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*** ***elNémo ID: 2404101708443329775Job options:ID = 2404101708443329775 JOBID = USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:data_8QFH # _entry.id 8QFH # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.388 _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 8QFH pdb_00008qfh 10.2210/pdb8qfh/pdb WWPDB D_1292132778 ? ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2023-11-01 2 'Structure model' 1 1 2024-01-24 3 'Structure model' 1 2 2024-03-13 # _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 ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' '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 3 3 'Structure model' citation # 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_ASTM' 4 2 'Structure model' '_citation.journal_id_CSD' 5 2 'Structure model' '_citation.journal_id_ISSN' 6 2 'Structure model' '_citation.page_first' 7 2 'Structure model' '_citation.page_last' 8 2 'Structure model' '_citation.pdbx_database_id_DOI' 9 2 'Structure model' '_citation.pdbx_database_id_PubMed' 10 2 'Structure model' '_citation.title' 11 2 'Structure model' '_citation.year' 12 2 'Structure model' '_citation_author.identifier_ORCID' 13 2 'Structure model' '_citation_author.name' 14 3 'Structure model' '_citation.journal_volume' 15 3 'Structure model' '_citation.title' # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 8QFH _pdbx_database_status.recvd_initial_deposition_date 2023-09-04 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site PDBE _pdbx_database_status.process_site PDBE _pdbx_database_status.status_code_cs ? _pdbx_database_status.status_code_nmr_data ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # _pdbx_contact_author.id 3 _pdbx_contact_author.email robin.schubert@xfel.eu _pdbx_contact_author.name_first Robin _pdbx_contact_author.name_last Schubert _pdbx_contact_author.name_mi ? _pdbx_contact_author.role 'principal investigator/group leader' _pdbx_contact_author.identifier_ORCID 0000-0002-6213-2872 # loop_ _audit_author.name _audit_author.pdbx_ordinal _audit_author.identifier_ORCID 'Chretien, A.' 1 0000-0001-8480-1443 'Nagel, M.F.' 2 ? 'Botha, S.' 3 ? 'de Wijn, R.' 4 ? 'Brings, L.' 5 ? 'Doerner, K.' 6 ? 'Han, H.' 7 ? 'C.P.Koliyadu, J.' 8 ? 'Letrun, R.' 9 ? 'Round, A.' 10 ? 'Sato, T.' 11 ? 'Schmidt, C.' 12 ? 'Secareanu, R.' 13 ? 'von Stetten, D.' 14 ? 'Vakili, M.' 15 ? 'Wrona, A.' 16 ? 'Bean, R.' 17 ? 'Mancuso, A.' 18 ? 'Schulz, J.' 19 ? 'R.Pearson, A.' 20 ? 'Kottke, T.' 21 ? 'Lorenzen, K.' 22 ? 'Schubert, R.' 23 0000-0002-6213-2872 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country UK _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev J.Mol.Biol. _citation.journal_id_ASTM JMOBAK _citation.journal_id_CSD 0070 _citation.journal_id_ISSN 1089-8638 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 436 _citation.language ? _citation.page_first 168439 _citation.page_last 168439 _citation.title 'Light-induced Trp in /Met out