7963 0.0453  0.005   0.0218  856  PHE   A CD2 
2461 C  CE1 . PHE   A 166 ? 0.2631 0.3866 0.804  0.0474  -0.0091 0.0248  856  PHE   A CE1 
2462 C  CE2 . PHE   A 166 ? 0.2728 0.3866 0.8069 0.0489  -0.0018 0.0222  856  PHE   A CE2 
2463 C  CZ  . PHE   A 166 ? 0.2569 0.3873 0.801  0.0488  -0.0088 0.0238  856  PHE   A CZ  
2473 N  N   . GLY   A 167 ? 0.278  0.355  0.7965 0.0076  0.0256  0.0221  857  GLY   A N   
2474 C  CA  . GLY   A 167 ? 0.2883 0.3594 0.7995 -0.0029 0.0335  0.023   857  GLY   A CA  
2475 C  C   . GLY   A 167 ? 0.2965 0.3594 0.8026 -0.0158 0.0382  0.0205  857  GLY   A C   
2476 O  O   . GLY   A 167 ? 0.3127 0.3563 0.8023 -0.0242 0.0451  0.0216  857  GLY   A O   
2480 N  N   . LEU   A 168 ? 0.2855 0.3618 0.8041 -0.0183 0.0342  0.0171  858  LEU   A N   
2481 C  CA  . LEU   A 168 ? 0.2977 0.3662 0.8113 -0.0297 0.0371  0.014   858  LEU   A CA  
2482 C  C   . LEU   A 168 ? 0.3186 0.3671 0.8205 -0.021  0.0349  0.0127  858  LEU   A C   
2483 O  O   . LEU   A 168 ? 0.3222 0.3601 0.8165 -0.0284 0.0366  0.0099  858  LEU   A O   
2484 C  CB  . LEU   A 168 ? 0.2853 0.3839 0.8198 -0.0375 0.0344  0.0108  858  LEU   A CB  
2485 C  CG  . LEU   A 168 ? 0.2917 0.4155 0.8375 -0.0453 0.0368  0.0116  858  LEU   A CG  
2486 C  CD1 . LEU   A 168 ? 0.2813 0.4346 0.8464 -0.0468 0.0326  0.0086  858  LEU   A CD1 
2487 C  CD2 . LEU   A 168 ? 0.3052 0.4224 0.8403 -0.0621 0.0444  0.0119  858  LEU   A CD2 
2499 N  N   . ALA   A 169 ? 0.331  0.3758 0.8304 -0.0052 0.031   0.0147  859  ALA   A N   
2500 C  CA  . ALA   A 169 ? 0.3581 0.3901 0.847  0.0058  0.0289  0.014   859  ALA   A CA  
2501 C  C   . ALA   A 169 ? 0.4042 0.3973 0.8614 0.0072  0.035   0.0144  859  ALA   A C   
2502 O  O   . ALA   A 169 ? 0.4181 0.3936 0.8609 0.0056  0.0396  0.0168  859  ALA   A O   
2503 C  CB  . ALA   A 169 ? 0.3517 0.3962 0.8475 0.021   0.0229  0.0164  859  ALA   A CB  
2509 N  N   . LYS   A 170 ? 0.4258 0.4034 0.8696 0.0106  0.0351  0.0122  860  LYS   A N   
2510 C  CA  . LYS   A 170 ? 0.4691 0.4039 0.8771 0.0128  0.0405  0.0122  860  LYS   A CA  
2511 C  C   . LYS   A 170 ? 0.4968 0.4208 0.8898 0.0325  0.0381  0.012   860  LYS   A C   
2512 O  O   . LYS   A 170 ? 0.4894 0.4326 0.8961 0.036   0.0339  0.0101  860  LYS   A O   
2513 C  CB  . LYS   A 170 ? 0.4984 0.4158 0.8953 -0.007  0.0447  0.009   860  LYS   A CB  
2514 C  CG  . LYS   A 170 ? 0.5388 0.4725 0.9507 -0.0278 0.0476  0.0091  860  LYS   A CG  
2515 C  CD  . LYS   A 170 ? 0.6031 0.5159 0.9973 -0.0327 0.0537  0.0127  860  LYS   A CD  
2516 C  CE  . LYS   A 170 ? 0.628  0.5714 1.045  -0.0464 0.0552  0.0141  860  LYS   A CE  
2517 N  NZ  . LYS   A 170 ? 0.6645 0.5922 1.0668 -0.0482 0.061   0.0183  860  LYS   A NZ  
2531 N  N   . LEU   A 171 ? 0.5262 0.42   0.8897 0.0466  0.0409  0.0143  861  LEU   A N   
2532 C  CA  . LEU   A 171 ? 0.5518 0.4339 0.8956 0.0683  0.0394  0.0145  861  LEU   A CA  
2533 C  C   . LEU   A 171 ? 0.589  0.4323 0.9021 0.0633  0.0433  0.0114  861  LEU   A C   
2534 O  O   . LEU   A 171 ? 0.6122 0.4195 0.901  0.0501  0.0489  0.011   861  LEU   A O   
2535 C  CB  . LEU   A 171 ? 0.5721 0.4348 0.8921 0.0869  0.0412  0.0179  861  LEU   A CB  
2536 C  CG  . LEU   A 171 ? 0.5771 0.4745 0.9215 0.0952  0.0365  0.0209  861  LEU   A CG  
2537 C  CD1 . LEU   A 171 ? 0.6018 0.4731 0.9207 0.106   0.0401  0.0239  861  LEU   A CD1 
2538 C  CD2 . LEU   A 171 ? 0.5724 0.5043 0.9322 0.1124  0.0298  0.0216  861  LEU   A CD2 
2550 N  N   . LEU   A 172 ? 0.5959 0.4453 0.9081 0.0729  0.0403  0.0094  862  LEU   A N   
2551 C  CA  . LEU   A 172 ? 0.6386 0.4486 0.9183 0.0701  0.0431  0.0061  862  LEU   A CA  
2552 C  C   . LEU   A 172 ? 0.6895 0.4564 0.9229 0.0928  0.0461  0.0076  862  LEU   A C   
2553 O  O   . LEU   A 172 ? 0.6846 0.4682 0.9195 0.1164  0.0438  0.0104  862  LEU   A O   
2554 C  CB  . LEU   A 172 ? 0.626  0.46   0.9224 0.0727  0.0387  0.0033  862  LEU   A CB  
2555 C  CG  . LEU   A 172 ? 0.6128 0.4881 0.9516 0.0533  0.0354  0.0013  862  LEU   A CG  
2556 C  CD1 . LEU   A 172 ? 0.6047 0.5068 0.9595 0.0621  0.0308  -0.0002 862  LEU   A CD1 
2557 C  CD2 . LEU   A 172 ? 0.6263 0.4824 0.9589 0.027   0.0386  -0.002  862  LEU   A CD2 
2569 N  N   . GLY   A 173 ? 0.7363 0.4483 0.9269 0.0859  0.051   0.0057  863  GLY   A N   
2570 C  CA  . GLY   A 173 ? 0.7896 0.452  0.9282 0.1083  0.0541  0.0067  863  GLY   A CA  
2571 C  C   . GLY   A 173 ? 0.8088 0.4782 0.9382 0.134   0.0507  0.0058  863  GLY   A C   
2572 O  O   . GLY   A 173 ? 0.7896 0.4914 0.9468 0.129   0.0467  0.0036  863  GLY   A O   
2576 N  N   . ALA   A 174 ? 0.8439 0.484  0.9331 0.1629  0.0524  0.0077  864  ALA   A N   
2577 C  CA  . ALA   A 174 ? 0.8627 0.5104 0.9387 0.1919  0.0497  0.0076  864  ALA   A CA  
2578 C  C   . ALA   A 174 ? 0.8864 0.5154 0.9496 0.1845  0.0489  0.0031  864  ALA   A C   
2579 O  O   . ALA   A 174 ? 0.8679 0.5345 0.9526 0.1957  0.0449  0.0027  864  ALA   A O   
2580 C  CB  . ALA   A 174 ? 0.899  0.5034 0.921  0.2228  0.053   0.0098  864  ALA   A CB  
2586 N  N   . GLU   A 175 ? 0.9243 0.4964 0.9525 0.1646  0.0526  -0.0001 865  GLU   A N   
2587 C  CA  . GLU   A 175 ? 0.951  0.4984 0.9615 0.1552  0.0516  -0.0049 865  GLU   A CA  
2588 C  C   . GLU   A 175 ? 0.9284 0.514  0.9871 0.1225  0.0488  -0.0079 865  GLU   A C   
2589 O  O   . GLU   A 175 ? 0.9287 0.52   0.9917 0.1192  0.046   -0.0115 865  GLU   A O   
2590 C  CB  . GLU   A 175 ? 1.0335 0.4969 0.9774 0.148   0.0563  -0.0072 865  GLU   A CB  
2591 C  CG  . GLU   A 175 ? 1.1335 0.5464 1.0178 0.1818  0.0594  -0.005  865  GLU   A CG  
2592 C  CD  . GLU   A 175 ? 1.2413 0.629  1.087  0.2097  0.0578  -0.007  865  GLU   A CD  
2593 O  OE1 . GLU   A 175 ? 1.3084 0.6234 1.0858 0.2231  0.061   -0.0078 865  GLU   A OE1 
2594 O  OE2 . GLU   A 175 ? 1.2387 0.6772 1.1197 0.2188  0.0534  -0.0077 865  GLU   A OE2 
2601 N  N   . GLU   A 176 ? 0.9074 0.5181 0.9998 0.0999  0.0497  -0.0064 866  GLU   A N   
2602 C  CA  . GLU   A 176 ? 0.8864 0.5329 1.0218 0.0699  0.0476  -0.0089 866  GLU   A CA  
2603 C  C   . GLU   A 176 ? 0.8438 0.556  1.0313 0.0757  0.0421  -0.0087 866  GLU   A C   
2604 O  O   . GLU   A 176 ? 0.8268 0.5754 1.0379 0.0922  0.0402  -0.0049 866  GLU   A O   
2605 C  CB  . GLU   A 176 ? 0.9116 0.5674 1.0651 0.0487  0.0506  -0.0066 866  GLU   A CB  
2606 C  CG  . GLU   A 176 ? 1.0109 0.6065 1.1191 0.0322  0.0564  -0.0069 866  GLU   A CG  
2607 C  CD  . GLU   A 176 ? 1.0846 0.6905 1.2085 0.0148  0.06    -0.0037 866  GLU   A CD  
2608 O  OE1 . GLU   A 176 ? 1.0712 0.7287 1.2391 0.0184  0.0578  -0.0012 866  GLU   A OE1 
2609 O  OE2 . GLU   A 176 ? 1.14   0.701  1.2299 -0.0027 0.0652  -0.0035 866  GLU   A OE2 
2616 N  N   . LYS   A 177 ? 0.8241 0.5517 1.0296 0.0597  0.0395  -0.0128 867  LYS   A N   
2617 C  CA  . LYS   A 177 ? 0.7866 0.5727 1.0396 0.061   0.0346  -0.0129 867  LYS   A CA  
2618 C  C   . LYS   A 177 ? 0.7556 0.5771 1.0498 0.0341  0.0335  -0.0139 867  LYS   A C   
2619 O  O   . LYS   A 177 ? 0.7304 0.5982 1.063  0.0335  0.0296  -0.0138 867  LYS   A O   
2620 C  CB  . LYS   A 177 ? 0.8159 0.5953 1.0581 0.0661  0.0321  -0.0169 867  LYS   A CB  
2621 C  CG  . LYS   A 177 ? 0.8743 0.6557 1.1013 0.0987  0.0309  -0.0147 867  LYS   A CG  
2622 C  CD  . LYS   A 177 ? 0.9286 0.7199 1.159  0.1023  0.0279  -0.018  867  LYS   A CD  
2623 C  CE  . LYS   A 177 ? 0.9811 0.7765 1.1949 0.1354  0.0271  -0.0156 867  LYS   A CE  
2624 N  NZ  . LYS   A 177 ? 1.0048 0.8095 1.2208 0.1394  0.0245  -0.0185 867  LYS   A NZ  
2638 N  N   . GLU   A 178 ? 0.7556 0.5562 1.0404 0.0125  0.0371  -0.0145 868  GLU   A N   
2639 C  CA  . GLU   A 178 ? 0.7296 0.5643 1.0498 -0.011  0.0366  -0.0153 868  GLU   A CA  
2640 C  C   . GLU   A 178 ? 0.7328 0.5509 1.0436 -0.0266 0.0414  -0.0132 868  GLU   A C   
2641 O  O   . GLU   A 178 ? 0.7657 0.5357 1.0361 -0.0261 0.0456  -0.0125 868  GLU   A O   
2642 C  CB  . GLU   A 178 ? 0.7542 0.5911 1.0777 -0.029  0.0348  -0.0208 868  GLU   A CB  
2643 C  CG  . GLU   A 178 ? 0.8405 0.6246 1.1208 -0.0443 0.0378  -0.0242 868  GLU   A CG  
2644 C  CD  . GLU   A 178 ? 0.916  0.6978 1.1931 -0.0565 0.0347  -0.03   868  GLU   A CD  
2645 O  OE1 . GLU   A 178 ? 0.9001 0.7219 1.209  -0.0509 0.0305  -0.0314 868  GLU   A OE1 
2646 O  OE2 . GLU   A 178 ? 0.9752 0.7134 1.2161 -0.0723 0.0365  -0.0332 868  GLU   A OE2 
2653 N  N   . TYR   A 179 ? 0.6984 0.5553 1.0443 -0.0393 0.041   -0.012  869  TYR   A N   
2654 C  CA  . TYR   A 179 ? 0.6991 0.5496 1.0419 -0.0544 0.0457  -0.0095 869  TYR   A CA  
2655 C  C   . TYR   A 179 ? 0.6844 0.55   1.0391 -0.0825 0.0466  -0.0125 869  TYR   A C   
2656 O  O   . TYR   A 179 ? 0.6596 0.567  1.0475 -0.0864 0.0429  -0.0144 869  TYR   A O   
2657 C  CB  . TYR   A 179 ? 0.6786 0.5634 1.0501 -0.0441 0.0446  -0.0052 869  TYR   A CB  
2658 C  CG  . TYR   A 179 ? 0.6898 0.5741 1.0617 -0.0583 0.0494  -0.0024 869  TYR   A CG  
2659 C  CD1 . TYR   A 179 ? 0.7283 0.5716 1.0665 -0.0575 0.0547  0.0004  869  TYR   A CD1 
2660 C  CD2 . TYR   A 179 ? 0.6769 0.6018 1.0808 -0.0711 0.0488  -0.0021 869  TYR   A CD2 
2661 C  CE1 . TYR   A 179 ? 0.7395 0.5832 1.0774 -0.0707 0.0596  0.0035  869  TYR   A CE1 
2662 C  CE2 . TYR   A 179 ? 0.6879 0.6154 1.0918 -0.083  0.0535  0.0009  869  TYR   A CE2 
2663 C  CZ  . TYR   A 179 ? 0.7245 0.612  1.0963 -0.0835 0.059   0.0038  869  TYR   A CZ  
2664 O  OH  . TYR   A 179 ? 0.7435 0.6343 1.1148 -0.0951 0.0641  0.0073  869  TYR   A OH  
2674 N  N   . HIS   A 180 ? 0.6981 0.5307 1.0247 -0.1022 0.0516  -0.0127 870  HIS   A N   
2675 C  CA  . HIS   A 180 ? 0.6892 0.5378 1.0246 -0.1314 0.053   -0.015  870  HIS   A CA  
2676 C  C   . HIS   A 180 ? 0.6664 0.5373 1.0172 -0.1407 0.0572  -0.0105 870  HIS   A C   
2677 O  O   . HIS   A 180 ? 0.6865 0.525  1.0114 -0.1435 0.0624  -0.0071 870  HIS   A O   
2678 C  CB  . HIS   A 180 ? 0.7366 0.5343 1.0286 -0.1501 0.0555  -0.018  870  HIS   A CB  
2679 C  CG  . HIS   A 180 ? 0.7834 0.566  1.0634 -0.1456 0.0509  -0.0233 870  HIS   A CG  
2680 N  ND1 . HIS   A 180 ? 0.8015 0.5955 1.0933 -0.1186 0.0466  -0.0238 870  HIS   A ND1 
2681 C  CD2 . HIS   A 180 ? 0.8164 0.5745 1.0731 -0.1654 0.0501  -0.0281 870  HIS   A CD2 
2682 C  CE1 . HIS   A 180 ? 0.8192 0.5958 1.0952 -0.1212 0.0435  -0.0288 870  HIS   A CE1 
2683 N  NE2 . HIS   A 180 ? 0.8339 0.5865 1.0873 -0.1488 0.0452  -0.0318 870  HIS   A NE2 
2691 N  N   . ALA   A 181 ? 0.6238 0.5486 1.0147 -0.1432 0.0549  -0.0104 871  ALA   A N   
2692 C  CA  . ALA   A 181 ? 0.6062 0.5585 1.0148 -0.1478 0.0582  -0.0061 871  ALA   A CA  
2693 C  C   . ALA   A 181 ? 0.5992 0.5579 1.0023 -0.1773 0.0633  -0.0057 871  ALA   A C   
2694 O  O   . ALA   A 181 ? 0.6004 0.5548 0.9952 -0.1966 0.0628  -0.0096 871  ALA   A O   
2695 C  CB  . ALA   A 181 ? 0.5782 0.5828 1.0274 -0.1361 0.0535  -0.0062 871  ALA   A CB  
2701 N  N   . GLU   A 182 ? 0.5902 0.5607 0.9978 -0.1809 0.0682  -0.0006 872  GLU   A N   
2702 C  CA  . GLU   A 182 ? 0.5891 0.5762 0.9964 -0.2077 0.0737  0.0013  872  GLU   A CA  
2703 C  C   . GLU   A 182 ? 0.5473 0.6008 0.9955 -0.21   0.071   0.0003  872  GLU   A C   
2704 O  O   . GLU   A 182 ? 0.5383 0.6155 1.0098 -0.1913 0.0653  -0.0017 872  GLU   A O   
2705 C  CB  . GLU   A 182 ? 0.635  0.6038 1.0267 -0.2069 0.0805  0.0077  872  GLU   A CB  
2706 C  CG  . GLU   A 182 ? 0.7437 0.6462 1.0892 -0.2107 0.0846  0.0089  872  GLU   A CG  
2707 C  CD  . GLU   A 182 ? 0.8539 0.7317 1.1711 -0.2439 0.0891  0.0081  872  GLU   A CD  
2708 O  OE1 . GLU   A 182 ? 0.8513 0.7585 1.1782 -0.2661 0.0936  0.0109  872  GLU   A OE1 
2709 O  OE2 . GLU   A 182 ? 0.9174 0.7457 1.2008 -0.2477 0.0881  0.0049  872  GLU   A OE2 
2716 N  N   . GLY   A 183 ? 0.5228 0.6062 0.9779 -0.2319 0.0754  0.0021  873  GLY   A N   
2717 C  CA  . GLY   A 183 ? 0.4819 0.6288 0.9719 -0.2327 0.0735  0.0015  873  GLY   A CA  
2718 C  C   . GLY   A 183 ? 0.4506 0.6284 0.9626 -0.2103 0.0732  0.0055  873  GLY   A C   
2719 O  O   . GLY   A 183 ? 0.4291 0.6571 0.9631 -0.2127 0.0739  0.0065  873  GLY   A O   
2723 N  N   . GLY   A 184 ? 0.446  0.5954 0.9512 -0.1881 0.072   0.0076  874  GLY   A N   
2724 C  CA  . GLY   A 184 ? 0.4233 0.5955 0.9455 -0.1667 0.0708  0.011   874  GLY   A CA  
2725 C  C   . GLY   A 184 ? 0.388  0.5935 0.9357 -0.1513 0.0637  0.0078  874  GLY   A C   
2726 O  O   . GLY   A 184 ? 0.3937 0.5952 0.9443 -0.1517 0.0591  0.003   874  GLY   A O   
2730 N  N   . LYS   A 185 ? 0.3514 0.5871 0.9147 -0.1368 0.0628  0.0104  875  LYS   A N   
2731 C  CA  . LYS   A 185 ? 0.3198 0.5851 0.9034 -0.1214 0.0564  0.0079  875  LYS   A CA  
2732 C  C   . LYS   A 185 ? 0.3036 0.5429 0.886  -0.1056 0.0498  0.0056  875  LYS   A C   
2733 O  O   . LYS   A 185 ? 0.317  0.5263 0.888  -0.0959 0.0495  0.008   875  LYS   A O   
2734 C  CB  . LYS   A 185 ? 0.3352 0.6285 0.9281 -0.1069 0.0568  0.0117  875  LYS   A CB  
2735 C  CG  . LYS   A 185 ? 0.3825 0.7184 0.9832 -0.1185 0.0622  0.0135  875  LYS   A CG  
2736 C  CD  . LYS   A 185 ? 0.4364 0.793  1.0399 -0.1025 0.0639  0.0183  875  LYS   A CD  
2737 C  CE  . LYS   A 185 ? 0.4809 0.8575 1.095  -0.0806 0.0574  0.0166  875  LYS   A CE  
2738 N  NZ  . LYS   A 185 ? 0.5073 0.9091 1.1218 -0.0657 0.0594  0.0208  875  LYS   A NZ  
2752 N  N   . VAL   A 186 ? 0.2708 0.5253 0.8654 -0.1027 0.0445  0.0013  876  VAL   A N   
2753 C  CA  . VAL   A 186 ? 0.2587 0.4949 0.854  -0.0898 0.0384  -0.0007 876  VAL   A CA  
2754 C  C   . VAL   A 186 ? 0.2168 0.482  0.8293 -0.0793 0.0327  -0.0031 876  VAL   A C   
2755 O  O   . VAL   A 186 ? 0.1972 0.4946 0.8195 -0.0846 0.0334  -0.0047 876  VAL   A O   
2756 C  CB  . VAL   A 186 ? 0.2821 0.4906 0.8654 -0.0997 0.0385  -0.004  876  VAL   A CB  
2757 C  CG1 . VAL   A 186 ? 0.3083 0.4764 0.8692 -0.1005 0.0422  -0.0014 876  VAL   A CG1 
2758 C  CG2 . VAL   A 186 ? 0.2847 0.5088 0.8695 -0.1198 0.0407  -0.0076 876  VAL   A CG2 
2768 N  N   . PRO   A 187 ? 0.1994 0.4542 0.814  -0.0645 0.027   -0.003  877  PRO   A N   
2769 C  CA  . PRO   A 187 ? 0.1758 0.453  0.8022 -0.0548 0.0218  -0.0048 877  PRO   A CA  
2770 C  C   . PRO   A 187 ? 0.153  0.4387 0.7862 -0.0598 0.0193  -0.0094 877  PRO   A C   
2771 O  O   . PRO   A 187 ? 0.1547 0.4264 0.7876 -0.0541 0.0154  -0.0103 877  PRO   A O   
2772 C  CB  . PRO   A 187 ? 0.1941 0.4539 0.817  -0.0403 0.017   -0.0022 877  PRO   A CB  
2773 C  CG  . PRO   A 187 ? 0.2157 0.4461 0.8289 -0.0428 0.0182  -0.0012 877  PRO   A CG  
2774 C  CD  . PRO   A 187 ? 0.2049 0.4288 0.81   -0.056  0.025   -0.0011 877  PRO   A CD  