Switching During BLUF Domain Activation in ATP-bound Photoactivatable Adenylate Cyclase OaPAC.' _citation.year 2024 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1016/j.jmb.2024.168439 _citation.pdbx_database_id_PubMed 38185322 _citation.pdbx_database_id_patent ? _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal _citation_author.identifier_ORCID primary 'Chretien, A.' 1 ? primary 'Nagel, M.F.' 2 ? primary 'Botha, S.' 3 ? primary 'de Wijn, R.' 4 ? primary 'Brings, L.' 5 ? primary 'Dorner, K.' 6 ? primary 'Han, H.' 7 ? primary 'Koliyadu, J.C.P.' 8 ? primary 'Letrun, R.' 9 ? primary 'Round, A.' 10 ? primary 'Sato, T.' 11 ? primary 'Schmidt, C.' 12 ? primary 'Secareanu, R.C.' 13 ? primary 'von Stetten, D.' 14 ? primary 'Vakili, M.' 15 ? primary 'Wrona, A.' 16 ? primary 'Bean, R.' 17 ? primary 'Mancuso, A.' 18 ? primary 'Schulz, J.' 19 ? primary 'Pearson, A.R.' 20 ? primary 'Kottke, T.' 21 ? primary 'Lorenzen, K.' 22 ? primary 'Schubert, R.' 23 ? # 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 'Family 3 adenylate cyclase' 39292.848 1 ? ? ? ? 2 non-polymer syn 'FLAVIN MONONUCLEOTIDE' 456.344 1 ? ? ? ? 3 non-polymer syn "ADENOSINE-5'-TRIPHOSPHATE" 507.181 1 ? ? ? ? 4 non-polymer syn 'MAGNESIUM ION' 24.305 2 ? ? ? ? 5 water nat water 18.015 81 ? ? ? ? # _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 ;MKRLTYISKFSRPLSGDEIEAIGRISSQKNQQANVTGVLLCLDGIFFQILEGEAEKIDRIYERILADERHTDILCLKSEV EVQERMFPDWSMQTINLDENTDFLIRPIKVLLQTLTESHRILEKYTQPSIFKIISQGTNPLNIRPKAVEKIVFFSDIVSF STFAEKLPVEEVVSVVNSYFSVCTAIITRQGGEVTKFIGDCVMAYFDGDCADQAIQASLDILMELEILRNSAPEGSPLRV LYSGIGLAKGKVIEGNIGSELKRDYTILGDAVNVAARLEALTRQLSQALVFSSEVKNSATKSWNFIWLTDSELKGKSESI DIYSIDNEMTRKSSGGLEIARNIGHYLERV ; _entity_poly.pdbx_seq_one_letter_code_can ;MKRLTYISKFSRPLSGDEIEAIGRISSQKNQQANVTGVLLCLDGIFFQILEGEAEKIDRIYERILADERHTDILCLKSEV EVQERMFPDWSMQTINLDENTDFLIRPIKVLLQTLTESHRILEKYTQPSIFKIISQGTNPLNIRPKAVEKIVFFSDIVSF STFAEKLPVEEVVSVVNSYFSVCTAIITRQGGEVTKFIGDCVMAYFDGDCADQAIQASLDILMELEILRNSAPEGSPLRV LYSGIGLAKGKVIEGNIGSELKRDYTILGDAVNVAARLEALTRQLSQALVFSSEVKNSATKSWNFIWLTDSELKGKSESI DIYSIDNEMTRKSSGGLEIARNIGHYLERV ; _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 'FLAVIN MONONUCLEOTIDE' FMN 3 "ADENOSINE-5'-TRIPHOSPHATE" ATP 4 'MAGNESIUM ION' MG 5 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 LYS n 1 3 ARG n 1 4 LEU n 1 5 THR n 1 6 TYR n 1 7 ILE n 1 8 SER n 1 9 LYS n 1 10 PHE n 1 11 SER n 1 12 ARG n 1 13 PRO n 1 14 LEU n 1 15 SER n 1 16 GLY n 1 17 ASP n 1 18 GLU n 1 19 ILE n 1 20 GLU n 1 21 ALA n 1 22 ILE n 1 23 GLY n 1 24 ARG n 1 25 ILE n 1 26 SER n 1 27 SER n 1 28 GLN n 1 29 LYS n 1 30 ASN n 1 31 GLN n 1 32 GLN n 1 33 ALA n 1 34 ASN n 1 35 VAL n 1 36 THR n 1 37 GLY n 1 38 VAL n 1 39 LEU n 1 40 LEU n 1 41 CYS n 1 42 LEU n 1 43 ASP n 1 44 GLY n 1 45 ILE n 1 46 PHE n 1 47 PHE n 1 48 GLN n 1 49 ILE n 1 50 LEU n 1 51 GLU n 1 52 GLY n 1 53 GLU n 1 54 ALA n 1 55 GLU n 1 56 LYS n 1 57 ILE n 1 58 ASP n 1 59 ARG n 1 60 ILE n 1 61 TYR n 1 62 GLU n 1 63 ARG n 1 64 ILE n 1 65 LEU n 1 66 ALA n 1 67 ASP n 1 68 GLU n 1 69 ARG n 1 70 HIS n 1 71 THR n 1 72 ASP n 1 73 ILE n 1 74 LEU n 1 75 CYS n 1 76 LEU n 1 77 LYS n 1 78 SER n 1 79 GLU n 1 80 VAL n 1 81 GLU n 1 82 VAL n 1 83 GLN n 1 84 GLU n 1 85 ARG n 1 86 MET n 1 87 PHE n 1 88 PRO n 1 89 ASP n 1 90 TRP n 1 91 SER n 1 92 MET n 1 93 GLN n 1 94 THR n 1 95 ILE n 1 96 ASN n 1 97 LEU n 1 98 ASP n 1 99 GLU n 1 100 ASN n 1 101 THR n 1 102 ASP n 1 103 PHE n 1 104 LEU n 1 105 ILE n 1 106 ARG n 1 107 PRO n 1 108 ILE n 1 109 LYS n 1 110 VAL n 1 111 LEU n 1 112 LEU n 1 113 GLN n 1 114 THR n 1 115 LEU n 1 116 THR n 1 117 GLU n 1 118 SER n 1 119 HIS n 1 120 ARG n 1 121 ILE n 1 122 LEU n 1 123 GLU n 1 124 LYS n 1 125 TYR n 1 126 THR n 1 127 GLN n 1 128 PRO n 1 129 SER n 1 130 ILE n 1 131 PHE n 1 132 LYS n 1 133 ILE n 1 134 ILE n 1 135 SER n 1 136 GLN n 1 137 GLY n 1 138 THR n 1 139 ASN n 1 140 PRO n 1 141 LEU n 1 142 ASN n 1 143 ILE n 1 144 ARG n 1 145 PRO n 1 146 LYS n 1 147 ALA n 1 148 VAL n 1 149 GLU n 1 150 LYS n 1 151 ILE n 1 152 VAL n 1 153 PHE n 1 154 PHE n 1 155 SER n 1 156 ASP n 1 157 ILE n 1 158 VAL n 1 159 SER n 1 160 PHE n 1 161 SER n 1 162 THR n 1 163 PHE n 1 164 ALA n 1 165 GLU n 1 166 LYS n 1 167 LEU n 1 168 PRO n 1 169 VAL n 1 170 GLU n 1 171 GLU n 1 172 VAL n 1 173 VAL n 1 174 SER n 1 175 VAL n 1 176 VAL n 1 177 ASN n 1 178 SER n 1 179 TYR n 1 180 PHE n 1 181 SER n 1 182 VAL n 1 183 CYS n 1 184 THR n 1 185 ALA n 1 186 ILE n 1 187 ILE n 1 188 THR n 1 189 ARG n 1 190 GLN n 1 191 GLY n 1 192 GLY n 1 193 GLU n 1 194 VAL n 1 195 THR n 1 196 LYS n 1 197 PHE n 1 198 ILE n 1 199 GLY n 1 200 ASP n 1 201 CYS n 1 202 VAL n 1 203 MET n 1 204 ALA n 1 205 TYR n 1 206 PHE n 1 207 ASP n 1 208 GLY n 1 209 ASP n 1 210 CYS n 1 211 ALA n 1 212 ASP n 1 213 GLN n 1 214 ALA n 1 215 ILE n 1 216 GLN n 1 217 ALA n 1 218 SER n 1 219 LEU n 1 220 ASP n 1 221 ILE n 1 222 LEU n 1 223 MET n 1 224 GLU n 1 225 LEU n 1 226 GLU n 1 227 ILE n 1 228 LEU n 1 229 ARG n 1 230 ASN n 1 231 SER n 1 232 ALA n 1 233 PRO n 1 234 GLU n 1 235 GLY n 1 236 SER n 1 237 PRO n 1 238 LEU n 1 239 ARG n 1 240 VAL n 1 241 LEU n 1 242 TYR n 1 243 SER n 1 244 GLY n 1 245 ILE n 1 246 GLY n 1 247 LEU n 1 248 ALA n 1 249 LYS n 1 250 GLY n 1 251 LYS n 1 252 VAL n 1 253 ILE n 1 254 GLU n 1 255 GLY n 1 256 ASN n 1 257 ILE n 1 258 GLY n 1 259 SER n 1 260 GLU n 1 261 LEU n 1 262 LYS n 1 263 ARG n 1 264 ASP n 1 265 TYR n 1 266 THR n 1 267 ILE n 1 268 LEU n 1 269 GLY n 1 270 ASP n 1 271 ALA n 1 272 VAL n 1 273 ASN n 1 274 VAL n 1 275 ALA n 1 276 ALA n 1 277 ARG n 1 278 LEU n 1 279 GLU n 1 280 ALA n 1 281 LEU n 1 282 THR n 1 283 ARG n 1 284 GLN n 1 285 LEU n 1 286 SER n 1 287 GLN n 1 288 ALA n 1 289 LEU n 1 290 VAL n 1 291 PHE n 1 292 SER n 1 293 SER n 1 294 GLU n 1 295 VAL n 1 296 LYS n 1 297 ASN n 1 298 SER n 1 299 ALA n 1 300 THR n 1 301 LYS n 1 302 SER n 1 303 TRP n 1 304 ASN n 1 305 PHE n 1 306 ILE n 1 307 TRP n 1 308 LEU n 1 309 THR n 1 310 ASP n 1 311 SER n 1 312 GLU n 1 313 LEU n 1 314 LYS n 1 315 GLY n 1 316 LYS n 1 317 SER n 1 318 GLU n 1 319 