2782 N  N   . ILE   A 188 ? 0.1247 0.4373 0.7647 -0.0695 0.0213  -0.0122 878  ILE   A N   
2783 C  CA  . ILE   A 188 ? 0.1138 0.4371 0.7596 -0.0758 0.0192  -0.0172 878  ILE   A CA  
2784 C  C   . ILE   A 188 ? 0.0966 0.4167 0.7437 -0.0615 0.0132  -0.0185 878  ILE   A C   
2785 O  O   . ILE   A 188 ? 0.1027 0.4095 0.7484 -0.063  0.0111  -0.0209 878  ILE   A O   
2786 C  CB  . ILE   A 188 ? 0.1127 0.4739 0.7667 -0.0863 0.0215  -0.0195 878  ILE   A CB  
2787 C  CG1 . ILE   A 188 ? 0.134  0.4955 0.7817 -0.1054 0.0277  -0.0184 878  ILE   A CG1 
2788 C  CG2 . ILE   A 188 ? 0.1143 0.4899 0.7749 -0.0906 0.0183  -0.025  878  ILE   A CG2 
2789 C  CD1 . ILE   A 188 ? 0.1696 0.4975 0.8032 -0.1224 0.0296  -0.0203 878  ILE   A CD1 
2801 N  N   . LYS   A 189 ? 0.0884 0.4054 0.7219 -0.0459 0.0104  -0.0168 879  LYS   A N   
2802 C  CA  . LYS   A 189 ? 0.0929 0.395  0.714  -0.0332 0.0051  -0.0176 879  LYS   A CA  
2803 C  C   . LYS   A 189 ? 0.106  0.3766 0.7194 -0.0285 0.0021  -0.0156 879  LYS   A C   
2804 O  O   . LYS   A 189 ? 0.1097 0.3725 0.7181 -0.0226 -0.0016 -0.0162 879  LYS   A O   
2805 C  CB  . LYS   A 189 ? 0.0916 0.4115 0.7141 -0.0214 0.0033  -0.0159 879  LYS   A CB  
2806 C  CG  . LYS   A 189 ? 0.0813 0.4547 0.7271 -0.0237 0.0055  -0.0184 879  LYS   A CG  
2807 C  CD  . LYS   A 189 ? 0.0885 0.4907 0.7436 -0.0081 0.0042  -0.0166 879  LYS   A CD  
2808 C  CE  . LYS   A 189 ? 0.0953 0.5389 0.7567 -0.0082 0.0067  -0.0188 879  LYS   A CE  
2809 N  NZ  . LYS   A 189 ? 0.1    0.5581 0.7528 0.0119  0.0048  -0.0177 879  LYS   A NZ  
2823 N  N   . TRP   A 190 ? 0.1095 0.3628 0.72   -0.031  0.004   -0.013  880  TRP   A N   
2824 C  CA  . TRP   A 190 ? 0.121  0.3549 0.73   -0.0273 0.0016  -0.011  880  TRP   A CA  
2825 C  C   . TRP   A 190 ? 0.1204 0.352  0.7374 -0.0355 0.004   -0.0129 880  TRP   A C   
2826 O  O   . TRP   A 190 ? 0.1272 0.3478 0.743  -0.0314 0.002   -0.012  880  TRP   A O   
2827 C  CB  . TRP   A 190 ? 0.1254 0.3493 0.7316 -0.0226 0.0013  -0.0066 880  TRP   A CB  
2828 C  CG  . TRP   A 190 ? 0.1336 0.3599 0.7371 -0.0141 -0.0029 -0.0044 880  TRP   A CG  
2829 C  CD1 . TRP   A 190 ? 0.1446 0.369  0.7526 -0.0093 -0.0081 -0.0023 880  TRP   A CD1 
2830 C  CD2 . TRP   A 190 ? 0.1293 0.3712 0.7339 -0.0101 -0.0026 -0.0041 880  TRP   A CD2 
2831 N  NE1 . TRP   A 190 ? 0.1476 0.3774 0.7539 -0.0031 -0.0113 -0.001  880  TRP   A NE1 
2832 C  CE2 . TRP   A 190 ? 0.1409 0.3825 0.7459 -0.0019 -0.0079 -0.0021 880  TRP   A CE2 
2833 C  CE3 . TRP   A 190 ? 0.1228 0.3886 0.7358 -0.0129 0.0017  -0.0049 880  TRP   A CE3 
2834 C  CZ2 . TRP   A 190 ? 0.1414 0.3997 0.7501 0.0065  -0.0093 -0.0012 880  TRP   A CZ2 
2835 C  CZ3 . TRP   A 190 ? 0.1235 0.4134 0.7447 -0.0042 0.0008  -0.0039 880  TRP   A CZ3 
2836 C  CH2 . TRP   A 190 ? 0.1322 0.4122 0.7459 0.0068  -0.0047 -0.0022 880  TRP   A CH2 
2847 N  N   . MET   A 191 ? 0.1128 0.3531 0.7342 -0.0475 0.0083  -0.0153 881  MET   A N   
2848 C  CA  . MET   A 191 ? 0.1157 0.3489 0.74   -0.058  0.0109  -0.0173 881  MET   A CA  
2849 C  C   . MET   A 191 ? 0.1149 0.35   0.7409 -0.0599 0.0088  -0.0214 881  MET   A C   
2850 O  O   . MET   A 191 ? 0.1072 0.3597 0.7382 -0.0601 0.0069  -0.0241 881  MET   A O   
2851 C  CB  . MET   A 191 ? 0.1224 0.3556 0.7405 -0.0729 0.0161  -0.0184 881  MET   A CB  
2852 C  CG  . MET   A 191 ? 0.1606 0.3787 0.7692 -0.073  0.0198  -0.0143 881  MET   A CG  
2853 S  SD  . MET   A 191 ? 0.2164 0.4509 0.8248 -0.0889 0.0254  -0.014  881  MET   A SD  
2854 C  CE  . MET   A 191 ? 0.2103 0.4313 0.8066 -0.1084 0.0277  -0.0185 881  MET   A CE  
2864 N  N   . ALA   A 192 ? 0.1283 0.3387 0.7413 -0.0599 0.0095  -0.0221 882  ALA   A N   
2865 C  CA  . ALA   A 192 ? 0.1368 0.3441 0.747  -0.0618 0.008   -0.0261 882  ALA   A CA  
2866 C  C   . ALA   A 192 ? 0.1479 0.3594 0.7543 -0.0786 0.0101  -0.0308 882  ALA   A C   
2867 O  O   . ALA   A 192 ? 0.1511 0.3601 0.7522 -0.0895 0.0136  -0.0302 882  ALA   A O   
2868 C  CB  . ALA   A 192 ? 0.1465 0.3245 0.7398 -0.0551 0.0086  -0.0252 882  ALA   A CB  
2874 N  N   . LEU   A 193 ? 0.1525 0.3716 0.7612 -0.0815 0.0077  -0.0353 883  LEU   A N   
2875 C  CA  . LEU   A 193 ? 0.1662 0.3924 0.7716 -0.0987 0.0086  -0.0402 883  LEU   A CA  
2876 C  C   . LEU   A 193 ? 0.1983 0.391  0.7797 -0.1125 0.0122  -0.0411 883  LEU   A C   
2877 O  O   . LEU   A 193 ? 0.2015 0.4021 0.7809 -0.1297 0.0146  -0.0423 883  LEU   A O   
2878 C  CB  . LEU   A 193 ? 0.1658 0.403  0.7758 -0.0977 0.0049  -0.0451 883  LEU   A CB  
2879 C  CG  . LEU   A 193 ? 0.1879 0.4346 0.7944 -0.1163 0.0046  -0.0509 883  LEU   A CG  
2880 C  CD1 . LEU   A 193 ? 0.1729 0.4586 0.7958 -0.1245 0.0054  -0.0511 883  LEU   A CD1 
2881 C  CD2 . LEU   A 193 ? 0.2007 0.4516 0.8082 -0.1126 0.0006  -0.0556 883  LEU   A CD2 
2893 N  N   . GLU   A 194 ? 0.2214 0.3774 0.7827 -0.1049 0.0127  -0.0401 884  GLU   A N   
2894 C  CA  . GLU   A 194 ? 0.2506 0.3677 0.7828 -0.1164 0.0162  -0.0407 884  GLU   A CA  
2895 C  C   . GLU   A 194 ? 0.2648 0.3773 0.7937 -0.1226 0.0207  -0.0365 884  GLU   A C   
2896 O  O   . GLU   A 194 ? 0.2833 0.3756 0.7931 -0.1397 0.024   -0.0373 884  GLU   A O   
2897 C  CB  . GLU   A 194 ? 0.2857 0.3636 0.7932 -0.1034 0.0158  -0.0407 884  GLU   A CB  
2898 C  CG  . GLU   A 194 ? 0.3195 0.3911 0.8282 -0.0825 0.0162  -0.0352 884  GLU   A CG  
2899 C  CD  . GLU   A 194 ? 0.3337 0.4357 0.8672 -0.0665 0.0124  -0.0333 884  GLU   A CD  
2900 O  OE1 . GLU   A 194 ? 0.3359 0.4357 0.8706 -0.0513 0.0122  -0.0289 884  GLU   A OE1 
2901 O  OE2 . GLU   A 194 ? 0.3279 0.4554 0.8781 -0.0695 0.0096  -0.0363 884  GLU   A OE2 
2908 N  N   . SER   A 195 ? 0.2532 0.3836 0.799  -0.1097 0.0207  -0.0319 885  SER   A N   
2909 C  CA  . SER   A 195 ? 0.2572 0.3871 0.8018 -0.114  0.0248  -0.0277 885  SER   A CA  
2910 C  C   . SER   A 195 ? 0.2447 0.4075 0.803  -0.131  0.0265  -0.0288 885  SER   A C   
2911 O  O   . SER   A 195 ? 0.2462 0.4036 0.7961 -0.1429 0.031   -0.0266 885  SER   A O   
2912 C  CB  . SER   A 195 ? 0.2615 0.4015 0.8192 -0.0954 0.0234  -0.023  885  SER   A CB  
2913 O  OG  . SER   A 195 ? 0.2989 0.4176 0.8471 -0.0797 0.0215  -0.0219 885  SER   A OG  
2919 N  N   . ILE   A 196 ? 0.2291 0.4272 0.8074 -0.1314 0.023   -0.0319 886  ILE   A N   
2920 C  CA  . ILE   A 196 ? 0.222  0.4577 0.8139 -0.145  0.0243  -0.033  886  ILE   A CA  
2921 C  C   . ILE   A 196 ? 0.2415 0.469  0.8189 -0.1697 0.026   -0.0369 886  ILE   A C   
2922 O  O   . ILE   A 196 ? 0.244  0.4835 0.8198 -0.1865 0.0299  -0.0355 886  ILE   A O   
2923 C  CB  . ILE   A 196 ? 0.2023 0.478  0.8176 -0.1348 0.0199  -0.0351 886  ILE   A CB  
2924 C  CG1 . ILE   A 196 ? 0.2019 0.4834 0.828  -0.113  0.0181  -0.0309 886  ILE   A CG1 
2925 C  CG2 . ILE   A 196 ? 0.1858 0.5041 0.8134 -0.1481 0.0212  -0.0367 886  ILE   A CG2 
2926 C  CD1 . ILE   A 196 ? 0.1981 0.5038 0.8395 -0.0997 0.0131  -0.0326 886  ILE   A CD1 
2938 N  N   . LEU   A 197 ? 0.2548 0.4619 0.8205 -0.1727 0.023   -0.0415 887  LEU   A N   
2939 C  CA  . LEU   A 197 ? 0.2758 0.4725 0.825  -0.1971 0.0234  -0.046  887  LEU   A CA  
2940 C  C   . LEU   A 197 ? 0.3119 0.4579 0.8275 -0.2096 0.0276  -0.0444 887  LEU   A C   
2941 O  O   . LEU   A 197 ? 0.3203 0.466  0.8254 -0.234  0.0306  -0.0448 887  LEU   A O   
2942 C  CB  . LEU   A 197 ? 0.2836 0.4743 0.8296 -0.1943 0.0182  -0.0519 887  LEU   A CB  
2943 C  CG  . LEU   A 197 ? 0.2738 0.5082 0.8476 -0.1825 0.0137  -0.0543 887  LEU   A CG  
2944 C  CD1 . LEU   A 197 ? 0.287  0.5041 0.8524 -0.1761 0.0092  -0.059  887  LEU   A CD1 
2945 C  CD2 . LEU   A 197 ? 0.2552 0.5375 0.8457 -0.1985 0.0134  -0.0567 887  LEU   A CD2 
2957 N  N   . HIS   A 198 ? 0.3334 0.4369 0.8302 -0.1931 0.0278  -0.0427 888  HIS   A N   
2958 C  CA  . HIS   A 198 ? 0.3672 0.4155 0.8264 -0.2    0.0313  -0.0416 888  HIS   A CA  
2959 C  C   . HIS   A 198 ? 0.373  0.4034 0.8255 -0.1879 0.0357  -0.0352 888  HIS   A C   
2960 O  O   . HIS   A 198 ? 0.4037 0.3856 0.8225 -0.1895 0.0387  -0.034  888  HIS   A O   
2961 C  CB  . HIS   A 198 ? 0.4008 0.4103 0.8366 -0.1889 0.028   -0.0451 888  HIS   A CB  
2962 C  CG  . HIS   A 198 ? 0.4277 0.4522 0.8689 -0.1976 0.0232  -0.0515 888  HIS   A CG  
2963 N  ND1 . HIS   A 198 ? 0.4543 0.481  0.8859 -0.2263 0.023   -0.0555 888  HIS   A ND1 
2964 C  CD2 . HIS   A 198 ? 0.4354 0.4733 0.8893 -0.1817 0.0185  -0.0543 888  HIS   A CD2 
2965 C  CE1 . HIS   A 198 ? 0.455  0.4963 0.8941 -0.2259 0.0178  -0.061  888  HIS   A CE1 
2966 N  NE2 . HIS   A 198 ? 0.4492 0.4967 0.9015 -0.199  0.0152  -0.0603 888  HIS   A NE2 
2974 N  N   . ARG   A 199 ? 0.3452 0.4114 0.8263 -0.175  0.0359  -0.0314 889  ARG   A N   
2975 C  CA  . ARG   A 199 ? 0.3504 0.4048 0.8282 -0.1628 0.0393  -0.0255 889  ARG   A CA  
2976 C  C   . ARG   A 199 ? 0.3648 0.377  0.8202 -0.143  0.0388  -0.0241 889  ARG   A C   
2977 O  O   . ARG   A 199 ? 0.3812 0.3666 0.8188 -0.1384 0.0426  -0.0202 889  ARG   A O   
2978 C  CB  . ARG   A 199 ? 0.3791 0.4248 0.8432 -0.183  0.0455  -0.0226 889  ARG   A CB  
2979 C  CG  . ARG   A 199 ? 0.3935 0.4884 0.8812 -0.2009 0.0462  -0.0233 889  ARG   A CG  
2980 C  CD  . ARG   A 199 ? 0.4409 0.5335 0.9178 -0.2201 0.0528  -0.0194 889  ARG   A CD  
2981 N  NE  . ARG   A 199 ? 0.4512 0.5966 0.951  -0.2367 0.0535  -0.0199 889  ARG   A NE  
2982 C  CZ  . ARG   A 199 ? 0.4819 0.6386 0.9763 -0.2595 0.059   -0.0172 889  ARG   A CZ  
2983 N  NH1 . ARG   A 199 ? 0.4535 0.6653 0.9708 -0.2721 0.0592  -0.0177 889  ARG   A NH1 
2984 N  NH2 . ARG   A 199 ? 0.5073 0.6212 0.9723 -0.2695 0.0645  -0.0137 889  ARG   A NH2 
2998 N  N   . ILE   A 200 ? 0.3533 0.363  0.8103 -0.13   0.0342  -0.027  890  ILE   A N   
2999 C  CA  . ILE   A 200 ? 0.3652 0.3419 0.8022 -0.1096 0.0334  -0.0259 890  ILE   A CA  
3000 C  C   . ILE   A 200 ? 0.3337 0.3389 0.7966 -0.0879 0.0303  -0.0225 890  ILE   A C   
3001 O  O   . ILE   A 200 ? 0.3127 0.3534 0.8026 -0.0854 0.0265  -0.0239 890  ILE   A O   
3002 C  CB  . ILE   A 200 ? 0.3869 0.3422 0.8058 -0.1093 0.0306  -0.0309 890  ILE   A CB  
3003 C  CG1 . ILE   A 200 ? 0.4257 0.3428 0.8107 -0.1325 0.0335  -0.0341 890  ILE   A CG1 
3004 C  CG2 . ILE   A 200 ? 0.406  0.3371 0.8083 -0.0839 0.0294  -0.0293 890  ILE   A CG2 
3005 C  CD1 . ILE   A 200 ? 0.4561 0.3552 0.8238 -0.1388 0.0301  -0.0402 890  ILE   A CD1 
3017 N  N   . TYR   A 201 ? 0.33   0.3186 0.7826 -0.0728 0.0318  -0.0182 891  TYR   A N   
3018 C  CA  . TYR   A 201 ? 0.3067 0.3195 0.7803 -0.0542 0.0287  -0.0147 891  TYR   A CA  
3019 C  C   . TYR   A 201 ? 0.3134 0.305  0.7693 -0.0338 0.0276  -0.0132 891  TYR   A C   
3020 O  O   . TYR   A 201 ? 0.3354 0.2906 0.7614 -0.0291 0.031   -0.012  891  TYR   A O   
3021 C  CB  . TYR   A 201 ? 0.3004 0.3211 0.7812 -0.0546 0.031   -0.0104 891  TYR   A CB  
3022 C  CG  . TYR   A 201 ? 0.2892 0.3381 0.7897 -0.0707 0.032   -0.011  891  TYR   A CG  
3023 C  CD1 . TYR   A 201 ? 0.3076 0.3452 0.7956 -0.0901 0.0367  -0.0119 891  TYR   A CD1 
3024 C  CD2 . TYR   A 201 ? 0.2735 0.3603 0.8028 -0.0661 0.0283  -0.0103 891  TYR   A CD2 
3025 C  CE1 . TYR   A 201 ? 0.3004 0.3698 0.807  -0.1036 0.0379  -0.0121 891  TYR   A CE1 
3026 C  CE2 . TYR   A 201 ? 0.2698 0.3836 0.8146 -0.0774 0.0294  -0.0106 891  TYR   A CE2 
3027 C  CZ  . TYR   A 201 ? 0.2865 0.3944 0.8213 -0.0957 0.0342  -0.0115 891  TYR   A CZ  
3028 O  OH  . TYR   A 201 ? 0.2827 0.4223 0.8329 -0.1062 0.0357  -0.0114 891  TYR   A OH  
3038 N  N   . THR   A 202 ? 0.29   0.3052 0.7631 -0.0213 0.0231  -0.0131 892  THR   A N   
3039 C  CA  . THR   A 202 ? 0.2908 0.2977 0.7523 -0.0006 0.0216  -0.0114 892  THR   A CA  
3040 C  C   . THR   A 202 ? 0.2556 0.301  0.7458 0.0101  0.0171  -0.0079 892  THR   A C   
3041 O  O   . THR   A 202 ? 0.2409 0.3133 0.7562 0.0014  0.0151  -0.0076 892  THR   A O   
3042 C  CB  . THR   A 202 ? 0.3162 0.313  0.7664 0.001   0.0204  -0.0154 892  THR   A CB  
3043 O  OG1 . THR   A 202 ? 0.3076 0.339  0.7868 -0.0058 0.0169  -0.0173 892  THR   A OG1 
3044 C  CG2 . THR   A 202 ? 0.3432 0.2993 0.762  -0.0117 0.0238  -0.0192 892  THR   A CG2 
3052 N  N   . HIS   A 203 ? 0.2397 0.2886 0.7251 0.0287  0.0154  -0.0052 893  HIS   A N   
3053 C  CA  . HIS   A 203 ? 0.2111 0.297  0.7219 0.0362  0.0108  -0.0018 893  HIS   A CA  
3054 C  C   . HIS   A 203 ? 0.1837 0.296  0.7175 0.0284  0.0076  -0.0038 893  HIS   A C   
3055 O  O   . HIS   A 203 ? 0.1667 0.3061 0.7229 0.0254  0.0042  -0.0018 893  HIS   A O   
3056 C  CB  . HIS   A 203 ? 0.2199 0.3086 0.7202 0.0568  0.0097  0.0014  893  HIS   A CB  
3057 C  CG  . HIS   A 203 ? 0.2555 0.3183 0.7308 0.0676  0.0126  0.0034  893  HIS   A CG  
3058 N  ND1 . HIS   A 203 ? 0.2728 0.3382 0.7533 0.0653  0.0126  0.0059  893  HIS   A ND1 
3059 C  CD2 . HIS   A 203 ? 0.2844 0.3162 0.7272 0.0813  0.0157  0.003   893  HIS   A CD2 
3060 C  CE1 . HIS   A 203 ? 0.2941 0.3319 0.7467 0.0776  0.0157  0.0071  893  HIS   A CE1 
3061 N  NE2 . HIS   A 203 ? 0.308  0.3239 0.7361 0.0879  0.0177  0.0055  893  HIS   A NE2 
3069 N  N   . GLN   A 204 ? 0.1812 0.2826 0.7067 0.0244  0.0087  -0.0079 894  GLN   A N   
3070 C  CA  . GLN   A 204 ? 0.1709 0.2945 0.7151 0.0179  0.0061  -0.0103 894  GLN   A CA  
3071 C  C   . GLN   A 204 ? 0.1635 0.2976 0.7229 0.0013  0.006   -0.0125 894  GLN   A C   
3072 O  O   . GLN   A 204 ? 0.1512 0.3105 0.7307 -0.0017 0.003   -0.0127 894  GLN   A O   
3073 C  CB  . GLN   A 204 ? 0.2049 0.3128 0.7331 0.0207  0.0069  -0.0141 894  GLN   A CB  
3074 C  CG  . GLN   A 204 ? 0.2449 0.3491 0.7591 0.0408  0.0067  -0.0115 894  GLN   A CG  
3075 C  CD  . GLN   A 204 ? 0.2787 0.4202 0.8153 0.0498  0.0033  -0.0066 894  GLN   A CD  
3076 O  OE1 . GLN   A 204 ? 0.3007 0.4519 0.8396 0.058   0.0026  -0.0021 894  GLN   A OE1 
3077 N  NE2 . GLN   A 204 ? 0.2672 0.4307 0.8197 0.0475  0.001   -0.0073 894  GLN   A NE2 
3086 N  N   . SER   A 205 ? 0.1672 0.2836 0.7166 -0.0087 0.0093  -0.0136 895  SER   A N   
3087 C  CA  . SER   A 205 ? 0.1568 0.2888 0.7213 -0.0221 0.0095  -0.0147 895  SER   A CA  
3088 C  C   . SER   A 205 ? 0.1382 0.2906 0.7194 -0.0164 0.0068  -0.0104 895  SER   A C   
3089 O  O   . SER   A 205 ? 0.1316 0.306  0.7296 -0.0203 0.0044  -0.0108 895  SER   A O   
3090 C  CB  . SER   A 205 ? 0.1893 0.3005 0.7388 -0.0346 0.0141  -0.0161 895  SER   A CB  
3091 O  OG  . SER   A 205 ? 0.2314 0.3305 0.773  -0.0305 0.0163  -0.0123 895  SER   A OG  
3097 N  N   . ASP   A 206 ? 0.1322 0.2769 0.7067 -0.0061 0.0066  -0.0064 896  ASP   A N   
3098 C  CA  . ASP   A 206 ? 0.1143 0.274  0.6994 -0.001  0.003   -0.0024 896  ASP   A CA  
3099 C  C   . ASP   A 206 ? 0.1116 0.2666 0.6841 0.0016  -0.0018 -0.0016 896  ASP   A C   
3100 O  O   . ASP   A 206 ? 0.115  0.2724 0.6867 0.0004  -0.0048 0.0003  896  ASP   A O   
3101 C  CB  . ASP   A 206 ? 0.1347 0.286  0.7107 0.0103  0.0031  0.0013  896  ASP   A CB  
3102 C  CG  . ASP   A 206 ? 0.1977 0.3294 0.761  0.0085  0.0067  0.0023  896  ASP   A CG  
3103 O  OD1 . ASP   A 206 ? 0.2028 0.3311 0.7671 -0.0026 0.0095  0.0005  896  ASP   A OD1 
3104 O  OD2 . ASP   A 206 ? 0.2254 0.3471 0.7774 0.0188  0.007   0.005   896  ASP   A OD2 
3109 N  N   . VAL   A 207 ? 0.1038 0.2559 0.6695 0.005   -0.0021 -0.0028 897  VAL   A N   
3110 C  CA  . VAL   A 207 ? 0.0982 0.2454 0.6505 0.0056  -0.0055 -0.0018 897  VAL   A CA  
3111 C  C   . VAL   A 207 ? 0.0948 0.2229 0.6289 -0.0008 -0.006  -0.0046 897  VAL   A C   
3112 O  O   . VAL   A 207 ? 0.0967 0.2265 0.6275 -0.0011 -0.0089 -0.0027 897  VAL   A O   
3113 C  CB  . VAL   A 207 ? 0.0966 0.2577 0.6569 0.0121  -0.005  -0.0024 897  VAL   A CB  
3114 C  CG1 . VAL   A 207 ? 0.0979 0.2705 0.6611 0.0114  -0.0078 -0.0017 897  VAL   A CG1 
3115 C  CG2 . VAL   A 207 ? 0.0975 0.2729 0.6649 0.0243  -0.0048 0.0012  897  VAL   A CG2 
3125 N  N   . TRP   A 208 ? 0.0876 0.2028 0.6131 -0.0049 -0.0034 -0.0089 898  TRP   A N   
3126 C  CA  . TRP   A 208 ? 0.0849 0.1923 0.5987 -0.0078 -0.0036 -0.0118 898  TRP   A CA  
3127 C  C   . TRP   A 208 ? 0.0822 0.1772 0.582  -0.0069 -0.0047 -0.0091 898  TRP   A C   
3128 O  O   . TRP   A 208 ? 0.084  0.1769 0.5763 -0.0059 -0.007  -0.0084 898  TRP   A O   
3129 C  CB  . TRP   A 208 ? 0.082  0.1984 0.6056 -0.014  -0.0005 -0.0165 898  TRP   A CB  
3130 C  CG  . TRP   A 208 ? 0.084  0.2173 0.6153 -0.0184 -0.001  -0.0197 898  TRP   A CG  
3131 C  CD1 . TRP   A 208 ? 0.0881 0.2358 0.6271 -0.0197 -0.0016 -0.0187 898  TRP   A CD1 
3132 C  CD2 . TRP   A 208 ? 0.0837 0.2359 0.628  -0.0237 -0.001  -0.0246 898  TRP   A CD2 
3133 N  NE1 . TRP   A 208 ? 0.0852 0.253  0.633  -0.0233 -0.002  -0.0224 898  TRP   A NE1 
3134 C  CE2 . TRP   A 208 ? 0.0838 0.2546 0.6348 -0.0267 -0.0016 -0.0263 898  TRP   A CE2 
3135 C  CE3 . TRP   A 208 ? 0.0876 0.2499 0.6448 -0.0282 -0.0005 -0.0281 898  TRP   A CE3 
3136 C  CZ2 . TRP   A 208 ? 0.082  0.2787 0.6485 -0.0327 -0.0021 -0.0311 898  TRP   A CZ2 
3137 C  CZ3 . TRP   A 208 ? 0.0873 0.2726 0.6592 -0.0355 -0.0012 -0.0331 898  TRP   A CZ3 
3138 C  CH2 . TRP   A 208 ? 0.0848 0.2862 0.6597 -0.0377 -0.002  -0.0346 898  TRP   A CH2 
3149 N  N   . SER   A 209 ? 0.0816 0.1677 0.5771 -0.0067 -0.0031 -0.0073 899  SER   A N   
3150 C  CA  . SER   A 209 ? 0.0848 0.1725 0.5805 -0.0064 -0.0042 -0.0047 899  SER   A CA  
3151 C  C   . SER   A 209 ? 0.0824 0.1529 0.5595 -0.0032 -0.008  -0.0009 899  SER   A C   
3152 O  O   . SER   A 209 ? 0.0823 0.1458 0.5493 -0.0028 -0.0099 0.0004  899  SER   A O   
3153 C  CB  . SER   A 209 ? 0.0987 0.2138 0.6275 -0.0093 -0.0017 -0.0032 899  SER   A CB  
3154 O  OG  . SER   A 209 ? 0.118  0.2822 0.6976 -0.0202 0.0028  -0.0062 899  SER   A OG  
3160 N  N   . TYR   A 210 ? 0.079  0.1423 0.549  -0.0017 -0.009  0.0011  900  TYR   A N   
3161 C  CA  . TYR   A 210 ? 0.0787 0.1432 0.5449 -0.0011 -0.0127 0.0049  900  TYR   A CA  
3162 C  C   . TYR   A 210 ? 0.0712 0.1198 0.5169 -0.0014 -0.014  0.0043  900  TYR   A C   
3163 O  O   . TYR   A 210 ? 0.072  0.1162 0.5109 -0.0016 -0.0166 0.0066  900  TYR   A O   
3164 C  CB  . TYR   A 210 ? 0.0789 0.1608 0.5579 0.0006  -0.0132 0.0072  900  TYR   A CB  
3165 C  CG  . TYR   A 210 ? 0.0855 0.1972 0.5845 0.0008  -0.0176 0.0113  900  TYR   A CG  
3166 C  CD1 . TYR   A 210 ? 0.0905 0.2203 0.6036 0.001   -0.0212 0.0151  900  TYR   A CD1 
3167 C  CD2 . TYR   A 210 ? 0.0891 0.2196 0.6005 0.0002  -0.019  0.0115  900  TYR   A CD2 
3168 C  CE1 . TYR   A 210 ? 0.091  0.2438 0.6162 -0.0009 -0.0258 0.019   900  TYR   A CE1 
3169 C  CE2 . TYR   A 210 ? 0.0896 0.2405 0.6109 -0.0013 -0.0229 0.0158  900  TYR   A CE2 
3170 C  CZ  . TYR   A 210 ? 0.0914 0.2579 0.6238 -0.0025 -0.0267 0.0196  900  TYR   A CZ  
3171 O  OH  . TYR   A 210 ? 0.0909 0.284  0.6378 -0.0065 -0.0314 0.0241  900  TYR   A OH  
3181 N  N   . GLY   A 211 ? 0.0655 0.1091 0.5048 -0.0013 -0.0123 0.001   901  GLY   A N   
3182 C  CA  . GLY   A 211 ? 0.0656 0.1134 0.5041 -0.0016 -0.0136 -0.0001 901  GLY   A CA  
3183 C  C   . GLY   A 211 ? 0.0668 0.1151 0.5041 -0.0018 -0.0142 -0.0014 901  GLY   A C   
3184 O  O   . GLY   A 211 ? 0.065  0.1092 0.4941 -0.0016 -0.0163 -0.0002 901  GLY   A O   
3188 N  N   . VAL   A 212 ? 0.0659 0.1149 0.5053 -0.002  -0.0121 -0.0035 902  VAL   A N   
3189 C  CA  . VAL   A 212 ? 0.0679 0.1282 0.513  -0.0021 -0.0126 -0.0044 902  VAL   A CA  
3190 C  C   . VAL   A 212 ? 0.0769 0.1429 0.5298 -0.0017 -0.0158 -0.0004 902  VAL   A C   
3191 O  O   . VAL   A 212 ? 0.0814 0.1555 0.5374 -0.001  -0.0183 0.0001  902  VAL   A O   
3192 C  CB  . VAL   A 212 ? 0.0635 0.1333 0.5148 -0.0032 -0.0093 -0.0072 902  VAL   A CB  
3193 C  CG1 . VAL   A 212 ? 0.0639 0.1479 0.5186 -0.0025 -0.0096 -0.0076 902  VAL   A CG1 
3194 C  CG2 . VAL   A 212 ? 0.0574 0.133  0.5114 -0.0048 -0.0071 -0.0116 902  VAL   A CG2 
3204 N  N   . THR   A 213 ? 0.0808 0.1469 0.5402 -0.002  -0.0163 0.0024  903  THR   A N   
3205 C  CA  . THR   A 213 ? 0.0877 0.1601 0.5549 -0.002  -0.0202 0.0062  903  THR   A CA  
3206 C  C   . THR   A 213 ? 0.0928 0.1747 0.5664 -0.003  -0.0248 0.0085  903  THR   A C   
3207 O  O   . THR   A 213 ? 0.0965 0.1792 0.5696 -0.003  -0.0285 0.0101  903  THR   A O   
3208 C  CB  . THR   A 213 ? 0.0927 0.1746 0.5743 -0.0023 -0.0204 0.0085  903  THR   A CB  
3209 O  OG1 . THR   A 213 ? 0.0957 0.1876 0.5907 -0.0023 -0.0163 0.0064  903  THR   A OG1 
3210 C  CG2 . THR   A 213 ? 0.0966 0.1807 0.5808 -0.0022 -0.0246 0.0119  903  THR   A CG2 
3218 N  N   . VAL   A 214 ? 0.0914 0.1771 0.567  -0.0039 -0.0246 0.0088  904  VAL   A N   
3219 C  CA  . VAL   A 214 ? 0.0945 0.1924 0.5777 -0.006  -0.0286 0.0115  904  VAL   A CA  
3220 C  C   . VAL   A 214 ? 0.097  0.1908 0.5734 -0.005  -0.0292 0.0095  904  VAL   A C   
3221 O  O   . VAL   A 214 ? 0.0987 0.1907 0.5717 -0.006  -0.0333 0.0119  904  VAL   A O   
3222 C  CB  . VAL   A 214 ? 0.0988 0.2211 0.6024 -0.0077 -0.0283 0.0123  904  VAL   A CB  
3223 C  CG1 . VAL   A 214 ? 0.1016 0.2409 0.6158 -0.0111 -0.032  0.0149  904  VAL   A CG1 
3224 C  CG2 . VAL   A 214 ? 0.0977 0.2341 0.6134 -0.0083 -0.029  0.0153  904  VAL   A CG2 
3234 N  N   . TRP   A 215 ? 0.0962 0.186  0.5668 -0.003  -0.0254 0.005   905  TRP   A N   
3235 C  CA  . TRP   A 215 ? 0.096  0.1888 0.5631 -0.0013 -0.0259 0.0025  905  TRP   A CA  
3236 C  C   . TRP   A 215 ? 0.095  0.1816 0.5542 0.0005  -0.028  0.0034  905  TRP   A C   
3237 O  O   . TRP   A 215 ? 0.0951 0.1833 0.5516 0.002   -0.0311 0.004   905  TRP   A O   
3238 C  CB  . TRP   A 215 ? 0.0945 0.1959 0.5652 -0.0002 -0.022  -0.0025 905  TRP   A CB  
3239 C  CG  . TRP   A 215 ? 0.0962 0.2151 0.5733 0.0027  -0.0229 -0.0052 905  TRP   A CG  
3240 C  CD1 . TRP   A 215 ? 0.1009 0.2304 0.5838 0.0037  -0.0241 -0.0062 905  TRP   A CD1 
3241 C  CD2 . TRP   A 215 ? 0.0971 0.2303 0.5781 0.0069  -0.0231 -0.0069 905  TRP   A CD2 
3242 N  NE1 . TRP   A 215 ? 0.1025 0.2501 0.5907 0.009   -0.025  -0.0087 905  TRP   A NE1 
3243 C  CE2 . TRP   A 215 ? 0.0994 0.252  0.5878 0.0118  -0.0246 -0.009  905  TRP   A CE2 
3244 C  CE3 . TRP   A 215 ? 0.0984 0.2409 0.5861 0.0089  -0.0224 -0.0065 905  TRP   A CE3 
3245 C  CZ2 . TRP   A 215 ? 0.0986 0.2685 0.5878 0.0197  -0.0249 -0.0109 905  TRP   A CZ2 
3246 C  CZ3 . TRP   A 215 ? 0.0993 0.2636 0.5929 0.0163  -0.0229 -0.0079 905  TRP   A CZ3 
3247 C  CH2 . TRP   A 215 ? 0.0982 0.274  0.5894 0.0221  -0.0239 -0.0102 905  TRP   A CH2 
3258 N  N   . GLU   A 216 ? 0.0935 0.1779 0.5534 0.0009  -0.0269 0.0037  906  GLU   A N   
3259 C  CA  . GLU   A 216 ? 0.0982 0.188  0.5612 0.0034  -0.0297 0.0047  906  GLU   A CA  
3260 C  C   . GLU   A 216 ? 0.1048 0.1955 0.5731 0.0019  -0.0363 0.0086  906  GLU   A C   
3261 O  O   . GLU   A 216 ? 0.1079 0.2017 0.5754 0.005   -0.0405 0.0089  906  GLU   A O   
3262 C  CB  . GLU   A 216 ? 0.1044 0.2083 0.5846 0.0042  -0.0282 0.0051  906  GLU   A CB  
3263 C  CG  . GLU   A 216 ? 0.1146 0.2542 0.624  0.0066  -0.024  0.002   906  GLU   A CG  
3264 C  CD  . GLU   A 216 ? 0.1292 0.2921 0.6663 0.0071  -0.0226 0.0033  906  GLU   A CD  
3265 O  OE1 . GLU   A 216 ? 0.1329 0.3116 0.6794 0.0129  -0.0229 0.0039  906  GLU   A OE1 
3266 O  OE2 . GLU   A 216 ? 0.1272 0.2769 0.66   0.0027  -0.0206 0.0038  906  GLU   A OE2 
3273 N  N   . LEU   A 217 ? 0.1059 0.2006 0.584  -0.0026 -0.0384 0.0117  907  LEU   A N   
3274 C  CA  . LEU   A 217 ? 0.1107 0.2131 0.5976 -0.0071 -0.046  0.0158  907  LEU   A CA  
3275 C  C   . LEU   A 217 ? 0.1144 0.2304 0.611  -0.0098 -0.0504 0.0164  907  LEU   A C   
3276 O  O   . LEU   A 217 ? 0.1182 0.236  0.616  -0.0116 -0.0575 0.0178  907  LEU   A O   
3277 C  CB  . LEU   A 217 ? 0.1087 0.2141 0.5993 -0.0121 -0.0467 0.0192  907  LEU   A CB  
3278 C  CG  . LEU   A 217 ? 0.1159 0.2358 0.6244 -0.0113 -0.0449 0.0186  907  LEU   A CG  
3279 C  CD1 . LEU   A 217 ? 0.1145 0.2457 0.6306 -0.0158 -0.0468 0.0221  907  LEU   A CD1 
3280 C  CD2 . LEU   A 217 ? 0.1217 0.2431 0.6347 -0.0089 -0.0476 0.0183  907  LEU   A CD2 
3292 N  N   . MET   A 218 ? 0.1122 0.236  0.614  -0.01   -0.0468 0.0152  908  MET   A N   
3293 C  CA  . MET   A 218 ? 0.1153 0.2501 0.6241 -0.0128 -0.05   0.016   908  MET   A CA  
3294 C  C   . MET   A 218 ? 0.1176 0.256  0.6259 -0.0049 -0.0523 0.0133  908  MET   A C   
3295 O  O   . MET   A 218 ? 0.1167 0.2536 0.6215 -0.0068 -0.0576 0.015   908  MET   A O   
3296 C  CB  . MET   A 218 ? 0.117  0.266  0.6373 -0.0135 -0.0457 0.0149  908  MET   A CB  
3297 C  CG  . MET   A 218 ? 0.1265 0.3033 0.6745 -0.0214 -0.0465 0.0178  908  MET   A CG  
3298 S  SD  . MET   A 218 ? 0.1636 0.3758 0.743  -0.0404 -0.0566 0.0241  908  MET   A SD  
3299 C  CE  . MET   A 218 ? 0.13   0.3409 0.7023 -0.0388 -0.0522 0.0268  908  MET   A CE  
3309 N  N   . THR   A 219 ? 0.1203 0.2656 0.6319 0.0046  -0.0489 0.0095  909  THR   A N   
3310 C  CA  . THR   A 219 ? 0.1271 0.285  0.642  0.0189  -0.0514 0.0076  909  THR   A CA  
3311 C  C   . THR   A 219 ? 0.1587 0.2905 0.6485 0.0236  -0.0555 0.0093  909  THR   A C   
3312 O  O   . THR   A 219 ? 0.1761 0.2976 0.6459 0.0373  -0.0556 0.0078  909  THR   A O   
3313 C  CB  . THR   A 219 ? 0.1237 0.2962 0.6432 0.0265  -0.0445 0.0029  909  THR   A CB  
3314 O  OG1 . THR   A 219 ? 0.123  0.2991 0.6504 0.0223  -0.0408 0.0024  909  THR   A OG1 
3315 C  CG2 . THR   A 219 ? 0.1236 0.3093 0.6527 0.024   -0.041  0.0003  909  THR   A CG2 
3323 N  N   . PHE   A 220 ? 0.1648 0.2876 0.6548 0.0137  -0.0588 0.0123  910  PHE   A N   
3324 C  CA  . PHE   A 220 ? 0.1925 0.2903 0.6593 0.0169  -0.0631 0.0138  910  PHE   A CA  
3325 C  C   . PHE   A 220 ? 0.1954 0.3023 0.6644 0.031   -0.0589 0.0114  910  PHE   A C   
3326 O  O   . PHE   A 220 ? 0.2158 0.3033 0.6589 0.043   -0.0609 0.0112  910  PHE   A O   
3327 C  CB  . PHE   A 220 ? 0.2196 0.2805 0.6484 0.018   -0.0693 0.0155  910  PHE   A CB  
3328 C  CG  . PHE   A 220 ? 0.2353 0.2881 0.6614 0.0008  -0.0733 0.0188  910  PHE   A CG  
3329 C  CD1 . PHE   A 220 ? 0.2481 0.2977 0.6771 -0.0151 -0.0779 0.0222  910  PHE   A CD1 
3330 C  CD2 . PHE   A 220 ? 0.2507 0.3021 0.6718 0.0004  -0.0725 0.0187  910  PHE   A CD2 
3331 C  CE1 . PHE   A 220 ? 0.2597 0.3075 0.6874 -0.032  -0.0813 0.0257  910  PHE   A CE1 
3332 C  CE2 . PHE   A 220 ? 0.2634 0.3089 0.6815 -0.0163 -0.0757 0.0224  910  PHE   A CE2 
3333 C  CZ  . PHE   A 220 ? 0.2601 0.3057 0.6824 -0.033  -0.08   0.026   910  PHE   A CZ  
3343 N  N   . GLY   A 221 ? 0.174  0.3096 0.6723 0.0292  -0.0532 0.0099  911  GLY   A N   
3344 C  CA  . GLY   A 221 ? 0.1693 0.3183 0.6742 0.0382  -0.0485 0.0083  911  GLY   A CA  
3345 C  C   . GLY   A 221 ? 0.1592 0.3285 0.6679 0.0497  -0.0435 0.0051  911  GLY   A C   
3346 O  O   . GLY   A 221 ? 0.1628 0.3384 0.6668 0.0598  -0.0409 0.0047  911  GLY   A O   
3350 N  N   . SER   A 222 ? 0.1458 0.3287 0.6636 0.0486  -0.0419 0.0029  912  SER   A N   
3351 C  CA  . SER   A 222 ? 0.135  0.3424 0.6581 0.0588  -0.0375 -0.0004 912  SER   A CA  
3352 C  C   . SER   A 222 ? 0.1203 0.3449 0.6576 0.0501  -0.0306 -0.0023 912  SER   A C   
3353 O  O   . SER   A 222 ? 0.1188 0.3307 0.6584 0.0361  -0.0289 -0.0016 912  SER   A O   
3354 C  CB  . SER   A 222 ? 0.1504 0.3636 0.6749 0.059   -0.038  -0.0024 912  SER   A CB  
3355 O  OG  . SER   A 222 ? 0.1991 0.3842 0.6942 0.0662  -0.043  -0.001  912  SER   A OG  
3361 N  N   . LYS   A 223 ? 0.1096 0.3551 0.6465 0.0581  -0.0266 -0.0043 913  LYS   A N   
3362 C  CA  . LYS   A 223 ? 0.1039 0.3711 0.6572 0.0503  -0.0206 -0.0057 913  LYS   A CA  
3363 C  C   . LYS   A 223 ? 0.1007 0.3776 0.664  0.0403  -0.0184 -0.0091 913  LYS   A C   
3364 O  O   . LYS   A 223 ? 0.101  0.398  0.6702 0.0482  -0.0196 -0.0115 913  LYS   A O   
3365 C  CB  . LYS   A 223 ? 0.1118 0.4225 0.6816 0.0658  -0.0177 -0.0061 913  LYS   A CB  
3366 C  CG  . LYS   A 223 ? 0.1878 0.4824 0.7398 0.0755  -0.0186 -0.0027 913  LYS   A CG  
3367 C  CD  . LYS   A 223 ? 0.2593 0.5793 0.8038 0.0911  -0.0153 -0.0028 913  LYS   A CD  
3368 C  CE  . LYS   A 223 ? 0.3355 0.6409 0.8622 0.1018  -0.0156 0.0007  913  LYS   A CE  
3369 N  NZ  . LYS   A 223 ? 0.3708 0.68   0.9119 0.0896  -0.0115 0.0026  913  LYS   A NZ  
3383 N  N   . PRO   A 224 ? 0.0995 0.3642 0.6649 0.026   -0.0156 -0.0097 914  PRO   A N   
3384 C  CA  . PRO   A 224 ? 0.0952 0.3658 0.6657 0.0188  -0.0141 -0.0133 914  PRO   A CA  
3385 C  C   . PRO   A 224 ? 0.083  0.3899 0.665  0.0197  -0.0108 -0.0167 914  PRO   A C   
3386 O  O   . PRO   A 224 ? 0.0749 0.4001 0.664  0.0194  -0.0076 -0.0159 914  PRO   A O   
3387 C  CB  . PRO   A 224 ? 0.103  0.3643 0.6843 0.0079  -0.0124 -0.0125 914  PRO   A CB  
3388 C  CG  . PRO   A 224 ? 0.1071 0.3688 0.694  0.0084  -0.0114 -0.0093 914  PRO   A CG  
3389 C  CD  . PRO   A 224 ? 0.1003 0.345  0.6622 0.0185  -0.0141 -0.0071 914  PRO   A CD  
3397 N  N   . TYR   A 225 ? 0.0764 0.3933 0.6573 0.0207  -0.0115 -0.0203 915  TYR   A N   
3398 C  CA  . TYR   A 225 ? 0.0651 0.4271 0.6635 0.0215  -0.0093 -0.0241 915  TYR   A CA  
3399 C  C   . TYR   A 225 ? 0.0624 0.4632 0.6736 0.0351  -0.0083 -0.0225 915  TYR   A C   
3400 O  O   . TYR   A 225 ? 0.0526 0.4843 0.6781 0.0304  -0.0043 -0.0227 915  TYR   A O   