SER n 1 320 ILE n 1 321 ASP n 1 322 ILE n 1 323 TYR n 1 324 SER n 1 325 ILE n 1 326 ASP n 1 327 ASN n 1 328 GLU n 1 329 MET n 1 330 THR n 1 331 ARG n 1 332 LYS n 1 333 SER n 1 334 SER n 1 335 GLY n 1 336 GLY n 1 337 LEU n 1 338 GLU n 1 339 ILE n 1 340 ALA n 1 341 ARG n 1 342 ASN n 1 343 ILE n 1 344 GLY n 1 345 HIS n 1 346 TYR n 1 347 LEU n 1 348 GLU n 1 349 ARG n 1 350 VAL 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 350 _entity_src_gen.gene_src_common_name ? _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene Oscil6304_3613 _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 'Oscillatoria acuminata PCC 6304' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 56110 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 ATP non-polymer . "ADENOSINE-5'-TRIPHOSPHATE" ? 'C10 H16 N5 O13 P3' 507.181 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FMN non-polymer . 'FLAVIN MONONUCLEOTIDE' 'RIBOFLAVIN MONOPHOSPHATE' 'C17 H21 N4 O9 P' 456.344 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 MG non-polymer . 'MAGNESIUM ION' ? 'Mg 2' 24.305 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 1 1 MET MET A . n A 1 2 LYS 2 2 2 LYS LYS A . n A 1 3 ARG 3 3 3 ARG ARG A . n A 1 4 LEU 4 4 4 LEU LEU A . n A 1 5 THR 5 5 5 THR THR A . n A 1 6 TYR 6 6 6 TYR TYR A . n A 1 7 ILE 7 7 7 ILE ILE A . n A 1 8 SER 8 8 8 SER SER A . n A 1 9 LYS 9 9 9 LYS LYS A . n A 1 10 PHE 10 10 10 PHE PHE A . n A 1 11 SER 11 11 11 SER SER A . n A 1 12 ARG 12 12 12 ARG ARG A . n A 1 13 PRO 13 13 13 PRO PRO A . n A 1 14 LEU 14 14 14 LEU LEU A . n A 1 15 SER 15 15 15 SER SER A . n A 1 16 GLY 16 16 16 GLY GLY A . n A 1 17 ASP 17 17 17 ASP ASP A . n A 1 18 GLU 18 18 18 GLU GLU A . n A 1 19 ILE 19 19 19 ILE ILE A . n A 1 20 GLU 20 20 20 GLU GLU A . n A 1 21 ALA 21 21 21 ALA ALA A . n A 1 22 ILE 22 22 22 ILE ILE A . n A 1 23 GLY 23 23 23 GLY GLY A . n A 1 24 ARG 24 24 24 ARG ARG A . n A 1 25 ILE 25 25 25 ILE ILE A . n A 1 26 SER 26 26 26 SER SER A . n A 1 27 SER 27 27 27 SER SER A . n A 1 28 GLN 28 28 28 GLN GLN A . n A 1 29 LYS 29 29 29 LYS LYS A . n A 1 30 ASN 30 30 30 ASN ASN A . n A 1 31 GLN 31 31 31 GLN GLN A . n A 1 32 GLN 32 32 32 GLN GLN A . n A 1 33 ALA 33 33 33 ALA ALA A . n A 1 34 ASN 34 34 34 ASN ASN A . n A 1 35 VAL 35 35 35 VAL VAL A . n A 1 36 THR 36 36 36 THR THR A . n A 1 37 GLY 37 37 37 GLY GLY A . n A 1 38 VAL 38 38 38 VAL VAL A . n A 1 39 LEU 39 39 39 LEU LEU A . n A 1 40 LEU 40 40 40 LEU LEU A . n A 1 41 CYS 41 41 41 CYS CYS A . n A 1 42 LEU 42 42 42 LEU LEU A . n A 1 43 ASP 43 43 43 ASP ASP A . n A 1 44 GLY 44 44 44 GLY GLY A . n A 1 45 ILE 45 45 45 ILE ILE A . n A 1 46 PHE 46 46 46 PHE PHE A . n A 1 47 PHE 47 47 47 PHE PHE A . n A 1 48 GLN 48 48 48 GLN GLN A . n A 1 49 ILE 49 49 49 ILE ILE A . n A 1 50 LEU 50 50 50 LEU LEU A . n A 1 51 GLU 51 51 51 GLU GLU A . n A 1 52 GLY 52 52 52 GLY GLY A . n A 1 53 GLU 53 53 53 GLU GLU A . n A 1 54 ALA 54 54 54 ALA ALA A . n A 1 55 GLU 55 55 55 GLU GLU A . n A 1 56 LYS 56 56 56 LYS LYS A . n A 1 57 ILE 57 57 57 ILE ILE A . n A 1 58 ASP 58 58 58 ASP ASP A . n A 1 59 ARG 59 59 59 ARG ARG A . n A 1 60 ILE 60 60 60 ILE ILE A . n A 1 61 TYR 61 61 61 TYR TYR A . n A 1 62 GLU 62 62 62 GLU GLU A . n A 1 63 ARG 63 63 63 ARG ARG A . n A 1 64 ILE 64 64 64 ILE ILE A . n A 1 65 LEU 65 65 65 LEU LEU A . n A 1 66 ALA 66 66 66 ALA ALA A . n A 1 67 ASP 67 67 67 ASP ASP A . n A 1 68 GLU 68 68 68 GLU GLU A . n A 1 69 ARG 69 69 69 ARG ARG A . n A 1 70 HIS 70 70 70 HIS HIS A . n A 1 71 THR 71 71 71 THR THR A . n A 1 72 ASP 72 72 72 ASP ASP A . n A 1 73 ILE 73 73 73 ILE ILE A . n A 1 74 LEU 74 74 74 LEU LEU A . n A 1 75 CYS 75 75 75 CYS CYS A . n A 1 76 LEU 76 76 76 LEU LEU A . n A 1 77 LYS 77 77 77 LYS LYS A . n A 1 78 SER 78 78 78 SER SER A . n A 1 79 GLU 79 79 79 GLU GLU A . n A 1 80 VAL 80 80 80 VAL VAL A . n A 1 81 GLU 81 81 81 GLU GLU A . n A 1 82 VAL 82 82 82 VAL VAL A . n A 1 83 GLN 83 83 83 GLN GLN A . n A 1 84 GLU 84 84 84 GLU GLU A . n A 1 85 ARG 85 85 85 ARG ARG A . n A 1 86 MET 86 86 86 MET MET A . n A 1 87 PHE 87 87 87 PHE PHE A . n A 1 88 PRO 88 88 88 PRO PRO A . n A 1 89 ASP 89 89 89 ASP ASP A . n A 1 90 TRP 90 90 90 TRP TRP A . n A 1 91 SER 91 91 91 SER SER A . n A 1 92 MET 92 92 92 MET MET A . n A 1 93 GLN 93 93 93 GLN GLN A . n A 1 94 THR 94 94 94 THR THR A . n A 1 95 ILE 95 95 95 ILE ILE A . n A 1 96 ASN 96 96 96 ASN ASN A . n A 1 97 LEU 97 97 97 LEU LEU A . n A 1 98 ASP 98 98 98 ASP ASP A . n A 1 99 GLU 99 99 99 GLU GLU A . n A 1 100 ASN 100 100 100 ASN ASN A . n A 1 101 THR 101 101 101 THR THR A . n A 1 102 ASP 102 102 102 ASP ASP A . n A 1 103 PHE 103 103 103 PHE PHE A . n A 1 104 LEU 104 104 104 LEU LEU A . n A 1 105 ILE 105 105 105 ILE ILE A . n A 1 106 ARG 106 106 106 ARG ARG A . n A 1 107 PRO 107 107 107 PRO PRO A . n A 1 108 ILE 108 108 108 ILE ILE A . n A 1 109 LYS 109 109 109 LYS LYS A . n A 1 110 VAL 110 110 110 VAL VAL A . n A 1 111 LEU 111 111 111 LEU LEU A . n A 1 112 LEU 112 112 112 LEU LEU A . n A 1 113 GLN 113 113 113 GLN GLN A . n A 1 114 THR 114 114 114 THR THR A . n A 1 115 LEU 115 115 115 LEU LEU A . n A 1 116 THR 116 116 116 THR THR A . n A 1 117 GLU 117 117 117 GLU GLU A . n A 1 118 SER 118 118 118 SER SER A . n A 1 119 HIS 119 119 119 HIS HIS A . n A 1 120 ARG 120 120 120 ARG ARG A . n A 1 121 ILE 121 121 121 ILE ILE A . n A 1 122 LEU 122 122 122 LEU LEU A . n A 1 123 GLU 123 123 123 GLU GLU A . n A 1 124 LYS 124 124 124 LYS LYS A . n A 1 125 TYR 125 125 125 TYR TYR A . n A 1 126 THR 126 126 126 THR THR A . n A 1 127 GLN 127 127 127 GLN GLN A . n A 1 128 PRO 128 128 128 PRO PRO A . n A 1 129 SER 129 129 129 SER SER A . n A 1 130 ILE 130 130 130 ILE ILE A . n A 1 131 PHE 131 131 131 PHE PHE A . n A 1 132 LYS 132 132 132 LYS LYS A . n A 1 133 ILE 133 133 133 ILE ILE A . n A 1 134 ILE 134 134 134 ILE ILE A . n A 1 135 SER 135 135 135 SER SER A . n A 1 136 GLN 136 136 136 GLN GLN A . n A 1 137 GLY 137 137 137 GLY GLY A . n A 1 138 THR 138 138 138 THR THR A . n A 1 139 ASN 139 139 139 ASN ASN A . n A 1 140 PRO 140 140 140 