3401 C  CB  . TYR   A 225 ? 0.0559 0.4234 0.6628 0.0051  -0.0055 -0.0263 915  TYR   A CB  
3402 C  CG  . TYR   A 225 ? 0.0695 0.4125 0.6793 -0.0043 -0.0063 -0.0268 915  TYR   A CG  
3403 C  CD1 . TYR   A 225 ? 0.074  0.4251 0.6928 -0.0066 -0.0079 -0.0304 915  TYR   A CD1 
3404 C  CD2 . TYR   A 225 ? 0.0816 0.409  0.6978 -0.0102 -0.0051 -0.0238 915  TYR   A CD2 
3405 C  CE1 . TYR   A 225 ? 0.0868 0.4238 0.7134 -0.0137 -0.0084 -0.0307 915  TYR   A CE1 
3406 C  CE2 . TYR   A 225 ? 0.0938 0.4082 0.7179 -0.0167 -0.0057 -0.0241 915  TYR   A CE2 
3407 C  CZ  . TYR   A 225 ? 0.0989 0.4241 0.7338 -0.0186 -0.0073 -0.0275 915  TYR   A CZ  
3408 O  OH  . TYR   A 225 ? 0.1149 0.4398 0.7677 -0.0245 -0.0078 -0.0276 915  TYR   A OH  
3418 N  N   . ASP   A 226 ? 0.0726 0.4693 0.6768 0.0524  -0.0117 -0.0205 916  ASP   A N   
3419 C  CA  . ASP   A 226 ? 0.0858 0.5042 0.6887 0.0701  -0.0112 -0.0185 916  ASP   A CA  
3420 C  C   . ASP   A 226 ? 0.0815 0.5452 0.6897 0.0779  -0.0087 -0.0215 916  ASP   A C   
3421 O  O   . ASP   A 226 ? 0.0799 0.5557 0.6888 0.0824  -0.0104 -0.0248 916  ASP   A O   
3422 C  CB  . ASP   A 226 ? 0.1356 0.5201 0.7118 0.0863  -0.0162 -0.0162 916  ASP   A CB  
3423 C  CG  . ASP   A 226 ? 0.2245 0.607  0.7805 0.1039  -0.016  -0.0135 916  ASP   A CG  
3424 O  OD1 . ASP   A 226 ? 0.2272 0.6225 0.7906 0.1003  -0.0123 -0.0118 916  ASP   A OD1 
3425 O  OD2 . ASP   A 226 ? 0.2762 0.6419 0.8063 0.122   -0.0195 -0.013  916  ASP   A OD2 
3430 N  N   . GLY   A 227 ? 0.0787 0.5697 0.6912 0.079   -0.0046 -0.0202 917  GLY   A N   
3431 C  CA  . GLY   A 227 ? 0.0764 0.618  0.6956 0.0853  -0.0019 -0.0224 917  GLY   A CA  
3432 C  C   . GLY   A 227 ? 0.0687 0.642  0.7123 0.0636  0.0008  -0.0261 917  GLY   A C   
3433 O  O   . GLY   A 227 ? 0.0545 0.6748 0.7066 0.064   0.0033  -0.0277 917  GLY   A O   
3437 N  N   . ILE   A 228 ? 0.0799 0.6286 0.7331 0.0446  0       -0.0274 918  ILE   A N   
3438 C  CA  . ILE   A 228 ? 0.0728 0.6421 0.7442 0.0228  0.0019  -0.0311 918  ILE   A CA  
3439 C  C   . ILE   A 228 ? 0.0792 0.6523 0.7578 0.0055  0.0069  -0.0286 918  ILE   A C   
3440 O  O   . ILE   A 228 ? 0.0972 0.6358 0.7694 0.0045  0.0074  -0.025  918  ILE   A O   
3441 C  CB  . ILE   A 228 ? 0.085  0.6218 0.7586 0.0137  -0.0013 -0.0335 918  ILE   A CB  
3442 C  CG1 . ILE   A 228 ? 0.093  0.6321 0.7604 0.0285  -0.0055 -0.0363 918  ILE   A CG1 
3443 C  CG2 . ILE   A 228 ? 0.0838 0.6288 0.7709 -0.0105 0.0008  -0.0368 918  ILE   A CG2 
3444 C  CD1 . ILE   A 228 ? 0.1173 0.6178 0.7804 0.0273  -0.0089 -0.0363 918  ILE   A CD1 
3456 N  N   . PRO   A 229 ? 0.0618 0.674  0.7524 -0.0097 0.0105  -0.0302 919  PRO   A N   
3457 C  CA  . PRO   A 229 ? 0.0615 0.6718 0.7557 -0.0277 0.0157  -0.0272 919  PRO   A CA  
3458 C  C   . PRO   A 229 ? 0.0787 0.6493 0.7731 -0.0471 0.0156  -0.0283 919  PRO   A C   
3459 O  O   . PRO   A 229 ? 0.0809 0.6417 0.7778 -0.0523 0.0125  -0.0324 919  PRO   A O   
3460 C  CB  . PRO   A 229 ? 0.0478 0.7146 0.7533 -0.0389 0.019   -0.0287 919  PRO   A CB  
3461 C  CG  . PRO   A 229 ? 0.0435 0.7348 0.7544 -0.0345 0.0149  -0.0341 919  PRO   A CG  
3462 C  CD  . PRO   A 229 ? 0.0419 0.7016 0.7423 -0.0125 0.01    -0.0347 919  PRO   A CD  
3470 N  N   . ALA   A 230 ? 0.0952 0.6416 0.785  -0.0555 0.0191  -0.0245 920  ALA   A N   
3471 C  CA  . ALA   A 230 ? 0.1263 0.632  0.8121 -0.0702 0.0193  -0.0251 920  ALA   A CA  
3472 C  C   . ALA   A 230 ? 0.1316 0.6457 0.8214 -0.0937 0.0204  -0.0294 920  ALA   A C   
3473 O  O   . ALA   A 230 ? 0.1447 0.6272 0.8296 -0.1012 0.0186  -0.0317 920  ALA   A O   
3474 C  CB  . ALA   A 230 ? 0.1385 0.6195 0.8165 -0.0732 0.0232  -0.0201 920  ALA   A CB  
3480 N  N   . SER   A 231 ? 0.1197 0.6766 0.8167 -0.1051 0.0231  -0.0303 921  SER   A N   
3481 C  CA  . SER   A 231 ? 0.1241 0.6932 0.8237 -0.1299 0.0236  -0.0346 921  SER   A CA  
3482 C  C   . SER   A 231 ? 0.1251 0.6992 0.8288 -0.1279 0.0181  -0.0407 921  SER   A C   
3483 O  O   . SER   A 231 ? 0.1383 0.7142 0.841  -0.1484 0.0175  -0.0449 921  SER   A O   
3484 C  CB  . SER   A 231 ? 0.1221 0.7435 0.8298 -0.1424 0.0275  -0.0336 921  SER   A CB  
3485 O  OG  . SER   A 231 ? 0.1413 0.8058 0.8579 -0.1214 0.0261  -0.0332 921  SER   A OG  
3491 N  N   . GLU   A 232 ? 0.1081 0.683  0.8142 -0.1043 0.0141  -0.0413 922  GLU   A N   
3492 C  CA  . GLU   A 232 ? 0.0972 0.6746 0.8061 -0.0996 0.009   -0.0466 922  GLU   A CA  
3493 C  C   . GLU   A 232 ? 0.1036 0.6317 0.8046 -0.0936 0.0063  -0.0468 922  GLU   A C   
3494 O  O   . GLU   A 232 ? 0.1075 0.6331 0.8094 -0.0911 0.0026  -0.0508 922  GLU   A O   
3495 C  CB  . GLU   A 232 ? 0.1039 0.712  0.8172 -0.0759 0.0065  -0.0468 922  GLU   A CB  
3496 C  CG  . GLU   A 232 ? 0.1401 0.7744 0.859  -0.0745 0.0025  -0.0527 922  GLU   A CG  
3497 C  CD  . GLU   A 232 ? 0.1915 0.8437 0.9091 -0.0479 -0.0003 -0.0528 922  GLU   A CD  
3498 O  OE1 . GLU   A 232 ? 0.189  0.8384 0.9006 -0.0307 0.0008  -0.0483 922  GLU   A OE1 
3499 O  OE2 . GLU   A 232 ? 0.2176 0.8848 0.9377 -0.0439 -0.0038 -0.0575 922  GLU   A OE2 
3506 N  N   . ILE   A 233 ? 0.1037 0.5959 0.797  -0.0905 0.0081  -0.0423 923  ILE   A N   
3507 C  CA  . ILE   A 233 ? 0.1124 0.5647 0.7992 -0.0823 0.0056  -0.0415 923  ILE   A CA  
3508 C  C   . ILE   A 233 ? 0.1263 0.5571 0.8078 -0.0959 0.0047  -0.0454 923  ILE   A C   
3509 O  O   . ILE   A 233 ? 0.1294 0.5502 0.8106 -0.0885 0.0012  -0.0476 923  ILE   A O   
3510 C  CB  . ILE   A 233 ? 0.1233 0.5473 0.8033 -0.0756 0.0074  -0.0357 923  ILE   A CB  
3511 C  CG1 . ILE   A 233 ? 0.1233 0.5652 0.8051 -0.0597 0.0075  -0.0321 923  ILE   A CG1 
3512 C  CG2 . ILE   A 233 ? 0.134  0.5211 0.8079 -0.0684 0.0049  -0.0345 923  ILE   A CG2 
3513 C  CD1 . ILE   A 233 ? 0.1351 0.5835 0.8169 -0.0406 0.0031  -0.0324 923  ILE   A CD1 
3525 N  N   . SER   A 234 ? 0.1376 0.5618 0.8129 -0.1161 0.0077  -0.0466 924  SER   A N   
3526 C  CA  . SER   A 234 ? 0.1614 0.56   0.826  -0.1288 0.0066  -0.0506 924  SER   A CA  
3527 C  C   . SER   A 234 ? 0.1513 0.5708 0.8222 -0.1286 0.0023  -0.0565 924  SER   A C   
3528 O  O   . SER   A 234 ? 0.1666 0.5638 0.8316 -0.1237 -0.0004 -0.0587 924  SER   A O   
3529 C  CB  . SER   A 234 ? 0.1917 0.5804 0.8451 -0.1524 0.0103  -0.0511 924  SER   A CB  
3530 O  OG  . SER   A 234 ? 0.2192 0.6464 0.8797 -0.1686 0.0103  -0.0545 924  SER   A OG  
3536 N  N   . SER   A 235 ? 0.1224 0.5868 0.8053 -0.1307 0.0016  -0.0585 925  SER   A N   
3537 C  CA  . SER   A 235 ? 0.1042 0.596  0.7941 -0.129  -0.0025 -0.0641 925  SER   A CA  
3538 C  C   . SER   A 235 ? 0.0883 0.5738 0.7813 -0.1054 -0.0057 -0.0635 925  SER   A C   
3539 O  O   . SER   A 235 ? 0.0902 0.5681 0.781  -0.1036 -0.009  -0.0673 925  SER   A O   
3540 C  CB  . SER   A 235 ? 0.1031 0.6491 0.8052 -0.1328 -0.002  -0.0653 925  SER   A CB  
3541 O  OG  . SER   A 235 ? 0.1439 0.6999 0.8454 -0.1488 0.0024  -0.0626 925  SER   A OG  
3547 N  N   . ILE   A 236 ? 0.0753 0.5625 0.7713 -0.0883 -0.0049 -0.0585 926  ILE   A N   
3548 C  CA  . ILE   A 236 ? 0.0817 0.5593 0.7775 -0.0677 -0.0077 -0.057  926  ILE   A CA  
3549 C  C   . ILE   A 236 ? 0.0913 0.5297 0.7798 -0.0672 -0.0087 -0.0563 926  ILE   A C   
3550 O  O   . ILE   A 236 ? 0.0978 0.5328 0.786  -0.0595 -0.0116 -0.0582 926  ILE   A O   
3551 C  CB  . ILE   A 236 ? 0.0899 0.5691 0.7852 -0.0527 -0.0066 -0.0514 926  ILE   A CB  
3552 C  CG1 . ILE   A 236 ? 0.0859 0.6086 0.7866 -0.0458 -0.0064 -0.0524 926  ILE   A CG1 
3553 C  CG2 . ILE   A 236 ? 0.1058 0.5617 0.7959 -0.036  -0.0093 -0.0484 926  ILE   A CG2 
3554 C  CD1 . ILE   A 236 ? 0.1041 0.6315 0.8022 -0.0363 -0.0042 -0.0475 926  ILE   A CD1 
3566 N  N   . LEU   A 237 ? 0.0926 0.5031 0.7742 -0.0749 -0.0062 -0.0536 927  LEU   A N   
3567 C  CA  . LEU   A 237 ? 0.1068 0.4825 0.7799 -0.0727 -0.0067 -0.0525 927  LEU   A CA  
3568 C  C   . LEU   A 237 ? 0.1234 0.4911 0.7903 -0.0816 -0.0082 -0.058  927  LEU   A C   
3569 O  O   . LEU   A 237 ? 0.1301 0.4825 0.7933 -0.0734 -0.0101 -0.0581 927  LEU   A O   
3570 C  CB  . LEU   A 237 ? 0.1138 0.4627 0.7786 -0.0771 -0.0034 -0.0483 927  LEU   A CB  
3571 C  CG  . LEU   A 237 ? 0.1233 0.4732 0.7912 -0.0683 -0.0022 -0.0426 927  LEU   A CG  
3572 C  CD1 . LEU   A 237 ? 0.1399 0.4638 0.7983 -0.0739 0.0011  -0.0394 927  LEU   A CD1 
3573 C  CD2 . LEU   A 237 ? 0.125  0.4711 0.7956 -0.0518 -0.0052 -0.0395 927  LEU   A CD2 
3585 N  N   . GLU   A 238 ? 0.13   0.5087 0.7946 -0.0987 -0.0076 -0.0624 928  GLU   A N   
3586 C  CA  . GLU   A 238 ? 0.1465 0.5158 0.8021 -0.1087 -0.0098 -0.0682 928  GLU   A CA  
3587 C  C   . GLU   A 238 ? 0.1427 0.5351 0.8067 -0.0995 -0.0138 -0.072  928  GLU   A C   
3588 O  O   . GLU   A 238 ? 0.1588 0.5364 0.8149 -0.0995 -0.016  -0.0755 928  GLU   A O   
3589 C  CB  . GLU   A 238 ? 0.1751 0.5509 0.8247 -0.1323 -0.0086 -0.0718 928  GLU   A CB  
3590 C  CG  . GLU   A 238 ? 0.2412 0.5818 0.8744 -0.1435 -0.0048 -0.069  928  GLU   A CG  
3591 C  CD  . GLU   A 238 ? 0.3155 0.6658 0.9436 -0.1682 -0.0027 -0.0708 928  GLU   A CD  
3592 O  OE1 . GLU   A 238 ? 0.3354 0.7278 0.9765 -0.1765 -0.004  -0.0736 928  GLU   A OE1 
3593 O  OE2 . GLU   A 238 ? 0.3459 0.6625 0.9558 -0.1793 0.0004  -0.0691 928  GLU   A OE2 
3600 N  N   . LYS   A 239 ? 0.1197 0.5461 0.7973 -0.0901 -0.0145 -0.0712 929  LYS   A N   
3601 C  CA  . LYS   A 239 ? 0.1109 0.5577 0.7945 -0.0784 -0.018  -0.0742 929  LYS   A CA  
3602 C  C   . LYS   A 239 ? 0.1083 0.5337 0.7895 -0.0608 -0.0189 -0.0706 929  LYS   A C   
3603 O  O   . LYS   A 239 ? 0.1118 0.5494 0.7955 -0.0501 -0.0214 -0.0723 929  LYS   A O   
3604 C  CB  . LYS   A 239 ? 0.1272 0.6147 0.8216 -0.0712 -0.0182 -0.0741 929  LYS   A CB  
3605 C  CG  . LYS   A 239 ? 0.187  0.7093 0.8866 -0.0872 -0.0182 -0.0784 929  LYS   A CG  
3606 C  CD  . LYS   A 239 ? 0.2417 0.8086 0.9509 -0.0759 -0.0185 -0.0782 929  LYS   A CD  
3607 C  CE  . LYS   A 239 ? 0.2946 0.8659 1.0057 -0.0709 -0.0148 -0.0723 929  LYS   A CE  
3608 N  NZ  . LYS   A 239 ? 0.3114 0.9304 1.0295 -0.0625 -0.0147 -0.0727 929  LYS   A NZ  
3622 N  N   . GLY   A 240 ? 0.099  0.4951 0.7747 -0.0581 -0.0169 -0.0656 930  GLY   A N   
3623 C  CA  . GLY   A 240 ? 0.0929 0.4731 0.7671 -0.0438 -0.0176 -0.0614 930  GLY   A CA  
3624 C  C   . GLY   A 240 ? 0.085  0.453  0.7429 -0.0299 -0.0171 -0.0565 930  GLY   A C   
3625 O  O   . GLY   A 240 ? 0.0926 0.447  0.7443 -0.0198 -0.018  -0.0532 930  GLY   A O   
3629 N  N   . GLU   A 241 ? 0.0723 0.4397 0.7164 -0.0298 -0.0156 -0.0559 931  GLU   A N   
3630 C  CA  . GLU   A 241 ? 0.0692 0.4182 0.6903 -0.0174 -0.0154 -0.0516 931  GLU   A CA  
3631 C  C   . GLU   A 241 ? 0.0693 0.3712 0.6619 -0.0157 -0.0134 -0.0456 931  GLU   A C   
3632 O  O   . GLU   A 241 ? 0.0691 0.365  0.6642 -0.0234 -0.0113 -0.0452 931  GLU   A O   
3633 C  CB  . GLU   A 241 ? 0.067  0.4724 0.7177 -0.0174 -0.016  -0.0537 931  GLU   A CB  
3634 C  CG  . GLU   A 241 ? 0.0883 0.5554 0.7773 -0.0151 -0.0192 -0.0591 931  GLU   A CG  
3635 C  CD  . GLU   A 241 ? 0.1499 0.6527 0.8424 -0.0123 -0.0188 -0.0611 931  GLU   A CD  
3636 O  OE1 . GLU   A 241 ? 0.159  0.69   0.8566 -0.0167 -0.02   -0.0665 931  GLU   A OE1 
3637 O  OE2 . GLU   A 241 ? 0.1733 0.6776 0.863  -0.0052 -0.0174 -0.0571 931  GLU   A OE2 
3644 N  N   . ARG   A 242 ? 0.0679 0.3352 0.6313 -0.0067 -0.0142 -0.0411 932  ARG   A N   
3645 C  CA  . ARG   A 242 ? 0.0758 0.3203 0.6325 -0.0064 -0.0136 -0.0355 932  ARG   A CA  
3646 C  C   . ARG   A 242 ? 0.0796 0.3206 0.6284 0.0003  -0.0152 -0.0318 932  ARG   A C   
3647 O  O   . ARG   A 242 ? 0.0766 0.3298 0.6227 0.0062  -0.0166 -0.0333 932  ARG   A O   
3648 C  CB  . ARG   A 242 ? 0.0838 0.3078 0.6376 -0.0067 -0.014  -0.0328 932  ARG   A CB  
3649 C  CG  . ARG   A 242 ? 0.0897 0.3278 0.6641 -0.0127 -0.0129 -0.0359 932  ARG   A CG  
3650 C  CD  . ARG   A 242 ? 0.0988 0.3525 0.697  -0.0203 -0.011  -0.0354 932  ARG   A CD  
3651 N  NE  . ARG   A 242 ? 0.1087 0.3851 0.7372 -0.0283 -0.0105 -0.0382 932  ARG   A NE  
3652 C  CZ  . ARG   A 242 ? 0.1098 0.4154 0.7611 -0.0388 -0.0106 -0.0438 932  ARG   A CZ  
3653 N  NH1 . ARG   A 242 ? 0.0925 0.4008 0.7293 -0.0396 -0.0108 -0.0473 932  ARG   A NH1 
3654 N  NH2 . ARG   A 242 ? 0.1208 0.4195 0.774  -0.0446 -0.0101 -0.046  932  ARG   A NH2 
3668 N  N   . LEU   A 243 ? 0.0838 0.3018 0.6218 0.0002  -0.0151 -0.0271 933  LEU   A N   
3669 C  CA  . LEU   A 243 ? 0.0864 0.2965 0.614  0.0055  -0.017  -0.0235 933  LEU   A CA  
3670 C  C   . LEU   A 243 ? 0.0932 0.2999 0.6177 0.0094  -0.0198 -0.0221 933  LEU   A C   
3671 O  O   . LEU   A 243 ? 0.0999 0.3064 0.6323 0.007   -0.0201 -0.0216 933  LEU   A O   
3672 C  CB  . LEU   A 243 ? 0.0917 0.2819 0.6135 0.0035  -0.017  -0.019  933  LEU   A CB  
3673 C  CG  . LEU   A 243 ? 0.0918 0.2903 0.6208 0.001   -0.0144 -0.0194 933  LEU   A CG  
3674 C  CD1 . LEU   A 243 ? 0.0987 0.2797 0.6264 -0.0011 -0.0145 -0.0151 933  LEU   A CD1 
3675 C  CD2 . LEU   A 243 ? 0.0865 0.3012 0.6138 0.0061  -0.0142 -0.0199 933  LEU   A CD2 
3687 N  N   . PRO   A 244 ? 0.0916 0.3003 0.607  0.0162  -0.0217 -0.0215 934  PRO   A N   
3688 C  CA  . PRO   A 244 ? 0.0947 0.2993 0.6053 0.0196  -0.0241 -0.0203 934  PRO   A CA  
3689 C  C   . PRO   A 244 ? 0.1027 0.287  0.6086 0.0155  -0.0261 -0.0146 934  PRO   A C   
3690 O  O   . PRO   A 244 ? 0.104  0.2764 0.6082 0.0118  -0.0263 -0.0116 934  PRO   A O   
3691 C  CB  . PRO   A 244 ? 0.0959 0.323  0.6113 0.0316  -0.0262 -0.0212 934  PRO   A CB  
3692 C  CG  . PRO   A 244 ? 0.0978 0.3316 0.6188 0.0336  -0.026  -0.0199 934  PRO   A CG  
3693 C  CD  . PRO   A 244 ? 0.0857 0.304  0.5964 0.0226  -0.0219 -0.0218 934  PRO   A CD  
3701 N  N   . GLN   A 245 ? 0.1067 0.2911 0.6127 0.0164  -0.0277 -0.0131 935  GLN   A N   
3702 C  CA  . GLN   A 245 ? 0.1158 0.2957 0.6278 0.0122  -0.0304 -0.0071 935  GLN   A CA  
3703 C  C   . GLN   A 245 ? 0.1261 0.3136 0.6468 0.0157  -0.0352 -0.0038 935  GLN   A C   
3704 O  O   . GLN   A 245 ? 0.1252 0.3161 0.6404 0.0244  -0.0374 -0.0046 935  GLN   A O   
3705 C  CB  . GLN   A 245 ? 0.1189 0.3094 0.6384 0.0129  -0.0314 -0.006  935  GLN   A CB  
3706 C  CG  . GLN   A 245 ? 0.1327 0.3442 0.6807 0.0061  -0.0351 0.0007  935  GLN   A CG  
3707 C  CD  . GLN   A 245 ? 0.1446 0.397  0.729  0.0062  -0.0369 0.0024  935  GLN   A CD  
3708 O  OE1 . GLN   A 245 ? 0.1572 0.4172 0.7419 0.0145  -0.0357 -0.0015 935  GLN   A OE1 
3709 N  NE2 . GLN   A 245 ? 0.1414 0.3797 0.7141 -0.0037 -0.0371 0.0083  935  GLN   A NE2 
3718 N  N   . PRO   A 246 ? 0.1351 0.3277 0.6703 0.0109  -0.0379 -0.0001 936  PRO   A N   