PRO PRO A . n A 1 141 LEU 141 141 141 LEU LEU A . n A 1 142 ASN 142 142 142 ASN ASN A . n A 1 143 ILE 143 143 143 ILE ILE A . n A 1 144 ARG 144 144 144 ARG ARG A . n A 1 145 PRO 145 145 145 PRO PRO A . n A 1 146 LYS 146 146 146 LYS LYS A . n A 1 147 ALA 147 147 147 ALA ALA A . n A 1 148 VAL 148 148 148 VAL VAL A . n A 1 149 GLU 149 149 149 GLU GLU A . n A 1 150 LYS 150 150 150 LYS LYS A . n A 1 151 ILE 151 151 151 ILE ILE A . n A 1 152 VAL 152 152 152 VAL VAL A . n A 1 153 PHE 153 153 153 PHE PHE A . n A 1 154 PHE 154 154 154 PHE PHE A . n A 1 155 SER 155 155 155 SER SER A . n A 1 156 ASP 156 156 156 ASP ASP A . n A 1 157 ILE 157 157 157 ILE ILE A . n A 1 158 VAL 158 158 158 VAL VAL A . n A 1 159 SER 159 159 159 SER SER A . n A 1 160 PHE 160 160 160 PHE PHE A . n A 1 161 SER 161 161 161 SER SER A . n A 1 162 THR 162 162 162 THR THR A . n A 1 163 PHE 163 163 163 PHE PHE A . n A 1 164 ALA 164 164 164 ALA ALA A . n A 1 165 GLU 165 165 165 GLU GLU A . n A 1 166 LYS 166 166 166 LYS LYS A . n A 1 167 LEU 167 167 167 LEU LEU A . n A 1 168 PRO 168 168 168 PRO PRO A . n A 1 169 VAL 169 169 169 VAL VAL A . n A 1 170 GLU 170 170 170 GLU GLU A . n A 1 171 GLU 171 171 171 GLU GLU A . n A 1 172 VAL 172 172 172 VAL VAL A . n A 1 173 VAL 173 173 173 VAL VAL A . n A 1 174 SER 174 174 174 SER SER A . n A 1 175 VAL 175 175 175 VAL VAL A . n A 1 176 VAL 176 176 176 VAL VAL A . n A 1 177 ASN 177 177 177 ASN ASN A . n A 1 178 SER 178 178 178 SER SER A . n A 1 179 TYR 179 179 179 TYR TYR A . n A 1 180 PHE 180 180 180 PHE PHE A . n A 1 181 SER 181 181 181 SER SER A . n A 1 182 VAL 182 182 182 VAL VAL A . n A 1 183 CYS 183 183 183 CYS CYS A . n A 1 184 THR 184 184 184 THR THR A . n A 1 185 ALA 185 185 185 ALA ALA A . n A 1 186 ILE 186 186 186 ILE ILE A . n A 1 187 ILE 187 187 187 ILE ILE A . n A 1 188 THR 188 188 188 THR THR A . n A 1 189 ARG 189 189 189 ARG ARG A . n A 1 190 GLN 190 190 190 GLN GLN A . n A 1 191 GLY 191 191 191 GLY GLY A . n A 1 192 GLY 192 192 192 GLY GLY A . n A 1 193 GLU 193 193 193 GLU GLU A . n A 1 194 VAL 194 194 194 VAL VAL A . n A 1 195 THR 195 195 195 THR THR A . n A 1 196 LYS 196 196 196 LYS LYS A . n A 1 197 PHE 197 197 197 PHE PHE A . n A 1 198 ILE 198 198 198 ILE ILE A . n A 1 199 GLY 199 199 199 GLY GLY A . n A 1 200 ASP 200 200 200 ASP ASP A . n A 1 201 CYS 201 201 201 CYS CYS A . n A 1 202 VAL 202 202 202 VAL VAL A . n A 1 203 MET 203 203 203 MET MET A . n A 1 204 ALA 204 204 204 ALA ALA A . n A 1 205 TYR 205 205 205 TYR TYR A . n A 1 206 PHE 206 206 206 PHE PHE A . n A 1 207 ASP 207 207 207 ASP ASP A . n A 1 208 GLY 208 208 208 GLY GLY A . n A 1 209 ASP 209 209 209 ASP ASP A . n A 1 210 CYS 210 210 210 CYS CYS A . n A 1 211 ALA 211 211 211 ALA ALA A . n A 1 212 ASP 212 212 212 ASP ASP A . n A 1 213 GLN 213 213 213 GLN GLN A . n A 1 214 ALA 214 214 214 ALA ALA A . n A 1 215 ILE 215 215 215 ILE ILE A . n A 1 216 GLN 216 216 216 GLN GLN A . n A 1 217 ALA 217 217 217 ALA ALA A . n A 1 218 SER 218 218 218 SER SER A . n A 1 219 LEU 219 219 219 LEU LEU A . n A 1 220 ASP 220 220 220 ASP ASP A . n A 1 221 ILE 221 221 221 ILE ILE A . n A 1 222 LEU 222 222 222 LEU LEU A . n A 1 223 MET 223 223 223 MET MET A . n A 1 224 GLU 224 224 224 GLU GLU A . n A 1 225 LEU 225 225 225 LEU LEU A . n A 1 226 GLU 226 226 226 GLU GLU A . n A 1 227 ILE 227 227 227 ILE ILE A . n A 1 228 LEU 228 228 228 LEU LEU A . n A 1 229 ARG 229 229 229 ARG ARG A . n A 1 230 ASN 230 230 230 ASN ASN A . n A 1 231 SER 231 231 231 SER SER A . n A 1 232 ALA 232 232 232 ALA ALA A . n A 1 233 PRO 233 233 233 PRO PRO A . n A 1 234 GLU 234 234 234 GLU GLU A . n A 1 235 GLY 235 235 235 GLY GLY A . n A 1 236 SER 236 236 236 SER SER A . n A 1 237 PRO 237 237 237 PRO PRO A . n A 1 238 LEU 238 238 238 LEU LEU A . n A 1 239 ARG 239 239 239 ARG ARG A . n A 1 240 VAL 240 240 240 VAL VAL A . n A 1 241 LEU 241 241 241 LEU LEU A . n A 1 242 TYR 242 242 242 TYR TYR A . n A 1 243 SER 243 243 243 SER SER A . n A 1 244 GLY 244 244 244 GLY GLY A . n A 1 245 ILE 245 245 245 ILE ILE A . n A 1 246 GLY 246 246 246 GLY GLY A . n A 1 247 LEU 247 247 247 LEU LEU A . n A 1 248 ALA 248 248 248 ALA ALA A . n A 1 249 LYS 249 249 249 LYS LYS A . n A 1 250 GLY 250 250 250 GLY GLY A . n A 1 251 LYS 251 251 251 LYS LYS A . n A 1 252 VAL 252 252 252 VAL VAL A . n A 1 253 ILE 253 253 253 ILE ILE A . n A 1 254 GLU 254 254 254 GLU GLU A . n A 1 255 GLY 255 255 255 GLY GLY A . n A 1 256 ASN 256 256 256 ASN ASN A . n A 1 257 ILE 257 257 257 ILE ILE A . n A 1 258 GLY 258 258 258 GLY GLY A . n A 1 259 SER 259 259 259 SER SER A . n A 1 260 GLU 260 260 260 GLU GLU A . n A 1 261 LEU 261 261 261 LEU LEU A . n A 1 262 LYS 262 262 262 LYS LYS A . n A 1 263 ARG 263 263 263 ARG ARG A . n A 1 264 ASP 264 264 264 ASP ASP A . n A 1 265 TYR 265 265 265 TYR TYR A . n A 1 266 THR 266 266 266 THR THR A . n A 1 267 ILE 267 267 267 ILE ILE A . n A 1 268 LEU 268 268 268 LEU LEU A . n A 1 269 GLY 269 269 269 GLY GLY A . n A 1 270 ASP 270 270 270 ASP ASP A . n A 1 271 ALA 271 271 271 ALA ALA A . n A 1 272 VAL 272 272 272 VAL VAL A . n A 1 273 ASN 273 273 273 ASN ASN A . n A 1 274 VAL 274 274 274 VAL VAL A . n A 1 275 ALA 275 275 275 ALA ALA A . n A 1 276 ALA 276 276 276 ALA ALA A . n A 1 277 ARG 277 277 277 ARG ARG A . n A 1 278 LEU 278 278 278 LEU LEU A . n A 1 279 GLU 279 279 279 GLU GLU A . n A 1 280 ALA 280 280 280 ALA ALA A . n A 1 281 LEU 281 281 281 LEU LEU A . n A 1 282 THR 282 282 282 THR THR A . n A 1 283 ARG 283 283 283 ARG ARG A . n A 1 284 GLN 284 284 284 GLN GLN A . n A 1 285 LEU 285 285 285 LEU LEU A . n A 1 286 SER 286 286 286 SER SER A . n A 1 287 GLN 287 287 287 GLN GLN A . n A 1 288 ALA 288 288 288 ALA ALA A . n A 1 289 LEU 289 289 289 LEU LEU A . n A 1 290 VAL 290 290 290 VAL VAL A . n A 1 291 PHE 291 291 291 PHE PHE A . n A 1 292 SER 292 292 292 SER SER A . n A 1 293 SER 293 293 293 SER SER A . n A 1 294 GLU 294 294 294 GLU GLU A . n A 1 295 VAL 295 295 295 VAL VAL A . n A 1 296 LYS 296 296 296 LYS LYS A . n A 1 297 ASN 297 297 297 ASN ASN A . n A 1 298 SER 