3719 C  CA  . PRO   A 246 ? 0.1424 0.3359 0.6794 0.0143  -0.0438 0.0029  936  PRO   A CA  
3720 C  C   . PRO   A 246 ? 0.1602 0.3414 0.6845 0.0118  -0.0479 0.0066  936  PRO   A C   
3721 O  O   . PRO   A 246 ? 0.1585 0.346  0.692  0.002   -0.0478 0.0093  936  PRO   A O   
3722 C  CB  . PRO   A 246 ? 0.1448 0.3414 0.6948 0.0055  -0.0458 0.006   936  PRO   A CB  
3723 C  CG  . PRO   A 246 ? 0.1463 0.3459 0.7018 0.003   -0.0399 0.0036  936  PRO   A CG  
3724 C  CD  . PRO   A 246 ? 0.1342 0.3184 0.6699 0.0032  -0.0357 0.0014  936  PRO   A CD  
3732 N  N   . PRO   A 247 ? 0.1799 0.3349 0.6732 0.0201  -0.0507 0.0069  937  PRO   A N   
3733 C  CA  . PRO   A 247 ? 0.1974 0.3278 0.6661 0.0158  -0.0535 0.0105  937  PRO   A CA  
3734 C  C   . PRO   A 247 ? 0.1982 0.3189 0.6654 -0.0036 -0.0567 0.0166  937  PRO   A C   
3735 O  O   . PRO   A 247 ? 0.2032 0.3159 0.6609 -0.0103 -0.0573 0.0197  937  PRO   A O   
3736 C  CB  . PRO   A 247 ? 0.2275 0.3249 0.6584 0.028   -0.0566 0.0102  937  PRO   A CB  
3737 C  CG  . PRO   A 247 ? 0.2249 0.3409 0.6653 0.0434  -0.0538 0.0053  937  PRO   A CG  
3738 C  CD  . PRO   A 247 ? 0.1809 0.3271 0.6576 0.035   -0.051  0.0042  937  PRO   A CD  
3746 N  N   . ILE   A 248 ? 0.1914 0.3143 0.6674 -0.0126 -0.0587 0.0187  938  ILE   A N   
3747 C  CA  . ILE   A 248 ? 0.1873 0.3069 0.6631 -0.0315 -0.0621 0.0245  938  ILE   A CA  
3748 C  C   . ILE   A 248 ? 0.169  0.3238 0.6775 -0.039  -0.0587 0.0259  938  ILE   A C   
3749 O  O   . ILE   A 248 ? 0.1619 0.3208 0.6712 -0.0536 -0.0607 0.0312  938  ILE   A O   
3750 C  CB  . ILE   A 248 ? 0.1952 0.3013 0.6628 -0.038  -0.0666 0.0264  938  ILE   A CB  
3751 C  CG1 . ILE   A 248 ? 0.1889 0.3206 0.6849 -0.0328 -0.0636 0.0235  938  ILE   A CG1 
3752 C  CG2 . ILE   A 248 ? 0.226  0.2917 0.6548 -0.0307 -0.0707 0.0258  938  ILE   A CG2 
3753 C  CD1 . ILE   A 248 ? 0.203  0.3355 0.7029 -0.044  -0.0674 0.0267  938  ILE   A CD1 
3765 N  N   . CYS   A 249 ? 0.1556 0.336  0.6893 -0.0295 -0.0538 0.0214  939  CYS   A N   
3766 C  CA  . CYS   A 249 ? 0.1401 0.3504 0.7011 -0.0334 -0.0505 0.0221  939  CYS   A CA  
3767 C  C   . CYS   A 249 ? 0.1363 0.3545 0.6986 -0.035  -0.0487 0.0236  939  CYS   A C   
3768 O  O   . CYS   A 249 ? 0.1317 0.3467 0.689  -0.0252 -0.0466 0.0199  939  CYS   A O   
3769 C  CB  . CYS   A 249 ? 0.1424 0.3582 0.7113 -0.0223 -0.0452 0.0166  939  CYS   A CB  
3770 S  SG  . CYS   A 249 ? 0.18   0.4068 0.7667 -0.0236 -0.0471 0.0159  939  CYS   A SG  
3776 N  N   . THR   A 250 ? 0.1264 0.3602 0.6981 -0.0459 -0.0488 0.0288  940  THR   A N   
3777 C  CA  . THR   A 250 ? 0.1271 0.3744 0.7045 -0.046  -0.046  0.0303  940  THR   A CA  
3778 C  C   . THR   A 250 ? 0.1237 0.3871 0.7173 -0.0341 -0.0408 0.0253  940  THR   A C   
3779 O  O   . THR   A 250 ? 0.125  0.3813 0.7172 -0.0287 -0.0393 0.022   940  THR   A O   
3780 C  CB  . THR   A 250 ? 0.1321 0.391  0.7103 -0.0611 -0.0475 0.0381  940  THR   A CB  
3781 O  OG1 . THR   A 250 ? 0.1208 0.4042 0.7189 -0.0638 -0.0472 0.0398  940  THR   A OG1 
3782 C  CG2 . THR   A 250 ? 0.1579 0.3894 0.7086 -0.0749 -0.0525 0.043   940  THR   A CG2 
3790 N  N   . ILE   A 251 ? 0.1217 0.3945 0.7186 -0.0297 -0.0376 0.0246  941  ILE   A N   
3791 C  CA  . ILE   A 251 ? 0.122  0.3943 0.7188 -0.0191 -0.0329 0.0194  941  ILE   A CA  
3792 C  C   . ILE   A 251 ? 0.1178 0.3944 0.7178 -0.019  -0.0311 0.0205  941  ILE   A C   
3793 O  O   . ILE   A 251 ? 0.1208 0.393  0.7217 -0.0125 -0.0286 0.0153  941  ILE   A O   
3794 C  CB  . ILE   A 251 ? 0.1222 0.4077 0.7248 -0.015  -0.0306 0.0187  941  ILE   A CB  
3795 C  CG1 . ILE   A 251 ? 0.1285 0.4205 0.739  -0.0053 -0.0274 0.0117  941  ILE   A CG1 
3796 C  CG2 . ILE   A 251 ? 0.1154 0.4214 0.7267 -0.0217 -0.0301 0.0259  941  ILE   A CG2 
3797 C  CD1 . ILE   A 251 ? 0.138  0.4275 0.7519 0.0004  -0.0278 0.0046  941  ILE   A CD1 
3809 N  N   . ASP   A 252 ? 0.1068 0.386  0.7008 -0.0259 -0.0321 0.0274  942  ASP   A N   
3810 C  CA  . ASP   A 252 ? 0.1014 0.3876 0.6974 -0.0237 -0.0305 0.0289  942  ASP   A CA  
3811 C  C   . ASP   A 252 ? 0.1017 0.3606 0.6813 -0.0212 -0.0307 0.026   942  ASP   A C   
3812 O  O   . ASP   A 252 ? 0.1029 0.3644 0.6867 -0.0158 -0.0285 0.0236  942  ASP   A O   
3813 C  CB  . ASP   A 252 ? 0.1068 0.4522 0.7452 -0.036  -0.0341 0.0371  942  ASP   A CB  
3814 C  CG  . ASP   A 252 ? 0.1836 0.5634 0.8425 -0.0398 -0.0332 0.0411  942  ASP   A CG  
3815 O  OD1 . ASP   A 252 ? 0.211  0.5756 0.8592 -0.0419 -0.0333 0.0402  942  ASP   A OD1 
3816 O  OD2 . ASP   A 252 ? 0.2166 0.6234 0.8852 -0.0384 -0.0314 0.0454  942  ASP   A OD2 
3821 N  N   . VAL   A 253 ? 0.1    0.3324 0.66   -0.0245 -0.0334 0.0265  943  VAL   A N   
3822 C  CA  . VAL   A 253 ? 0.1036 0.3208 0.658  -0.0226 -0.0339 0.0241  943  VAL   A CA  
3823 C  C   . VAL   A 253 ? 0.1089 0.3085 0.6553 -0.0149 -0.0304 0.0167  943  VAL   A C   
3824 O  O   . VAL   A 253 ? 0.1135 0.314  0.6659 -0.0125 -0.0288 0.0142  943  VAL   A O   
3825 C  CB  . VAL   A 253 ? 0.1096 0.3278 0.6682 -0.0303 -0.0395 0.0266  943  VAL   A CB  
3826 C  CG1 . VAL   A 253 ? 0.116  0.3268 0.6765 -0.0278 -0.0402 0.0239  943  VAL   A CG1 
3827 C  CG2 . VAL   A 253 ? 0.1059 0.3467 0.6757 -0.0428 -0.0441 0.0338  943  VAL   A CG2 
3837 N  N   . TYR   A 254 ? 0.1055 0.2886 0.636  -0.0118 -0.0291 0.0135  944  TYR   A N   
3838 C  CA  . TYR   A 254 ? 0.1085 0.2842 0.636  -0.007  -0.0265 0.0066  944  TYR   A CA  
3839 C  C   . TYR   A 254 ? 0.1055 0.288  0.6394 -0.0046 -0.0234 0.0035  944  TYR   A C   
3840 O  O   . TYR   A 254 ? 0.1044 0.2771 0.6335 -0.0031 -0.0214 -0.0008 944  TYR   A O   
3841 C  CB  . TYR   A 254 ? 0.1073 0.2749 0.6234 -0.0045 -0.0267 0.0039  944  TYR   A CB  
3842 C  CG  . TYR   A 254 ? 0.1087 0.2742 0.6224 -0.0006 -0.0247 -0.003  944  TYR   A CG  
3843 C  CD1 . TYR   A 254 ? 0.113  0.281  0.6322 0       -0.0249 -0.0049 944  TYR   A CD1 
3844 C  CD2 . TYR   A 254 ? 0.109  0.2852 0.6274 0.0022  -0.0235 -0.0073 944  TYR   A CD2 
3845 C  CE1 . TYR   A 254 ? 0.1146 0.2955 0.6421 0.0027  -0.0235 -0.0106 944  TYR   A CE1 
3846 C  CE2 . TYR   A 254 ? 0.1109 0.2995 0.6371 0.005   -0.0227 -0.0135 944  TYR   A CE2 
3847 C  CZ  . TYR   A 254 ? 0.1144 0.3099 0.6487 0.005   -0.0227 -0.0149 944  TYR   A CZ  
3848 O  OH  . TYR   A 254 ? 0.1166 0.3373 0.6679 0.0071  -0.0219 -0.0204 944  TYR   A OH  
3858 N  N   . MET   A 255 ? 0.1018 0.2981 0.6427 -0.0045 -0.0229 0.0062  945  MET   A N   
3859 C  CA  . MET   A 255 ? 0.1015 0.3088 0.6522 -0.0012 -0.0204 0.0034  945  MET   A CA  
3860 C  C   . MET   A 255 ? 0.0998 0.3044 0.6515 -0.0006 -0.0195 0.0042  945  MET   A C   
3861 O  O   . MET   A 255 ? 0.1005 0.3053 0.6557 0.0022  -0.0175 0.0002  945  MET   A O   
3862 C  CB  . MET   A 255 ? 0.1025 0.3386 0.671  0.0003  -0.0203 0.0067  945  MET   A CB  
3863 C  CG  . MET   A 255 ? 0.1153 0.3834 0.7123 0.0016  -0.0214 0.0047  945  MET   A CG  
3864 S  SD  . MET   A 255 ? 0.1667 0.4982 0.8322 0.0066  -0.0228 -0.0046 945  MET   A SD  
3865 C  CE  . MET   A 255 ? 0.1381 0.4546 0.7908 0.0104  -0.0196 -0.0083 945  MET   A CE  
3875 N  N   . ILE   A 256 ? 0.0972 0.2965 0.6432 -0.0032 -0.0212 0.0089  946  ILE   A N   
3876 C  CA  . ILE   A 256 ? 0.097  0.297  0.6464 -0.0019 -0.0206 0.0096  946  ILE   A CA  
3877 C  C   . ILE   A 256 ? 0.0979 0.2713 0.6326 -0.0018 -0.019  0.0043  946  ILE   A C   
3878 O  O   . ILE   A 256 ? 0.0975 0.2674 0.6331 0.0002  -0.0168 0.0017  946  ILE   A O   
3879 C  CB  . ILE   A 256 ? 0.1004 0.3201 0.6643 -0.0054 -0.0241 0.0156  946  ILE   A CB  
3880 C  CG1 . ILE   A 256 ? 0.0974 0.3539 0.6813 -0.0072 -0.0259 0.0217  946  ILE   A CG1 
3881 C  CG2 . ILE   A 256 ? 0.1056 0.3366 0.6838 -0.0028 -0.0237 0.0155  946  ILE   A CG2 
3882 C  CD1 . ILE   A 256 ? 0.1003 0.3805 0.7009 -0.0155 -0.031  0.0276  946  ILE   A CD1 
3894 N  N   . MET   A 257 ? 0.0971 0.2514 0.6167 -0.0036 -0.0199 0.0031  947  MET   A N   
3895 C  CA  . MET   A 257 ? 0.0989 0.24   0.612  -0.0035 -0.0184 -0.0013 947  MET   A CA  
3896 C  C   . MET   A 257 ? 0.0888 0.2166 0.5889 -0.0024 -0.0155 -0.007  947  MET   A C   
3897 O  O   . MET   A 257 ? 0.091  0.2205 0.5976 -0.0031 -0.0137 -0.0099 947  MET   A O   
3898 C  CB  . MET   A 257 ? 0.1101 0.2644 0.6355 -0.0045 -0.0208 -0.0016 947  MET   A CB  
3899 C  CG  . MET   A 257 ? 0.1315 0.3215 0.694  -0.0074 -0.0256 0.003   947  MET   A CG  
3900 S  SD  . MET   A 257 ? 0.1583 0.4135 0.783  -0.0085 -0.0318 0.0021  947  MET   A SD  
3901 C  CE  . MET   A 257 ? 0.1452 0.384  0.7508 -0.0132 -0.0359 0.0081  947  MET   A CE  
3911 N  N   A ARG   A 258 ? 0.0805 0.2012 0.5679 -0.0015 -0.0153 -0.0086 948  ARG   A N   
3912 N  N   B ARG   A 258 ? 0.0843 0.2117 0.5785 -0.0016 -0.0155 -0.0086 948  ARG   A N   
3913 C  CA  A ARG   A 258 ? 0.0765 0.1971 0.5627 -0.0012 -0.0136 -0.0144 948  ARG   A CA  
3914 C  CA  B ARG   A 258 ? 0.084  0.2181 0.5838 -0.0014 -0.014  -0.0144 948  ARG   A CA  
3915 C  C   A ARG   A 258 ? 0.0777 0.2092 0.578  -0.0005 -0.0124 -0.0154 948  ARG   A C   
3916 C  C   B ARG   A 258 ? 0.0816 0.2188 0.588  -0.0006 -0.0125 -0.0153 948  ARG   A C   
3917 O  O   A ARG   A 258 ? 0.0754 0.2044 0.5756 -0.0016 -0.011  -0.0204 948  ARG   A O   
3918 O  O   B ARG   A 258 ? 0.08   0.2143 0.5864 -0.0019 -0.011  -0.0201 948  ARG   A O   
3919 C  CB  A ARG   A 258 ? 0.0719 0.1918 0.5497 -0.0002 -0.0143 -0.0159 948  ARG   A CB  
3920 C  CB  B ARG   A 258 ? 0.0891 0.2416 0.5996 -0.0003 -0.0151 -0.016  948  ARG   A CB  
3921 C  CG  A ARG   A 258 ? 0.0721 0.1882 0.5412 0       -0.0155 -0.0162 948  ARG   A CG  
3922 C  CG  B ARG   A 258 ? 0.1064 0.2945 0.6469 -0.0004 -0.0171 -0.0188 948  ARG   A CG  
3923 C  CD  A ARG   A 258 ? 0.067  0.1818 0.5313 -0.0003 -0.0147 -0.0214 948  ARG   A CD  
3924 C  CD  B ARG   A 258 ? 0.1165 0.3404 0.6897 -0.0024 -0.0167 -0.0252 948  ARG   A CD  
3925 N  NE  A ARG   A 258 ? 0.0593 0.1788 0.5233 -0.0006 -0.0136 -0.0273 948  ARG   A NE  
3926 N  NE  B ARG   A 258 ? 0.1237 0.3773 0.7256 -0.004  -0.0164 -0.0298 948  ARG   A NE  
3927 C  CZ  A ARG   A 258 ? 0.0531 0.1769 0.5104 0.0006  -0.0141 -0.0312 948  ARG   A CZ  
3928 C  CZ  B ARG   A 258 ? 0.1265 0.3871 0.7417 -0.008  -0.015  -0.032  948  ARG   A CZ  
3929 N  NH1 A ARG   A 258 ? 0.0491 0.1664 0.4923 0.0026  -0.0151 -0.0299 948  ARG   A NH1 
3930 N  NH1 B ARG   A 258 ? 0.1184 0.3791 0.732  -0.009  -0.0146 -0.0365 948  ARG   A NH1 
3931 N  NH2 A ARG   A 258 ? 0.0398 0.1518 0.4809 -0.0002 -0.013  -0.0367 948  ARG   A NH2 
3932 N  NH2 B ARG   A 258 ? 0.1218 0.3605 0.7229 -0.0099 -0.0133 -0.0296 948  ARG   A NH2 
3959 N  N   . LYS   A 259 ? 0.0801 0.2181 0.585  0.0014  -0.0127 -0.0105 949  LYS   A N   
3960 C  CA  . LYS   A 259 ? 0.082  0.2373 0.605  0.0045  -0.0115 -0.011  949  LYS   A CA  
3961 C  C   . LYS   A 259 ? 0.0858 0.2397 0.6163 0.0032  -0.0103 -0.0118 949  LYS   A C   
3962 O  O   . LYS   A 259 ? 0.0884 0.2495 0.6304 0.0042  -0.0087 -0.015  949  LYS   A O   
3963 C  CB  . LYS   A 259 ? 0.0925 0.2909 0.6481 0.0104  -0.0126 -0.0052 949  LYS   A CB  
3964 C  CG  . LYS   A 259 ? 0.1199 0.39   0.7381 0.0166  -0.0142 -0.0049 949  LYS   A CG  
3965 C  CD  . LYS   A 259 ? 0.1487 0.478  0.8114 0.0245  -0.0156 0.0019  949  LYS   A CD  
3966 C  CE  . LYS   A 259 ? 0.2047 0.5451 0.8697 0.027   -0.0154 0.0021  949  LYS   A CE  
3967 N  NZ  . LYS   A 259 ? 0.2435 0.6052 0.9115 0.0322  -0.0152 0.0091  949  LYS   A NZ  
3982 N  N   . CYS   A 260 ? 0.0861 0.2295 0.609  0.0011  -0.0111 -0.0092 950  CYS   A N   
3983 C  CA  . CYS   A 260 ? 0.0899 0.2319 0.6192 -0.0003 -0.0098 -0.0097 950  CYS   A CA  
3984 C  C   . CYS   A 260 ? 0.0909 0.2335 0.6253 -0.0044 -0.008  -0.0153 950  CYS   A C   
3985 O  O   . CYS   A 260 ? 0.0917 0.2332 0.6311 -0.0064 -0.0059 -0.0163 950  CYS   A O   
3986 C  CB  . CYS   A 260 ? 0.0975 0.2403 0.6281 -0.0013 -0.0116 -0.0058 950  CYS   A CB  
3987 S  SG  . CYS   A 260 ? 0.098  0.2406 0.6203 0.0012  -0.0139 0.0011  950  CYS   A SG  
3993 N  N   . TRP   A 261 ? 0.0878 0.2312 0.618  -0.0062 -0.0086 -0.0186 951  TRP   A N   
3994 C  CA  . TRP   A 261 ? 0.0892 0.2505 0.636  -0.012  -0.0074 -0.0238 951  TRP   A CA  
3995 C  C   . TRP   A 261 ? 0.0986 0.2955 0.6791 -0.0162 -0.0076 -0.0288 951  TRP   A C   
3996 O  O   . TRP   A 261 ? 0.0998 0.3186 0.6952 -0.0218 -0.0081 -0.0332 951  TRP   A O   
3997 C  CB  . TRP   A 261 ? 0.0803 0.2279 0.605  -0.0111 -0.0082 -0.0244 951  TRP   A CB  
3998 C  CG  . TRP   A 261 ? 0.079  0.2076 0.5861 -0.0082 -0.009  -0.0196 951  TRP   A CG  
3999 C  CD1 . TRP   A 261 ? 0.083  0.2088 0.5938 -0.0087 -0.0082 -0.0168 951  TRP   A CD1 
4000 C  CD2 . TRP   A 261 ? 0.0783 0.1986 0.5715 -0.0057 -0.0111 -0.0176 951  TRP   A CD2 
4001 N  NE1 . TRP   A 261 ? 0.0866 0.2091 0.5928 -0.0069 -0.0102 -0.0132 951  TRP   A NE1 
4002 C  CE2 . TRP   A 261 ? 0.0842 0.2029 0.5794 -0.0053 -0.0119 -0.0137 951  TRP   A CE2 
4003 C  CE3 . TRP   A 261 ? 0.0788 0.2066 0.5715 -0.0045 -0.0127 -0.0188 951  TRP   A CE3 
4004 C  CZ2 . TRP   A 261 ? 0.0887 0.2112 0.5842 -0.004  -0.0145 -0.0111 951  TRP   A CZ2 
4005 C  CZ3 . TRP   A 261 ? 0.0855 0.2219 0.5832 -0.003  -0.015  -0.016  951  TRP   A CZ3 
4006 C  CH2 . TRP   A 261 ? 0.0891 0.2177 0.5836 -0.0028 -0.016  -0.0122 951  TRP   A CH2 
4017 N  N   . MET   A 262 ? 0.1029 0.3075 0.6954 -0.0133 -0.0073 -0.0283 952  MET   A N   
4018 C  CA  . MET   A 262 ? 0.1076 0.3353 0.7223 -0.0164 -0.0076 -0.0332 952  MET   A CA  
4019 C  C   . MET   A 262 ? 0.1317 0.3507 0.7436 -0.0276 -0.0054 -0.0372 952  MET   A C   
4020 O  O   . MET   A 262 ? 0.1449 0.3502 0.7498 -0.0291 -0.0033 -0.0348 952  MET   A O   
4021 C  CB  . MET   A 262 ? 0.1131 0.3443 0.7308 -0.0051 -0.0078 -0.031  952  MET   A CB  
4022 C  CG  . MET   A 262 ? 0.1317 0.3837 0.7614 0.0021  -0.0099 -0.0282 952  MET   A CG  
4023 S  SD  . MET   A 262 ? 0.2379 0.4884 0.8601 0.0172  -0.0093 -0.0234 952  MET   A SD  
4024 C  CE  . MET   A 262 ? 0.2167 0.4565 0.826  0.0201  -0.0092 -0.0295 952  MET   A CE  
4034 N  N   . ILE   A 263 ? 0.1411 0.357  0.7469 -0.0354 -0.006  -0.0432 953  ILE   A N   
4035 C  CA  . ILE   A 263 ? 0.161  0.3566 0.7506 -0.0489 -0.0042 -0.0473 953  ILE   A CA  
4036 C  C   . ILE   A 263 ? 0.1882 0.3483 0.7534 -0.0429 -0.002  -0.0456 953  ILE   A C   
4037 O  O   . ILE   A 263 ? 0.2022 0.3438 0.7557 -0.0496 0.0006  -0.0447 953  ILE   A O   
4038 C  CB  . ILE   A 263 ? 0.1685 0.3683 0.7547 -0.0588 -0.0062 -0.0543 953  ILE   A CB  
4039 C  CG1 . ILE   A 263 ? 0.1606 0.3978 0.7691 -0.0636 -0.0082 -0.0562 953  ILE   A CG1 
4040 C  CG2 . ILE   A 263 ? 0.1916 0.3647 0.7555 -0.0751 -0.0048 -0.0585 953  ILE   A CG2 
4041 C  CD1 . ILE   A 263 ? 0.1704 0.4248 0.7891 -0.0736 -0.0067 -0.0553 953  ILE   A CD1 
4053 N  N   . ASP   A 264 ? 0.1904 0.3418 0.7469 -0.0288 -0.0029 -0.0449 954  ASP   A N   
4054 C  CA  . ASP   A 264 ? 0.2141 0.3328 0.7448 -0.0191 -0.0009 -0.0432 954  ASP   A CA  
4055 C  C   . ASP   A 264 ? 0.2144 0.3386 0.7516 -0.009  0.0005  -0.0365 954  ASP   A C   
4056 O  O   . ASP   A 264 ? 0.2074 0.3548 0.7607 0.0019  -0.0009 -0.0324 954  ASP   A O   
4057 C  CB  . ASP   A 264 ? 0.2417 0.3529 0.7602 -0.0051 -0.0022 -0.0442 954  ASP   A CB  
4058 C  CG  . ASP   A 264 ? 0.3203 0.3964 0.8075 0.0079  -0.0002 -0.0428 954  ASP   A CG  
4059 O  OD1 . ASP   A 264 ? 0.3522 0.3963 0.8168 0.0001  0.0019  -0.0444 954  ASP   A OD1 
4060 O  OD2 . ASP   A 264 ? 0.3463 0.4271 0.8299 0.0264  -0.0004 -0.0399 954  ASP   A OD2 
4065 N  N   . ALA   A 265 ? 0.2238 0.3267 0.7475 -0.0137 0.0032  -0.0354 955  ALA   A N   
4066 C  CA  . ALA   A 265 ? 0.2267 0.3324 0.7541 -0.0047 0.0045  -0.0295 955  ALA   A CA  
4067 C  C   . ALA   A 265 ? 0.2272 0.3357 0.7499 0.016   0.0039  -0.0253 955  ALA   A C   
4068 O  O   . ALA   A 265 ? 0.2125 0.3443 0.7523 0.0226  0.0027  -0.0203 955  ALA   A O   
4069 C  CB  . ALA   A 265 ? 0.248  0.3226 0.754  -0.0113 0.0079  -0.0296 955  ALA   A CB  
4075 N  N   . ASP   A 266 ? 0.2428 0.3285 0.7411 0.0261  0.0046  -0.0271 956  ASP   A N   
4076 C  CA  . ASP   A 266 ? 0.25   0.3416 0.7419 0.0478  0.0044  -0.0229 956  ASP   A CA  
4077 C  C   . ASP   A 266 ? 0.2221 0.3531 0.7402 0.0528  0.0017  -0.0204 956  ASP   A C   
4078 O  O   . ASP   A 266 ? 0.2203 0.3703 0.7437 0.067   0.0013  -0.0151 956  ASP   A O   
4079 C  CB  . ASP   A 266 ? 0.3128 0.368  0.7682 0.059   0.0058  -0.0258 956  ASP   A CB  
4080 C  CG  . ASP   A 266 ? 0.4245 0.4349 0.8458 0.0587  0.0089  -0.027  956  ASP   A CG  
4081 O  OD1 . ASP   A 266 ? 0.4404 0.4496 0.8681 0.0492  0.0102  -0.0254 956  ASP   A OD1 
4082 O  OD2 . ASP   A 266 ? 0.4849 0.4589 0.8704 0.0684  0.0099  -0.0294 956  ASP   A OD2 
4087 N  N   . SER   A 267 ? 0.2016 0.3455 0.7346 0.0413  -0.0001 -0.024  957  SER   A N   
4088 C  CA  . SER   A 267 ? 0.1771 0.355  0.7327 0.0446  -0.0024 -0.0216 957  SER   A CA  
4089 C  C   . SER   A 267 ? 0.157  0.3632 0.7381 0.0396  -0.004  -0.0167 957  SER   A C   
4090 O  O   . SER   A 267 ? 0.1483 0.3807 0.7448 0.043   -0.0057 -0.0132 957  SER   A O   
4091 C  CB  . SER   A 267 ? 0.185  0.3651 0.7452 0.0352  -0.0038 -0.0272 957  SER   A CB  
4092 O  OG  . SER   A 267 ? 0.2236 0.3787 0.7595 0.0406  -0.0032 -0.0315 957  SER   A OG  
4098 N  N   . ARG   A 268 ? 0.1478 0.3472 0.731  0.0314  -0.0034 -0.0163 958  ARG   A N   
4099 C  CA  . ARG   A 268 ? 0.1287 0.3492 0.7311 0.027   -0.0053 -0.0121 958  ARG   A CA  
4100 C  C   . ARG   A 268 ? 0.139  0.3738 0.7434 0.0387  -0.0061 -0.0057 958  ARG   A C   
4101 O  O   . ARG   A 268 ? 0.1562 0.3797 0.7443 0.0508  -0.0043 -0.0047 958  ARG   A O   
4102 C  CB  . ARG   A 268 ? 0.1263 0.3339 0.7271 0.0174  -0.0041 -0.0132 958  ARG   A CB  
4103 C  CG  . ARG   A 268 ? 0.1259 0.3294 0.7293 0.0039  -0.0036 -0.0187 958  ARG   A CG  
4104 C  CD  . ARG   A 268 ? 0.1505 0.3394 0.7477 -0.005  -0.0013 -0.0197 958  ARG   A CD  
4105 N  NE  . ARG   A 268 ? 0.1541 0.3374 0.7482 -0.0178 -0.0002 -0.0253 958  ARG   A NE  
4106 C  CZ  . ARG   A 268 ? 0.1774 0.3443 0.7608 -0.0281 0.0026  -0.0273 958  ARG   A CZ  
4107 N  NH1 . ARG   A 268 ? 0.1752 0.342  0.7567 -0.0413 0.0031  -0.0323 958  ARG   A NH1 
4108 N  NH2 . ARG   A 268 ? 0.1842 0.336  0.7583 -0.026  0.0049  -0.0241 958  ARG   A NH2 
4122 N  N   . PRO   A 269 ? 0.1261 0.3852 0.7477 0.0358  -0.009  -0.0011 959  PRO   A N   
4123 C  CA  . PRO   A 269 ? 0.1224 0.3985 0.7459 0.0449  -0.0101 0.0051  959  PRO   A CA  
4124 C  C   . PRO   A 269 ? 0.1313 0.3932 0.7437 0.0499  -0.0088 0.0062  959  PRO   A C   
4125 O  O   . PRO   A 269 ? 0.1391 0.3814 0.7469 0.0427  -0.0077 0.0033  959  PRO   A O   
4126 C  CB  . PRO   A 269 ? 0.1178 0.4167 0.759  0.0357  -0.0138 0.0089  959  PRO   A CB  
4127 C  CG  . PRO   A 269 ? 0.122  0.4141 0.7663 0.0259  -0.0142 0.0048  959  PRO   A CG  
4128 C  CD  . PRO   A 269 ? 0.1183 0.3755 0.7416 0.023   -0.0113 -0.0012 959  PRO   A CD  
4136 N  N   . LYS   A 270 ? 0.1251 0.3984 0.7324 0.0627  -0.0089 0.0105  960  LYS   A N   
4137 C  CA  . LYS   A 270 ? 0.1332 0.3954 0.7291 0.0697  -0.008  0.0121  960  LYS   A CA  
4138 C  C   . LYS   A 270 ? 0.1148 0.399  0.7265 0.0628  -0.012  0.0165  960  LYS   A C   
4139 O  O   . LYS   A 270 ? 0.1033 0.4137 0.7306 0.0568  -0.0152 0.0196  960  LYS   A O   
4140 C  CB  . LYS   A 270 ? 0.1726 0.4375 0.7523 0.09    -0.0062 0.0145  960  LYS   A CB  
4141 C  CG  . LYS   A 270 ? 0.2505 0.4935 0.811  0.0989  -0.0029 0.0105  960  LYS   A CG  
4142 C  CD  . LYS   A 270 ? 0.3335 0.5314 0.8714 0.0953  0.0002  0.0048  960  LYS   A CD  
4143 C  CE  . LYS   A 270 ? 0.3979 0.5758 0.9199 0.0982  0.002   0.0002  960  LYS   A CE  
4144 N  NZ  . LYS   A 270 ? 0.4205 0.6061 0.9603 0.0814  0.0005  -0.0034 960  LYS   A NZ  
4158 N  N   . PHE   A 271 ? 0.1127 0.3851 0.7184 0.0631  -0.012  0.0171  961  PHE   A N   
4159 C  CA  . PHE   A 271 ? 0.1048 0.3957 0.7226 0.0568  -0.0164 0.021   961  PHE   A CA  
4160 C  C   . PHE   A 271 ? 0.1031 0.4295 0.7284 0.0633  -0.0196 0.0267  961  PHE   A C   
4161 O  O   . PHE   A 271 ? 0.0937 0.4406 0.7319 0.0527  -0.0241 0.0299  961  PHE   A O   
4162 C  CB  . PHE   A 271 ? 0.1054 0.3767 0.7134 0.0575  -0.0158 0.0206  961  PHE   A CB  
4163 C  CG  . PHE   A 271 ? 0.1129 0.3562 0.7164 0.0463  -0.0135 0.0162  961  PHE   A CG  
4164 C  CD1 . PHE   A 271 ? 0.1167 0.3566 0.724  0.0321  -0.0158 0.0153  961  PHE   A CD1 
4165 C  CD2 . PHE   A 271 ? 0.1313 0.3478 0.7205 0.0501  -0.0088 0.0132  961  PHE   A CD2 
4166 C  CE1 . PHE   A 271 ? 0.1259 0.3598 0.7436 0.0255  -0.0138 0.0116  961  PHE   A CE1 
4167 C  CE2 . PHE   A 271 ? 0.1441 0.3426 0.7324 0.0389  -0.0065 0.0096  961  PHE   A CE2 
4168 C  CZ  . PHE   A 271 ? 0.1332 0.3431 0.737  0.0274  -0.009  0.0089  961  PHE   A CZ  
4178 N  N   . ARG   A 272 ? 0.1112 0.4447 0.7262 0.0803  -0.0172 0.0281  962  ARG   A N   
4179 C  CA  . ARG   A 272 ? 0.1068 0.4808 0.7299 0.0873  -0.0196 0.0339  962  ARG   A CA  
4180 C  C   . ARG   A 272 ? 0.0904 0.4878 0.7298 0.0763  -0.0215 0.0358  962  ARG   A C   
4181 O  O   . ARG   A 272 ? 0.0797 0.5092 0.7322 0.0684  -0.0256 0.0408  962  ARG   A O   
4182 C  CB  . ARG   A 272 ? 0.1465 0.5226 0.752  0.1112  -0.016  0.0349  962  ARG   A CB  
4183 C  CG  . ARG   A 272 ? 0.2219 0.5797 0.8152 0.1197  -0.0118 0.0314  962  ARG   A CG  
4184 C  CD  . ARG   A 272 ? 0.3016 0.6494 0.8695 0.1449  -0.0082 0.0316  962  ARG   A CD  
4185 N  NE  . ARG   A 272 ? 0.3625 0.702  0.9189 0.155   -0.0052 0.0296  962  ARG   A NE  
4186 C  CZ  . ARG   A 272 ? 0.4138 0.71   0.9496 0.1565  -0.002  0.0237  962  ARG   A CZ  
4187 N  NH1 . ARG   A 272 ? 0.4259 0.6833 0.9505 0.1478  -0.0007 0.0194  962  ARG   A NH1 
4188 N  NH2 . ARG   A 272 ? 0.4186 0.7106 0.9438 0.1662  0       0.0223  962  ARG   A NH2 
4202 N  N   . GLU   A 273 ? 0.085  0.4643 0.7217 0.0739  -0.0187 0.0317  963  GLU   A N   
4203 C  CA  . GLU   A 273 ? 0.0775 0.4655 0.7179 0.0635  -0.0194 0.0329  963  GLU   A CA  
4204 C  C   . GLU   A 273 ? 0.077  0.4526 0.7176 0.0426  -0.0229 0.0332  963  GLU   A C   
4205 O  O   . GLU   A 273 ? 0.0737 0.4715 0.725  0.0341  -0.0254 0.0369  963  GLU   A O   
4206 C  CB  . GLU   A 273 ? 0.1101 0.4859 0.7523 0.0691  -0.016  0.0277  963  GLU   A CB  
4207 C  CG  . GLU   A 273 ? 0.1784 0.5511 0.8046 0.0894  -0.0123 0.0273  963  GLU   A CG  
4208 C  CD  . GLU   A 273 ? 0.2649 0.6079 0.8785 0.0921  -0.0092 0.021   963  GLU   A CD  
4209 O  OE1 . GLU   A 273 ? 0.269  0.5882 0.8833 0.0797  -0.0092 0.016   963  GLU   A OE1 
4210 O  OE2 . GLU   A 273 ? 0.3159 0.6604 0.9179 0.1072  -0.0069 0.021   963  GLU   A OE2 
4217 N  N   . LEU   A 274 ? 0.0803 0.4147 0.7023 0.0349  -0.0228 0.0294  964  LEU   A N   
4218 C  CA  . LEU   A 274 ? 0.0813 0.3921 0.6919 0.0192  -0.0256 0.0293  964  LEU   A CA  
4219 C  C   . LEU   A 274 ? 0.0724 0.3983 0.6828 0.0132  -0.0301 0.0348  964  LEU   A C   
4220 O  O   . LEU   A 274 ? 0.0684 0.392  0.6749 0.0019  -0.0333 0.0372  964  LEU   A O   
4221 C  CB  . LEU   A 274 ? 0.0907 0.3661 0.6902 0.0164  -0.024  0.0241  964  LEU   A CB  
4222 C  CG  . LEU   A 274 ? 0.1003 0.3684 0.7074 0.0188  -0.0205 0.0183  964  LEU   A CG  
4223 C  CD1 . LEU   A 274 ? 0.1091 0.3588 0.7154 0.0177  -0.0187 0.0144  964  LEU   A CD1 
4224 C  CD2 . LEU   A 274 ? 0.1064 0.3757 0.7185 0.0116  -0.0215 0.0169  964  LEU   A CD2 
4236 N  N   . ILE   A 275 ? 0.068  0.4132 0.6841 0.0215  -0.0309 0.0371  965  ILE   A N   
4237 C  CA  . ILE   A 275 ? 0.0631 0.4451 0.6957 0.0168  -0.0366 0.0426  965  ILE   A CA  
4238 C  C   . ILE   A 275 ? 0.0542 0.4763 0.703  0.0104  -0.039  0.0479  965  ILE   A C   
4239 O  O   . ILE   A 275 ? 0.0526 0.4869 0.71   -0.005  -0.0441 0.0509  965  ILE   A O   
4240 C  CB  . ILE   A 275 ? 0.0589 0.4678 0.7011 0.0319  -0.0368 0.0443  965  ILE   A CB  
4241 C  CG1 . ILE   A 275 ? 0.0743 0.4603 0.7151 0.0371  -0.0361 0.0404  965  ILE   A CG1 
4242 C  CG2 . ILE   A 275 ? 0.0459 0.4918 0.6943 0.0263  -0.0424 0.0506  965  ILE   A CG2 
4243 C  CD1 . ILE   A 275 ? 0.0788 0.4813 0.7216 0.0576  -0.0345 0.0413  965  ILE   A CD1 
4255 N  N   . ILE   A 276 ? 0.0502 0.4909 0.7033 0.0217  -0.0352 0.0487  966  ILE   A N   
4256 C  CA  . ILE   A 276 ? 0.0442 0.5225 0.709  0.018   -0.036  0.0541  966  ILE   A CA  
4257 C  C   . ILE   A 276 ? 0.0487 0.5097 0.71   0.0024  -0.0368 0.0537  966  ILE   A C   
4258 O  O   . ILE   A 276 ? 0.044  0.5263 0.7116 -0.0118 -0.0406 0.059   966  ILE   A O   
4259 C  CB  . ILE   A 276 ? 0.0485 0.5525 0.7216 0.0387  -0.0313 0.0544  966  ILE   A CB  
4260 C  CG1 . ILE   A 276 ? 0.0494 0.5891 0.7316 0.056   -0.0319 0.0574  966  ILE   A CG1 
4261 C  CG2 . ILE   A 276 ? 0.0456 0.5862 0.7333 0.0353  -0.0309 0.0592  966  ILE   A CG2 
4262 C  CD1 . ILE   A 276 ? 0.0678 0.6075 0.7399 0.0821  -0.0265 0.0559  966  ILE   A CD1 
4274 N  N   . GLU   A 277 ? 0.061  0.48   0.7065 0.005   -0.033  0.0478  967  GLU   A N   
4275 C  CA  . GLU   A 277 ? 0.0662 0.4648 0.7032 -0.0055 -0.0332 0.0469  967  GLU   A CA  
4276 C  C   . GLU   A 277 ? 0.0642 0.4377 0.6856 -0.0202 -0.0376 0.0481  967  GLU   A C   
4277 O  O   . GLU   A 277 ? 0.059  0.4423 0.682  -0.0317 -0.0402 0.0521  967  GLU   A O   
4278 C  CB  . GLU   A 277 ? 0.0982 0.4983 0.76   0.0016  -0.0306 0.0397  967  GLU   A CB  
4279 C  CG  . GLU   A 277 ? 0.1625 0.5761 0.8477 -0.0064 -0.0318 0.0381  967  GLU   A CG  
4280 C  CD  . GLU   A 277 ? 0.2238 0.6504 0.9116 0.0001  -0.0284 0.0385  967  GLU   A CD  
4281 O  OE1 . GLU   A 277 ? 0.2053 0.6146 0.8903 0.0033  -0.0262 0.0332  967  GLU   A OE1 
4282 O  OE2 . GLU   A 277 ? 0.2398 0.6959 0.9325 0.0026  -0.0281 0.0442  967  GLU   A OE2 
4289 N  N   . PHE   A 278 ? 0.0688 0.4154 0.6788 -0.0198 -0.0388 0.0452  968  PHE   A N   
4290 C  CA  . PHE   A 278 ? 0.0749 0.4145 0.6862 -0.0325 -0.0444 0.0462  968  PHE   A CA  
4291 C  C   . PHE   A 278 ? 0.0662 0.4458 0.6947 -0.0448 -0.0507 0.0527  968  PHE   A C   
4292 O  O   . PHE   A 278 ? 0.065  0.4365 0.6866 -0.059  -0.0555 0.0551  968  PHE   A O   
4293 C  CB  . PHE   A 278 ? 0.0836 0.3907 0.6842 -0.0283 -0.0441 0.0413  968  PHE   A CB  
4294 C  CG  . PHE   A 278 ? 0.0987 0.3834 0.6986 -0.0254 -0.0413 0.0355  968  PHE   A CG  
4295 C  CD1 . PHE   A 278 ? 0.1065 0.3837 0.7065 -0.033  -0.0441 0.035   968  PHE   A CD1 
4296 C  CD2 . PHE   A 278 ? 0.1066 0.3866 0.7119 -0.0159 -0.0366 0.0305  968  PHE   A CD2 
4297 C  CE1 . PHE   A 278 ? 0.1197 0.3829 0.7207 -0.0292 -0.0417 0.0297  968  PHE   A CE1 
4298 C  CE2 . PHE   A 278 ? 0.1198 0.3861 0.7269 -0.0146 -0.0345 0.0253  968  PHE   A CE2 
4299 C  CZ  . PHE   A 278 ? 0.1217 0.3735 0.719  -0.02   -0.0365 0.025   968  PHE   A CZ  
4309 N  N   . SER   A 279 ? 0.0572 0.4786 0.7042 -0.0395 -0.051  0.0559  969  SER   A N   
4310 C  CA  . SER   A 279 ? 0.0509 0.5146 0.7126 -0.0522 -0.0571 0.0624  969  SER   A CA  
4311 C  C   . SER   A 279 ? 0.0539 0.5518 0.7321 -0.0658 -0.0585 0.0675  969  SER   A C   
4312 O  O   . SER   A 279 ? 0.0598 0.5748 0.7445 -0.0868 -0.0649 0.0719  969  SER   A O   
4313 C  CB  . SER   A 279 ? 0.0486 0.5558 0.7288 -0.0401 -0.057  0.0644  969  SER   A CB  
4314 O  OG  . SER   A 279 ? 0.0734 0.5737 0.7618 -0.0314 -0.0582 0.0603  969  SER   A OG  
4320 N  N   . LYS   A 280 ? 0.0525 0.5596 0.7371 -0.0557 -0.0529 0.067   970  LYS   A N   
4321 C  CA  . LYS   A 280 ? 0.0526 0.5841 0.7468 -0.0669 -0.0528 0.0717  970  LYS   A CA  
4322 C  C   . LYS   A 280 ? 0.0676 0.5695 0.7536 -0.0848 -0.0563 0.0707  970  LYS   A C   
4323 O  O   . LYS   A 280 ? 0.0725 0.5842 0.7545 -0.1033 -0.0596 0.0763  970  LYS   A O   
4324 C  CB  . LYS   A 280 ? 0.0743 0.6161 0.7784 -0.0502 -0.0461 0.0696  970  LYS   A CB  
4325 C  CG  . LYS   A 280 ? 0.1279 0.6843 0.8338 -0.059  -0.0446 0.0741  970  LYS   A CG  
4326 C  CD  . LYS   A 280 ? 0.1958 0.7516 0.9043 -0.0415 -0.0381 0.0711  970  LYS   A CD  
4327 C  CE  . LYS   A 280 ? 0.2659 0.7793 0.9673 -0.0335 -0.0358 0.0624  970  LYS   A CE  
4328 N  NZ  . LYS   A 280 ? 0.3227 0.8043 1.0144 -0.0483 -0.0392 0.0605  970  LYS   A NZ  
4342 N  N   . MET   A 281 ? 0.0778 0.5351 0.7507 -0.0782 -0.0552 0.0639  971  MET   A N   
4343 C  CA  . MET   A 281 ? 0.0904 0.5156 0.7511 -0.0903 -0.0583 0.0623  971  MET   A CA  
4344 C  C   . MET   A 281 ? 0.0997 0.5154 0.7489 -0.108  -0.0658 0.0652  971  MET   A C   
4345 O  O   . MET   A 281 ? 0.1098 0.5108 0.7445 -0.1242 -0.0693 0.0681  971  MET   A O   
4346 C  CB  . MET   A 281 ? 0.1038 0.4946 0.7587 -0.0767 -0.0551 0.0543  971  MET   A CB  
4347 C  CG  . MET   A 281 ? 0.1105 0.509  0.7758 -0.0633 -0.0489 0.051   971  MET   A CG  
4348 S  SD  . MET   A 281 ? 0.1329 0.4974 0.7922 -0.0521 -0.0458 0.0423  971  MET   A SD  
4349 C  CE  . MET   A 281 ? 0.1086 0.486  0.7752 -0.0436 -0.0405 0.0411  971  MET   A CE  
4359 N  N   . ALA   A 282 ? 0.0981 0.5201 0.7506 -0.1053 -0.0684 0.0647  972  ALA   A N   
4360 C  CA  . ALA   A 282 ? 0.1154 0.5286 0.7556 -0.1217 -0.0761 0.0671  972  ALA   A CA  
4361 C  C   . ALA   A 282 ? 0.1106 0.5551 0.7517 -0.1427 -0.0807 0.0751  972  ALA   A C   
4362 O  O   . ALA   A 282 ? 0.1183 0.5492 0.744  -0.1613 -0.0878 0.0774  972  ALA   A O   
4363 C  CB  . ALA   A 282 ? 0.1167 0.5332 0.7617 -0.1118 -0.0774 0.0647  972  ALA   A CB  
4369 N  N   . ARG   A 283 ? 0.0951 0.581  0.7523 -0.1407 -0.0768 0.0795  973  ARG   A N   
4370 C  CA  . ARG   A 283 ? 0.0944 0.6151 0.7535 -0.1619 -0.0805 0.0878  973  ARG   A CA  
4371 C  C   . ARG   A 283 ? 0.1187 0.614  0.7598 -0.1812 -0.082  0.0905  973  ARG   A C   
4372 O  O   . ARG   A 283 ? 0.1221 0.6266 0.7541 -0.2058 -0.0875 0.0965  973  ARG   A O   
4373 C  CB  . ARG   A 283 ? 0.0826 0.6591 0.7638 -0.1515 -0.0756 0.0922  973  ARG   A CB  
4374 C  CG  . ARG   A 283 ? 0.0853 0.6889 0.7792 -0.1346 -0.0753 0.0909  973  ARG   A CG  
4375 C  CD  . ARG   A 283 ? 0.0754 0.7401 0.7869 -0.1274 -0.0725 0.097   973  ARG   A CD  
4376 N  NE  . ARG   A 283 ? 0.0797 0.7515 0.7989 -0.106  -0.0642 0.0955  973  ARG   A NE  
4377 C  CZ  . ARG   A 283 ? 0.085  0.7447 0.8064 -0.0799 -0.0593 0.0897  973  ARG   A CZ  
4378 N  NH1 . ARG   A 283 ? 0.0768 0.7155 0.7939 -0.0713 -0.061  0.0849  973  ARG   A NH1 
4379 N  NH2 . ARG   A 283 ? 0.0714 0.7367 0.7969 -0.0629 -0.0525 0.0887  973  ARG   A NH2 
4393 N  N   . ASP   A 284 ? 0.135  0.5979 0.7691 -0.1705 -0.0773 0.0861  974  ASP   A N   
4394 C  CA  . ASP   A 284 ? 0.1593 0.5908 0.7722 -0.1846 -0.0782 0.0876  974  ASP   A CA  
4395 C  C   . ASP   A 284 ? 0.1726 0.5529 0.7704 -0.1708 -0.0774 0.0796  974  ASP   A C   
4396 O  O   . ASP   A 284 ? 0.1761 0.5475 0.7773 -0.1558 -0.0717 0.0758  974  ASP   A O   
4397 C  CB  . ASP   A 284 ? 0.1785 0.6351 0.8018 -0.182  -0.072  0.0913  974  ASP   A CB  
4398 C  CG  . ASP   A 284 ? 0.2563 0.6853 0.857  -0.198  -0.0727 0.0944  974  ASP   A CG  
4399 O  OD1 . ASP   A 284 ? 0.2871 0.674  0.8608 -0.2114 -0.0782 0.0938  974  ASP   A OD1 
4400 O  OD2 . ASP   A 284 ? 0.2789 0.7263 0.8863 -0.1962 -0.0676 0.0976  974  ASP   A OD2 
4405 N  N   . PRO   A 285 ? 0.1765 0.527  0.7592 -0.1734 -0.0828 0.0766  975  PRO   A N   
4406 C  CA  . PRO   A 285 ? 0.1853 0.4951 0.7567 -0.1571 -0.0813 0.0691  975  PRO   A CA  
4407 C  C   . PRO   A 285 ? 0.2012 0.4717 0.7484 -0.1576 -0.0806 0.0675  975  PRO   A C   
4408 O  O   . PRO   A 285 ? 0.2068 0.4586 0.7528 -0.1398 -0.0769 0.0614  975  PRO   A O   
4409 C  CB  . PRO   A 285 ? 0.2051 0.4961 0.7643 -0.1618 -0.0877 0.0677  975  PRO   A CB  
4410 C  CG  . PRO   A 285 ? 0.208  0.5119 0.7592 -0.187  -0.0944 0.0746  975  PRO   A CG  
4411 C  CD  . PRO   A 285 ? 0.1651 0.5201 0.7409 -0.1899 -0.0905 0.0797  975  PRO   A CD  
4419 N  N   . GLN   A 286 ? 0.206  0.4641 0.7327 -0.1776 -0.0842 0.073   976  GLN   A N   
4420 C  CA  . GLN   A 286 ? 0.2338 0.4509 0.7325 -0.1772 -0.0837 0.0718  976  GLN   A CA  
4421 C  C   . GLN   A 286 ? 0.2206 0.4541 0.7323 -0.1671 -0.0764 0.0717  976  GLN   A C   
4422 O  O   . GLN   A 286 ? 0.2363 0.4387 0.7287 -0.1598 -0.0748 0.0691  976  GLN   A O   
4423 C  CB  . GLN   A 286 ? 0.2835 0.4712 0.7481 -0.2027 -0.0906 0.0774  976  GLN   A CB  
4424 C  CG  . GLN   A 286 ? 0.3569 0.5183 0.8029 -0.209  -0.0981 0.0759  976  GLN   A CG  
4425 C  CD  . GLN   A 286 ? 0.4663 0.5911 0.8731 -0.2346 -0.1058 0.0806  976  GLN   A CD  
4426 O  OE1 . GLN   A 286 ? 0.4956 0.6152 0.888  -0.2514 -0.1058 0.086   976  GLN   A OE1 
4427 N  NE2 . GLN   A 286 ? 0.5082 0.6051 0.8949 -0.2388 -0.1128 0.0788  976  GLN   A NE2 
4436 N  N   . ARG   A 287 ? 0.1904 0.4714 0.7331 -0.1642 -0.0721 0.0739  977  ARG   A N   
4437 C  CA  . ARG   A 287 ? 0.1841 0.4816 0.7406 -0.1515 -0.0653 0.0729  977  ARG   A CA  
4438 C  C   . ARG   A 287 ? 0.1798 0.4684 0.746  -0.1269 -0.0613 0.064   977  ARG   A C   
4439 O  O   . ARG   A 287 ? 0.1831 0.4598 0.7451 -0.116  -0.0577 0.0606  977  ARG   A O   
4440 C  CB  . ARG   A 287 ? 0.1795 0.5303 0.7639 -0.1534 -0.0621 0.0778  977  ARG   A CB  
4441 C  CG  . ARG   A 287 ? 0.2173 0.5862 0.8168 -0.1375 -0.0549 0.0761  977  ARG   A CG  
4442 C  CD  . ARG   A 287 ? 0.2409 0.6602 0.8621 -0.1393 -0.0519 0.0821  977  ARG   A CD  
4443 N  NE  . ARG   A 287 ? 0.2825 0.7151 0.9159 -0.1214 -0.0453 0.0795  977  ARG   A NE  
4444 C  CZ  . ARG   A 287 ? 0.2992 0.7721 0.9483 -0.1179 -0.0413 0.0841  977  ARG   A CZ  
4445 N  NH1 . ARG   A 287 ? 0.2929 0.7714 0.9494 -0.1007 -0.0359 0.0809  977  ARG   A NH1 
4446 N  NH2 . ARG   A 287 ? 0.28   0.7894 0.9368 -0.1312 -0.043  0.0921  977  ARG   A NH2 
4460 N  N   . TYR   A 288 ? 0.169  0.465  0.7479 -0.1191 -0.0621 0.0606  978  TYR   A N   
4461 C  CA  . TYR   A 288 ? 0.1666 0.4596 0.7568 -0.0987 -0.0581 0.053   978  TYR   A CA  
4462 C  C   . TYR   A 288 ? 0.1934 0.4492 0.7651 -0.0917 -0.06   0.0476  978  TYR   A C   
4463 O  O   . TYR   A 288 ? 0.1922 0.4459 0.7708 -0.0763 -0.0562 0.0416  978  TYR   A O   
4464 C  CB  . TYR   A 288 ? 0.1427 0.464  0.7555 -0.0924 -0.0567 0.0523  978  TYR   A CB  
4465 C  CG  . TYR   A 288 ? 0.129  0.4892 0.7601 -0.0923 -0.0535 0.0566  978  TYR   A CG  
4466 C  CD1 . TYR   A 288 ? 0.1298 0.5012 0.7718 -0.0788 -0.0478 0.0537  978  TYR   A CD1 
4467 C  CD2 . TYR   A 288 ? 0.1295 0.5157 0.7645 -0.1063 -0.0564 0.0638  978  TYR   A CD2 
4468 C  CE1 . TYR   A 288 ? 0.1214 0.5273 0.7774 -0.0764 -0.0447 0.0578  978  TYR   A CE1 
4469 C  CE2 . TYR   A 288 ? 0.122  0.5474 0.7728 -0.1046 -0.0531 0.0683  978  TYR   A CE2 
4470 C  CZ  . TYR   A 288 ? 0.1232 0.5573 0.7839 -0.0885 -0.0471 0.0653  978  TYR   A CZ  
4471 O  OH  . TYR   A 288 ? 0.1119 0.5839 0.7857 -0.0847 -0.0438 0.0698  978  TYR   A OH  
4481 N  N   . LEU   A 289 ? 0.2167 0.4439 0.764  -0.102  -0.0657 0.0495  979  LEU   A N   
4482 C  CA  . LEU   A 289 ? 0.2481 0.4398 0.7744 -0.0927 -0.0673 0.0447  979  LEU   A CA  
4483 C  C   . LEU   A 289 ? 0.2923 0.447  0.7827 -0.103  -0.0718 0.0477  979  LEU   A C   
4484 O  O   . LEU   A 289 ? 0.3042 0.4523 0.782  -0.1215 -0.077  0.053   979  LEU   A O   
4485 C  CB  . LEU   A 289 ? 0.2465 0.4337 0.7744 -0.0905 -0.0701 0.0428  979  LEU   A CB  
4486 C  CG  . LEU   A 289 ? 0.2367 0.452  0.7936 -0.0801 -0.066  0.0397  979  LEU   A CG  
4487 C  CD1 . LEU   A 289 ? 0.2426 0.4501 0.7962 -0.0807 -0.0695 0.0392  979  LEU   A CD1 
4488 C  CD2 . LEU   A 289 ? 0.2365 0.4536 0.8024 -0.0631 -0.0602 0.0335  979  LEU   A CD2 
4500 N  N   . VAL   A 290 ? 0.3157 0.4459 0.7876 -0.0912 -0.0702 0.0443  980  VAL   A N   
4501 C  CA  . VAL   A 290 ? 0.358  0.4467 0.7898 -0.0975 -0.074  0.0467  980  VAL   A CA  
4502 C  C   . VAL   A 290 ? 0.3922 0.4443 0.7966 -0.0891 -0.078  0.0436  980  VAL   A C   
4503 O  O   . VAL   A 290 ? 0.3931 0.4386 0.7944 -0.0691 -0.0753 0.0382  980  VAL   A O   
4504 C  CB  . VAL   A 290 ? 0.3719 0.4553 0.7963 -0.0877 -0.0697 0.0454  980  VAL   A CB  
4505 C  CG1 . VAL   A 290 ? 0.4104 0.4459 0.7882 -0.0933 -0.0735 0.0482  980  VAL   A CG1 
4506 C  CG2 . VAL   A 290 ? 0.3564 0.4771 0.8081 -0.0946 -0.0656 0.0486  980  VAL   A CG2 
4516 N  N   . ILE   A 291 ? 0.4154 0.4467 0.8004 -0.1041 -0.0846 0.0469  981  ILE   A N   
4517 C  CA  . ILE   A 291 ? 0.4546 0.4484 0.8099 -0.0968 -0.0891 0.0445  981  ILE   A CA  
4518 C  C   . ILE   A 291 ? 0.5094 0.4517 0.8145 -0.1097 -0.0955 0.0483  981  ILE   A C   
4519 O  O   . ILE   A 291 ? 0.5107 0.4523 0.8099 -0.1338 -0.0991 0.054   981  ILE   A O   
4520 C  CB  . ILE   A 291 ? 0.4449 0.4556 0.8189 -0.1006 -0.0917 0.0441  981  ILE   A CB  
4521 C  CG1 . ILE   A 291 ? 0.4212 0.4763 0.8393 -0.0867 -0.0848 0.0402  981  ILE   A CG1 
4522 C  CG2 . ILE   A 291 ? 0.4756 0.4461 0.8166 -0.0923 -0.0965 0.0417  981  ILE   A CG2 
4523 C  CD1 . ILE   A 291 ? 0.4161 0.4938 0.8571 -0.0893 -0.0858 0.04    981  ILE   A CD1 
4535 N  N   . GLN   A 292 ? 0.552  0.4513 0.8188 -0.0934 -0.0967 0.0452  982  GLN   A N   
4536 C  CA  . GLN   A 292 ? 0.6104 0.452  0.8217 -0.1023 -0.1026 0.0482  982  GLN   A CA  
4537 C  C   . GLN   A 292 ? 0.6418 0.4605 0.8336 -0.1198 -0.1108 0.0507  982  GLN   A C   
4538 O  O   . GLN   A 292 ? 0.6411 0.4624 0.8391 -0.1089 -0.112  0.0473  982  GLN   A O   
4539 C  CB  . GLN   A 292 ? 0.6594 0.4624 0.8336 -0.0753 -0.1017 0.0439  982  GLN   A CB  
4540 C  CG  . GLN   A 292 ? 0.7055 0.5179 0.8836 -0.0602 -0.0953 0.0421  982  GLN   A CG  
4541 C  CD  . GLN   A 292 ? 0.8011 0.5713 0.9363 -0.0715 -0.0974 0.0465  982  GLN   A CD  
4542 O  OE1 . GLN   A 292 ? 0.8602 0.5721 0.94   -0.0698 -0.1025 0.0474  982  GLN   A OE1 
4543 N  NE2 . GLN   A 292 ? 0.7965 0.5923 0.9529 -0.0825 -0.0935 0.0495  982  GLN   A NE2 
4552 N  N   . GLY   A 293 ? 0.6665 0.4637 0.8345 -0.1475 -0.1163 0.0565  983  GLY   A N   
4553 C  CA  . GLY   A 293 ? 0.6991 0.4744 0.8462 -0.1683 -0.1251 0.0591  983  GLY   A CA  
4554 C  C   . GLY   A 293 ? 0.6851 0.5132 0.8795 -0.1779 -0.1255 0.0596  983  GLY   A C   
4555 O  O   . GLY   A 293 ? 0.6941 0.5104 0.879  -0.1829 -0.1316 0.059   983  GLY   A O   
4559 N  N   . ASP   A 294 ? 0.6621 0.547  0.9047 -0.1804 -0.1194 0.061   984  ASP   A N   
4560 C  CA  . ASP   A 294 ? 0.6461 0.5845 0.9344 -0.1856 -0.1186 0.0616  984  ASP   A CA  
4561 C  C   . ASP   A 294 ? 0.6668 0.6111 0.9494 -0.2164 -0.1265 0.0672  984  ASP   A C   
4562 O  O   . ASP   A 294 ? 0.6557 0.6197 0.9548 -0.2181 -0.1296 0.0663  984  ASP   A O   
4563 C  CB  . ASP   A 294 ? 0.6269 0.6187 0.9608 -0.1788 -0.11   0.0618  984  ASP   A CB  
4564 C  CG  . ASP   A 294 ? 0.6324 0.6756 1.0124 -0.1722 -0.1069 0.0603  984  ASP   A CG  
4565 O  OD1 . ASP   A 294 ? 0.6383 0.6801 1.0184 -0.1735 -0.1112 0.0593  984  ASP   A OD1 
4566 O  OD2 . ASP   A 294 ? 0.6291 0.7117 1.0427 -0.1648 -0.1001 0.0601  984  ASP   A OD2 
4571 N  N   . GLU   A 295 ? 0.6941 0.6226 0.9527 -0.2412 -0.1299 0.0729  985  GLU   A N   
4572 C  CA  . GLU   A 295 ? 0.7129 0.6491 0.9642 -0.2741 -0.1379 0.0787  985  GLU   A CA  
4573 C  C   . GLU   A 295 ? 0.7601 0.6468 0.9701 -0.2823 -0.1479 0.0772  985  GLU   A C   
4574 O  O   . GLU   A 295 ? 0.7593 0.6575 0.9677 -0.3076 -0.1553 0.0808  985  GLU   A O   
4575 C  CB  . GLU   A 295 ? 0.7512 0.6795 0.983  -0.3005 -0.1388 0.0857  985  GLU   A CB  
4576 C  CG  . GLU   A 295 ? 0.7848 0.7726 1.0601 -0.3007 -0.1307 0.0892  985  GLU   A CG  
4577 C  CD  . GLU   A 295 ? 0.8769 0.864  1.1367 -0.3278 -0.1309 0.097   985  GLU   A CD  
4578 O  OE1 . GLU   A 295 ? 0.924  0.8743 1.1436 -0.3555 -0.1388 0.1011  985  GLU   A OE1 
4579 O  OE2 . GLU   A 295 ? 0.882  0.9052 1.1688 -0.3219 -0.1231 0.0991  985  GLU   A OE2 
4586 N  N   . ARG   A 296 ? 0.7974 0.6316 0.9739 -0.2606 -0.1484 0.072   986  ARG   A N   
4587 C  CA  . ARG   A 296 ? 0.846  0.6264 0.9774 -0.2642 -0.1576 0.0701  986  ARG   A CA  
4588 C  C   . ARG   A 296 ? 0.8489 0.6301 0.9919 -0.2337 -0.1555 0.0635  986  ARG   A C   
4589 O  O   . ARG   A 296 ? 0.8844 0.6126 0.9862 -0.219  -0.1585 0.0602  986  ARG   A O   
4590 C  CB  . ARG   A 296 ? 0.9203 0.6259 0.9862 -0.2691 -0.1616 0.0711  986  ARG   A CB  
4591 C  CG  . ARG   A 296 ? 0.9858 0.6713 1.0412 -0.2402 -0.1536 0.0679  986  ARG   A CG  
4592 C  CD  . ARG   A 296 ? 1.0866 0.7008 1.0762 -0.248  -0.1574 0.0701  986  ARG   A CD  
4593 N  NE  . ARG   A 296 ? 1.1441 0.743  1.1241 -0.2192 -0.1498 0.0672  986  ARG   A NE  
4594 C  CZ  . ARG   A 296 ? 1.1611 0.7896 1.1655 -0.2172 -0.1422 0.069   986  ARG   A CZ  
4595 N  NH1 . ARG   A 296 ? 1.1653 0.7778 1.1577 -0.1894 -0.1361 0.0656  986  ARG   A NH1 
4596 N  NH2 . ARG   A 296 ? 1.1362 0.8128 1.1771 -0.2418 -0.1405 0.0741  986  ARG   A NH2 
4610 N  N   . MET   A 297 ? 0.8086 0.6497 1.0059 -0.2245 -0.1504 0.0621  987  MET   A N   
4611 C  CA  . MET   A 297 ? 0.8028 0.6532 1.0173 -0.1987 -0.1476 0.0567  987  MET   A CA  
4612 C  C   . MET   A 297 ? 0.7879 0.673  1.0274 -0.2107 -0.152  0.0579  987  MET   A C   
4613 O  O   . MET   A 297 ? 0.7658 0.6976 1.0368 -0.227  -0.1514 0.0617  987  MET   A O   
4614 C  CB  . MET   A 297 ? 0.7804 0.6692 1.0356 -0.1743 -0.1363 0.0537  987  MET   A CB  
4615 C  CG  . MET   A 297 ? 0.8159 0.6726 1.0476 -0.1551 -0.1319 0.051   987  MET   A CG  
4616 S  SD  . MET   A 297 ? 0.7943 0.6987 1.0741 -0.1295 -0.1197 0.0471  987  MET   A SD  
4617 C  CE  . MET   A 297 ? 0.8095 0.6686 1.0501 -0.1071 -0.1173 0.0437  987  MET   A CE  
4627 N  N   . HIS   A 298 ? 0.7974 0.6614 1.0225 -0.2014 -0.1563 0.0547  988  HIS   A N   
4628 C  CA  . HIS   A 298 ? 0.7849 0.6774 1.0291 -0.2112 -0.1612 0.0554  988  HIS   A CA  
4629 C  C   . HIS   A 298 ? 0.7789 0.6721 1.033  -0.1853 -0.1584 0.0505  988  HIS   A C   
4630 O  O   . HIS   A 298 ? 0.8003 0.6531 1.0266 -0.1667 -0.1576 0.0471  988  HIS   A O   
4631 C  CB  . HIS   A 298 ? 0.8223 0.6787 1.0249 -0.2391 -0.1739 0.0581  988  HIS   A CB  
4632 C  CG  . HIS   A 298 ? 0.839  0.7205 1.0554 -0.2494 -0.1804 0.0584  988  HIS   A CG  
4633 N  ND1 . HIS   A 298 ? 0.8789 0.7316 1.0753 -0.2375 -0.185  0.0547  988  HIS   A ND1 
4634 C  CD2 . HIS   A 298 ? 0.8255 0.7594 1.0726 -0.2689 -0.1828 0.0621  988  HIS   A CD2 
4635 C  CE1 . HIS   A 298 ? 0.8675 0.7543 1.083  -0.2505 -0.1903 0.056   988  HIS   A CE1 
4636 N  NE2 . HIS   A 298 ? 0.8392 0.7764 1.0853 -0.2692 -0.1892 0.0604  988  HIS   A NE2 
4644 N  N   . LEU   A 299 ? 0.7486 0.6885 1.0407 -0.1838 -0.1568 0.0505  989  LEU   A N   
4645 C  CA  . LEU   A 299 ? 0.75   0.6948 1.0536 -0.1624 -0.1542 0.0467  989  LEU   A CA  
4646 C  C   . LEU   A 299 ? 0.7462 0.711  1.0572 -0.1761 -0.1616 0.0482  989  LEU   A C   
4647 O  O   . LEU   A 299 ? 0.7268 0.728  1.0569 -0.1954 -0.164  0.0519  989  LEU   A O   
4648 C  CB  . LEU   A 299 ? 0.7249 0.7099 1.0711 -0.1416 -0.1422 0.0447  989  LEU   A CB  
4649 C  CG  . LEU   A 299 ? 0.7478 0.7217 1.0924 -0.1263 -0.1343 0.0427  989  LEU   A CG  
4650 C  CD1 . LEU   A 299 ? 0.7245 0.7432 1.1127 -0.1135 -0.124  0.0415  989  LEU   A CD1 
4651 C  CD2 . LEU   A 299 ? 0.7816 0.7136 1.096  -0.1065 -0.1339 0.039   989  LEU   A CD2 
4663 N  N   . PRO   A 300 ? 0.7622 0.7068 1.0582 -0.1668 -0.1656 0.0455  990  PRO   A N   
4664 C  CA  . PRO   A 300 ? 0.7581 0.7227 1.0599 -0.1804 -0.1735 0.0468  990  PRO   A CA  
4665 C  C   . PRO   A 300 ? 0.7274 0.756  1.0769 -0.1799 -0.1686 0.0486  990  PRO   A C   
4666 O  O   . PRO   A 300 ? 0.7109 0.7629 1.0891 -0.1607 -0.1582 0.0472  990  PRO   A O   
4667 C  CB  . PRO   A 300 ? 0.783  0.7175 1.0657 -0.1624 -0.1753 0.0431  990  PRO   A CB  
4668 C  CG  . PRO   A 300 ? 0.8141 0.7007 1.0658 -0.1475 -0.1726 0.0407  990  PRO   A CG  
4669 C  CD  . PRO   A 300 ? 0.7789 0.6836 1.051  -0.1434 -0.1636 0.0415  990  PRO   A CD  
4677 N  N   . SER   A 301 ? 0.7164 0.7734 1.0724 -0.201  -0.1763 0.0517  991  SER   A N   
4678 C  CA  . SER   A 301 ? 0.6875 0.8071 1.085  -0.1999 -0.1725 0.0539  991  SER   A CA  
4679 C  C   . SER   A 301 ? 0.6812 0.8179 1.0789 -0.2057 -0.1807 0.054   991  SER   A C   
4680 O  O   . SER   A 301 ? 0.702  0.8134 1.0697 -0.2255 -0.1919 0.0546  991  SER   A O   
4681 C  CB  . SER   A 301 ? 0.6924 0.8452 1.1029 -0.2214 -0.1732 0.0589  991  SER   A CB  
4682 O  OG  . SER   A 301 ? 0.7354 0.865  1.1367 -0.2219 -0.1683 0.0592  991  SER   A OG  
4688 N  N   . PRO   A 302 ? 0.6542 0.8324 1.0818 -0.1905 -0.1764 0.0536  992  PRO   A N   
4689 C  CA  . PRO   A 302 ? 0.6495 0.8458 1.0754 -0.1968 -0.1851 0.0539  992  PRO   A CA  
4690 C  C   . PRO   A 302 ? 0.6454 0.8701 1.0686 -0.2283 -0.1956 0.0583  992  PRO   A C   
4691 O  O   . PRO   A 302 ? 0.6451 0.8772 1.0593 -0.2383 -0.2052 0.0582  992  PRO   A O   
4692 C  CB  . PRO   A 302 ? 0.6308 0.8696 1.0903 -0.1736 -0.1767 0.0534  992  PRO   A CB  
4693 C  CG  . PRO   A 302 ? 0.6359 0.8621 1.1064 -0.1532 -0.1643 0.0514  992  PRO   A CG  
4694 C  CD  . PRO   A 302 ? 0.6253 0.8338 1.0861 -0.1674 -0.164  0.0529  992  PRO   A CD  
4702 N  N   . THR   A 303 ? 0.6418 0.8827 1.0718 -0.2449 -0.1941 0.0621  993  THR   A N   
4703 C  CA  . THR   A 303 ? 0.6435 0.9127 1.0701 -0.2779 -0.2035 0.0671  993  THR   A CA  
4704 C  C   . THR   A 303 ? 0.6826 0.8942 1.0628 -0.3023 -0.2151 0.0665  993  THR   A C   
4705 O  O   . THR   A 303 ? 0.6838 0.9078 1.0522 -0.3282 -0.2265 0.0686  993  THR   A O   
4706 C  CB  . THR   A 303 ? 0.6421 0.9452 1.0891 -0.2872 -0.1973 0.0719  993  THR   A CB  
4707 O  OG1 . THR   A 303 ? 0.6798 0.9324 1.1048 -0.2893 -0.1941 0.0711  993  THR   A OG1 
4708 C  CG2 . THR   A 303 ? 0.6153 0.9692 1.1032 -0.2619 -0.1858 0.0723  993  THR   A CG2 
4716 N  N   . ASP   A 304 ? 0.712  0.8606 1.0637 -0.2935 -0.2124 0.0635  994  ASP   A N   
4717 C  CA  . ASP   A 304 ? 0.7545 0.8385 1.0554 -0.3116 -0.2225 0.0624  994  ASP   A CA  
4718 C  C   . ASP   A 304 ? 0.7707 0.8351 1.0508 -0.3117 -0.2324 0.0593  994  ASP   A C   
4719 O  O   . ASP   A 304 ? 0.7597 0.8378 1.0578 -0.2866 -0.2282 0.0562  994  ASP   A O   
4720 C  CB  . ASP   A 304 ? 0.7993 0.824  1.0761 -0.2925 -0.216  0.0592  994  ASP   A CB  
4721 C  CG  . ASP   A 304 ? 0.8399 0.8735 1.1309 -0.2903 -0.2065 0.0615  994  ASP   A CG  
4722 O  OD1 . ASP   A 304 ? 0.8319 0.9052 1.1402 -0.311  -0.2069 0.0664  994  ASP   A OD1 
4723 O  OD2 . ASP   A 304 ? 0.874  0.8769 1.1586 -0.2676 -0.1987 0.0584  994  ASP   A OD2 
4728 N  N   . SER   A 305 ? 0.7971 0.8261 1.0366 -0.3401 -0.2456 0.06    995  SER   A N   
4729 C  CA  . SER   A 305 ? 0.8199 0.8247 1.034  -0.3424 -0.2564 0.0568  995  SER   A CA  
4730 C  C   . SER   A 305 ? 0.8551 0.7964 1.0396 -0.3141 -0.2539 0.0514  995  SER   A C   
4731 O  O   . SER   A 305 ? 0.862  0.7927 1.0366 -0.3047 -0.259  0.0483  995  SER   A O   
4732 C  CB  . SER   A 305 ? 0.8561 0.8374 1.0313 -0.383  -0.2717 0.059   995  SER   A CB  
4733 O  OG  . SER   A 305 ? 0.8479 0.8966 1.052  -0.4097 -0.2752 0.0642  995  SER   A OG  
4739 N  N   . ASN   A 306 ? 0.8748 0.7766 1.0452 -0.2996 -0.246  0.0505  996  ASN   A N   
4740 C  CA  . ASN   A 306 ? 0.9094 0.7562 1.0526 -0.2709 -0.2425 0.0459  996  ASN   A CA  
4741 C  C   . ASN   A 306 ? 0.8867 0.7627 1.0699 -0.2354 -0.2277 0.044   996  ASN   A C   
4742 O  O   . ASN   A 306 ? 0.9064 0.7446 1.0727 -0.2121 -0.222  0.0413  996  ASN   A O   
4743 C  CB  . ASN   A 306 ? 0.9638 0.7463 1.0607 -0.2755 -0.2437 0.0459  996  ASN   A CB  
4744 C  CG  . ASN   A 306 ? 1.0473 0.7745 1.087  -0.3032 -0.2587 0.0462  996  ASN   A CG  
4745 O  OD1 . ASN   A 306 ? 1.0701 0.7933 1.096  -0.3142 -0.2692 0.045   996  ASN   A OD1 
4746 N  ND2 . ASN   A 306 ? 1.0873 0.7671 1.0888 -0.3153 -0.2604 0.0477  996  ASN   A ND2 
4753 N  N   . PHE   A 307 ? 0.8459 0.7872 1.0788 -0.2305 -0.2217 0.0454  997  PHE   A N   
4754 C  CA  . PHE   A 307 ? 0.8323 0.7966 1.0989 -0.1991 -0.208  0.0436  997  PHE   A CA  
4755 C  C   . PHE   A 307 ? 0.8393 0.7823 1.0957 -0.1757 -0.2074 0.0399  997  PHE   A C   
4756 O  O   . PHE   A 307 ? 0.8406 0.775  1.1045 -0.1502 -0.1973 0.0379  997  PHE   A O   
4757 C  CB  . PHE   A 307 ? 0.7963 0.8299 1.1128 -0.1987 -0.2017 0.0462  997  PHE   A CB  
4758 C  CG  . PHE   A 307 ? 0.7925 0.8434 1.139  -0.1695 -0.1874 0.0445  997  PHE   A CG  
4759 C  CD1 . PHE   A 307 ? 0.807  0.8447 1.1561 -0.1606 -0.1787 0.0441  997  PHE   A CD1 
4760 C  CD2 . PHE   A 307 ? 0.7865 0.864  1.1554 -0.1513 -0.183  0.0432  997  PHE   A CD2 
4761 C  CE1 . PHE   A 307 ? 0.8025 0.8558 1.1775 -0.1365 -0.1664 0.0424  997  PHE   A CE1 
4762 C  CE2 . PHE   A 307 ? 0.7836 0.8725 1.176  -0.1272 -0.1702 0.0418  997  PHE   A CE2 
4763 C  CZ  . PHE   A 307 ? 0.7843 0.8619 1.18   -0.121  -0.1622 0.0414  997  PHE   A CZ  
4773 N  N   . TYR   A 308 ? 0.8422 0.7771 1.0807 -0.1846 -0.2182 0.0391  998  TYR   A N   
4774 C  CA  . TYR   A 308 ? 0.8562 0.7679 1.081  -0.1631 -0.2185 0.0358  998  TYR   A CA  
4775 C  C   . TYR   A 308 ? 0.8933 0.7423 1.0782 -0.1479 -0.2173 0.0333  998  TYR   A C   
4776 O  O   . TYR   A 308 ? 0.8994 0.7346 1.0802 -0.1234 -0.2126 0.031   998  TYR   A O   
4777 C  CB  . TYR   A 308 ? 0.86   0.772  1.0686 -0.1783 -0.2319 0.0353  998  TYR   A CB  
4778 C  CG  . TYR   A 308 ? 0.9003 0.7616 1.0588 -0.2025 -0.2459 0.0349  998  TYR   A CG  
4779 C  CD1 . TYR   A 308 ? 0.9439 0.7466 1.0574 -0.1931 -0.2521 0.0318  998  TYR   A CD1 
4780 C  CD2 . TYR   A 308 ? 0.9075 0.7787 1.0613 -0.2352 -0.2532 0.038   998  TYR   A CD2 
4781 C  CE1 . TYR   A 308 ? 0.9882 0.7384 1.0502 -0.2152 -0.2654 0.0313  998  TYR   A CE1 
4782 C  CE2 . TYR   A 308 ? 0.9506 0.7716 1.0546 -0.2599 -0.2665 0.0379  998  TYR   A CE2 
4783 C  CZ  . TYR   A 308 ? 0.9975 0.7559 1.0542 -0.2498 -0.2728 0.0343  998  TYR   A CZ  
4784 O  OH  . TYR   A 308 ? 1.0524 0.755  1.0545 -0.2741 -0.2861 0.034   998  TYR   A OH  
4794 N  N   . ARG   A 309 ? 0.9159 0.7278 1.0701 -0.1614 -0.2212 0.034   999  ARG   A N   
4795 C  CA  . ARG   A 309 ? 0.9557 0.7087 1.0689 -0.1455 -0.2201 0.0319  999  ARG   A CA  
4796 C  C   . ARG   A 309 ? 0.947  0.7171 1.0876 -0.1187 -0.2048 0.0313  999  ARG   A C   
4797 O  O   . ARG   A 309 ? 0.9626 0.7079 1.088  -0.0938 -0.2002 0.0291  999  ARG   A O   
4798 C  CB  . ARG   A 309 ? 0.9965 0.7064 1.069  -0.1673 -0.2278 0.0331  999  ARG   A CB  
4799 C  CG  . ARG   A 309 ? 1.0429 0.7279 1.0804 -0.1982 -0.2439 0.0338  999  ARG   A CG  
4800 C  CD  . ARG   A 309 ? 1.1065 0.7319 1.0922 -0.1891 -0.2528 0.0305  999  ARG   A CD  
4801 N  NE  . ARG   A 309 ? 1.1522 0.7509 1.1013 -0.2215 -0.2689 0.031   999  ARG   A NE  
4802 C  CZ  . ARG   A 309 ? 1.2081 0.7511 1.1056 -0.2216 -0.2798 0.0283  999  ARG   A CZ  
4803 N  NH1 . ARG   A 309 ? 1.2185 0.7274 1.0948 -0.1888 -0.276  0.0252  999  ARG   A NH1 
4804 N  NH2 . ARG   A 309 ? 1.2229 0.7443 1.0884 -0.2549 -0.2948 0.0288  999  ARG   A NH2 
4818 N  N   . ALA   A 310 ? 0.921  0.7341 1.1007 -0.1241 -0.1971 0.0333  1000 ALA   A N   
4819 C  CA  . ALA   A 310 ? 0.9125 0.746  1.1205 -0.1023 -0.1831 0.0327  1000 ALA   A CA  
4820 C  C   . ALA   A 310 ? 0.8942 0.7626 1.1357 -0.0842 -0.1755 0.0318  1000 ALA   A C   
4821 O  O   . ALA   A 310 ? 0.8972 0.7593 1.1408 -0.0608 -0.1672 0.0301  1000 ALA   A O   
4822 C  CB  . ALA   A 310 ? 0.8951 0.7616 1.1313 -0.1154 -0.1785 0.0351  1000 ALA   A CB  
4828 N  N   . GLU   A 325 ? 0.3396 0.7222 0.967  -0.0038 0.0221  0.0033  1015 GLU   A N   
4829 C  CA  . GLU   A 325 ? 0.3541 0.7087 0.983  -0.0102 0.0184  0.0012  1015 GLU   A CA  
4830 C  C   . GLU   A 325 ? 0.3556 0.7025 0.9882 -0.0291 0.0231  0.0006  1015 GLU   A C   
4831 O  O   . GLU   A 325 ? 0.3581 0.6984 0.995  -0.0375 0.0217  -0.0027 1015 GLU   A O   
4832 C  CB  . GLU   A 325 ? 0.3978 0.7189 1.0159 -0.0002 0.0138  0.0037  1015 GLU   A CB  
4833 C  CG  . GLU   A 325 ? 0.4569 0.7764 1.0641 0.0177  0.0092  0.005   1015 GLU   A CG  
4834 C  CD  . GLU   A 325 ? 0.5437 0.831  1.1386 0.0244  0.0047  0.0077  1015 GLU   A CD  
4835 O  OE1 . GLU   A 325 ? 0.5546 0.8296 1.1474 0.0203  0.0075  0.0101  1015 GLU   A OE1 
4836 O  OE2 . GLU   A 325 ? 0.5778 0.8518 1.1636 0.0334  -0.0017 0.0076  1015 GLU   A OE2 
4842 N  N   . TYR   A 326 ? 0.353  0.6974 0.9808 -0.0351 0.0287  0.0039  1016 TYR   A N   
4843 C  CA  . TYR   A 326 ? 0.3618 0.6931 0.9869 -0.0532 0.0338  0.0039  1016 TYR   A CA  
4844 C  C   . TYR   A 326 ? 0.3524 0.7173 0.9836 -0.0677 0.0394  0.0035  1016 TYR   A C   
4845 O  O   . TYR   A 326 ? 0.3387 0.7313 0.9722 -0.0622 0.042   0.0061  1016 TYR   A O   
4846 C  CB  . TYR   A 326 ? 0.3757 0.6793 0.9887 -0.0508 0.0364  0.0082  1016 TYR   A CB  
4847 C  CG  . TYR   A 326 ? 0.3972 0.6725 1.0045 -0.0371 0.0306  0.0089  1016 TYR   A CG  
4848 C  CD1 . TYR   A 326 ? 0.4196 0.6666 1.0218 -0.0404 0.0292  0.0079  1016 TYR   A CD1 
4849 C  CD2 . TYR   A 326 ? 0.4088 0.6859 1.0137 -0.0208 0.0264  0.0107  1016 TYR   A CD2 
4850 C  CE1 . TYR   A 326 ? 0.4382 0.6655 1.0365 -0.0289 0.0237  0.0089  1016 TYR   A CE1 
4851 C  CE2 . TYR   A 326 ? 0.4292 0.6823 1.0284 -0.0112 0.0204  0.0114  1016 TYR   A CE2 
4852 C  CZ  . TYR   A 326 ? 0.4489 0.6798 1.0463 -0.0157 0.0193  0.0107  1016 TYR   A CZ  
4853 O  OH  . TYR   A 326 ? 0.4732 0.6864 1.0661 -0.0068 0.0134  0.0118  1016 TYR   A OH  
4863 N  N   . LEU   A 327 ? 0.3561 0.7204 0.9889 -0.0861 0.041   0.0003  1017 LEU   A N   
4864 C  CA  . LEU   A 327 ? 0.3531 0.751  0.9917 -0.104  0.0455  -0.0006 1017 LEU   A CA  
4865 C  C   . LEU   A 327 ? 0.3755 0.7504 1.0032 -0.1274 0.0499  -0.001  1017 LEU   A C   
4866 O  O   . LEU   A 327 ? 0.3907 0.7253 1.0076 -0.1286 0.0483  -0.0023 1017 LEU   A O   
4867 C  CB  . LEU   A 327 ? 0.3401 0.7687 0.9915 -0.1036 0.0413  -0.0056 1017 LEU   A CB  
4868 C  CG  . LEU   A 327 ? 0.3513 0.798  1.0092 -0.0795 0.0363  -0.006  1017 LEU   A CG  
4869 C  CD1 . LEU   A 327 ? 0.3682 0.7855 1.0245 -0.0693 0.0298  -0.0087 1017 LEU   A CD1 
4870 C  CD2 . LEU   A 327 ? 0.3383 0.837  1.0077 -0.0791 0.0364  -0.0081 1017 LEU   A CD2 
4882 N  N   . ILE   A 328 ? 0.3755 0.7767 1.0043 -0.1463 0.0554  0.0003  1018 ILE   A N   
4883 C  CA  . ILE   A 328 ? 0.401  0.7806 1.0159 -0.1723 0.0598  0       1018 ILE   A CA  
4884 C  C   . ILE   A 328 ? 0.4056 0.7814 1.0219 -0.1828 0.0552  -0.0065 1018 ILE   A C   
4885 O  O   . ILE   A 328 ? 0.3899 0.8064 1.0223 -0.182  0.0523  -0.0096 1018 ILE   A O   
4886 C  CB  . ILE   A 328 ? 0.4007 0.8165 1.0177 -0.1915 0.0668  0.0036  1018 ILE   A CB  
4887 C  CG1 . ILE   A 328 ? 0.4215 0.8318 1.0319 -0.1829 0.0723  0.0106  1018 ILE   A CG1 
4888 C  CG2 . ILE   A 328 ? 0.4159 0.8177 1.0194 -0.2237 0.0699  0.0019  1018 ILE   A CG2 
4889 C  CD1 . ILE   A 328 ? 0.4662 0.8183 1.0517 -0.1891 0.0763  0.0138  1018 ILE   A CD1 
4901 N  N   . PRO   A 329 ? 0.4255 0.7539 1.0241 -0.1902 0.0543  -0.0088 1019 PRO   A N   
4902 C  CA  . PRO   A 329 ? 0.4281 0.7532 1.027  -0.1981 0.0497  -0.0151 1019 PRO   A CA  
4903 C  C   . PRO   A 329 ? 0.4217 0.7756 1.0223 -0.2255 0.0513  -0.0178 1019 PRO   A C   
4904 O  O   . PRO   A 329 ? 0.4281 0.7801 1.0177 -0.2462 0.0569  -0.015  1019 PRO   A O   
4905 C  CB  . PRO   A 329 ? 0.4632 0.7287 1.0379 -0.1982 0.0494  -0.0159 1019 PRO   A CB  
4906 C  CG  . PRO   A 329 ? 0.4824 0.7231 1.0406 -0.2022 0.0555  -0.0104 1019 PRO   A CG  
4907 C  CD  . PRO   A 329 ? 0.4443 0.7199 1.02   -0.1892 0.0571  -0.006  1019 PRO   A CD  
4915 C  C   . A1IMS B .   ? 0.3092 0.4061 0.8304 0.0487  -0.0089 0.0291  2001 A1IMS A C   
4916 N  N   . A1IMS B .   ? 0.2953 0.4029 0.818  0.0463  -0.0255 0.0284  2001 A1IMS A N   
4917 CL CL  . A1IMS B .   ? 0.3535 0.4274 0.845  0.0714  -0.0144 0.0338  2001 A1IMS A CL  
4918 C  C2  . A1IMS B .   ? 0.3315 0.4122 0.8297 0.0646  -0.0184 0.0329  2001 A1IMS A C2  
4919 C  C3  . A1IMS B .   ? 0.3331 0.4051 0.8206 0.0697  -0.0204 0.0341  2001 A1IMS A C3  
4920 C  C4  . A1IMS B .   ? 0.3303 0.4048 0.8182 0.0673  -0.0242 0.0334  2001 A1IMS A C4  
4921 C  C5  . A1IMS B .   ? 0.3202 0.4059 0.8192 0.0597  -0.0255 0.0315  2001 A1IMS A C5  
4922 C  C6  . A1IMS B .   ? 0.31   0.406  0.8218 0.0535  -0.0235 0.0303  2001 A1IMS A C6  
4923 C  C1  . A1IMS B .   ? 0.3153 0.4084 0.8261 0.0563  -0.0198 0.031   2001 A1IMS A C1  
4924 O  O   . A1IMS B .   ? 0.3095 0.4108 0.8296 0.0524  -0.0181 0.0298  2001 A1IMS A O   
4925 C  C7  . A1IMS B .   ? 0.2891 0.399  0.8114 0.0446  -0.027  0.0275  2001 A1IMS A C7  
4926 C  C13 . A1IMS B .   ? 0.2899 0.393  0.8018 0.0465  -0.0353 0.0275  2001 A1IMS A C13 
4927 N  N2  . A1IMS B .   ? 0.2868 0.3944 0.7995 0.0463  -0.0333 0.0263  2001 A1IMS A N2  
4928 C  C9  . A1IMS B .   ? 0.2797 0.3999 0.8051 0.0429  -0.0249 0.0253  2001 A1IMS A C9  
4929 C  C10 . A1IMS B .   ? 0.2757 0.4081 0.8063 0.0422  -0.0204 0.0239  2001 A1IMS A C10 
4930 C  C11 . A1IMS B .   ? 0.2651 0.4106 0.8115 0.0338  -0.0141 0.0223  2001 A1IMS A C11 
4931 N  N1  . A1IMS B .   ? 0.268  0.4075 0.8152 0.0318  -0.0092 0.0233  2001 A1IMS A N1  
4932 C  C12 . A1IMS B .   ? 0.2768 0.4033 0.8162 0.0361  -0.0123 0.0251  2001 A1IMS A C12 
4933 O  O1  . A1IMS B .   ? 0.2801 0.4009 0.8186 0.0355  -0.0079 0.0258  2001 A1IMS A O1  
4934 C  C8  . A1IMS B .   ? 0.2807 0.4003 0.8112 0.041   -0.021  0.026   2001 A1IMS A C8  
4935 C  C14 . A1IMS B .   ? 0.29   0.3832 0.7905 0.0472  -0.045  0.0284  2001 A1IMS A C14 
4936 C  C18 . A1IMS B .   ? 0.2939 0.3737 0.7782 0.0488  -0.0524 0.0282  2001 A1IMS A C18 
4937 C  C17 . A1IMS B .   ? 0.3006 0.3711 0.7737 0.0456  -0.0626 0.0288  2001 A1IMS A C17 
4938 N  N3  . A1IMS B .   ? 0.2979 0.3775 0.7781 0.0417  -0.0657 0.0296  2001 A1IMS A N3  
4939 C  C16 . A1IMS B .   ? 0.289  0.3828 0.7847 0.0431  -0.0583 0.0299  2001 A1IMS A C16 
4940 C  C15 . A1IMS B .   ? 0.2859 0.3836 0.7903 0.0455  -0.0481 0.0292  2001 A1IMS A C15 
4941 O  O2  . A1IMS B .   ? 0.2916 0.3669 0.7683 0.0535  -0.0502 0.0275  2001 A1IMS A O2  
4942 C  C19 . A1IMS B .   ? 0.2891 0.3608 0.7609 0.0485  -0.0563 0.0264  2001 A1IMS A C19 
4943 C  C20 . A1IMS B .   ? 0.285  0.359  0.7529 0.0556  -0.0513 0.0254  2001 A1IMS A C20 
4944 O  O3  . A1IMS B .   ? 0.2699 0.3653 0.7589 0.0529  -0.0424 0.0246  2001 A1IMS A O3  
4945 C  C23 . A1IMS B .   ? 0.2668 0.3691 0.7525 0.0613  -0.0363 0.0245  2001 A1IMS A C23 
4946 C  C22 . A1IMS B .   ? 0.2809 0.3653 0.7432 0.0733  -0.0392 0.026   2001 A1IMS A C22 
4947 C  C21 . A1IMS B .   ? 0.2927 0.3567 0.7438 0.0688  -0.0489 0.0265  2001 A1IMS A C21 
# 