298 298 298 SER SER A . n A 1 299 ALA 299 299 299 ALA ALA A . n A 1 300 THR 300 300 300 THR THR A . n A 1 301 LYS 301 301 301 LYS LYS A . n A 1 302 SER 302 302 302 SER SER A . n A 1 303 TRP 303 303 303 TRP TRP A . n A 1 304 ASN 304 304 304 ASN ASN A . n A 1 305 PHE 305 305 305 PHE PHE A . n A 1 306 ILE 306 306 306 ILE ILE A . n A 1 307 TRP 307 307 307 TRP TRP A . n A 1 308 LEU 308 308 308 LEU LEU A . n A 1 309 THR 309 309 309 THR THR A . n A 1 310 ASP 310 310 310 ASP ASP A . n A 1 311 SER 311 311 311 SER SER A . n A 1 312 GLU 312 312 312 GLU GLU A . n A 1 313 LEU 313 313 313 LEU LEU A . n A 1 314 LYS 314 314 314 LYS LYS A . n A 1 315 GLY 315 315 315 GLY GLY A . n A 1 316 LYS 316 316 316 LYS LYS A . n A 1 317 SER 317 317 317 SER SER A . n A 1 318 GLU 318 318 318 GLU GLU A . n A 1 319 SER 319 319 319 SER SER A . n A 1 320 ILE 320 320 320 ILE ILE A . n A 1 321 ASP 321 321 321 ASP ASP A . n A 1 322 ILE 322 322 322 ILE ILE A . n A 1 323 TYR 323 323 323 TYR TYR A . n A 1 324 SER 324 324 324 SER SER A . n A 1 325 ILE 325 325 325 ILE ILE A . n A 1 326 ASP 326 326 326 ASP ASP A . n A 1 327 ASN 327 327 327 ASN ASN A . n A 1 328 GLU 328 328 328 GLU GLU A . n A 1 329 MET 329 329 329 MET MET A . n A 1 330 THR 330 330 330 THR THR A . n A 1 331 ARG 331 331 331 ARG ARG A . n A 1 332 LYS 332 332 332 LYS LYS A . n A 1 333 SER 333 333 333 SER SER A . n A 1 334 SER 334 334 334 SER SER A . n A 1 335 GLY 335 335 335 GLY GLY A . n A 1 336 GLY 336 336 336 GLY GLY A . n A 1 337 LEU 337 337 337 LEU LEU A . n A 1 338 GLU 338 338 338 GLU GLU A . n A 1 339 ILE 339 339 339 ILE ILE A . n A 1 340 ALA 340 340 340 ALA ALA A . n A 1 341 ARG 341 341 341 ARG ARG A . n A 1 342 ASN 342 342 342 ASN ASN A . n A 1 343 ILE 343 343 343 ILE ILE A . n A 1 344 GLY 344 344 344 GLY GLY A . n A 1 345 HIS 345 345 345 HIS HIS A . n A 1 346 TYR 346 346 346 TYR TYR A . n A 1 347 LEU 347 347 347 LEU LEU A . n A 1 348 GLU 348 348 348 GLU GLU A . n A 1 349 ARG 349 349 349 ARG ARG A . n A 1 350 VAL 350 350 350 VAL VAL A . n # 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 FMN 1 401 1 FMN FMN A . C 3 ATP 1 402 2 ATP ATP A . D 4 MG 1 403 3 MG MG A . E 4 MG 1 404 4 MG MG A . F 5 HOH 1 501 52 HOH HOH A . F 5 HOH 2 502 35 HOH HOH A . F 5 HOH 3 503 48 HOH HOH A . F 5 HOH 4 504 43 HOH HOH A . F 5 HOH 5 505 36 HOH HOH A . F 5 HOH 6 506 65 HOH HOH A . F 5 HOH 7 507 72 HOH HOH A . F 5 HOH 8 508 76 HOH HOH A . F 5 HOH 9 509 71 HOH HOH A . F 5 HOH 10 510 67 HOH HOH A . F 5 HOH 11 511 49 HOH HOH A . F 5 HOH 12 512 56 HOH HOH A . F 5 HOH 13 513 54 HOH HOH A . F 5 HOH 14 514 13 HOH HOH A . F 5 HOH 15 515 45 HOH HOH A . F 5 HOH 16 516 30 HOH HOH A . F 5 HOH 17 517 64 HOH HOH A . F 5 HOH 18 518 37 HOH HOH A . F 5 HOH 19 519 80 HOH HOH A . F 5 HOH 20 520 22 HOH HOH A . F 5 HOH 21 521 47 HOH HOH A . F 5 HOH 22 522 8 HOH HOH A . F 5 HOH 23 523 39 HOH HOH A . F 5 HOH 24 524 16 HOH HOH A . F 5 HOH 25 525 68 HOH HOH A . F 5 HOH 26 526 9 HOH HOH A . F 5 HOH 27 527 62 HOH HOH A . F 5 HOH 28 528 42 HOH HOH A . F 5 HOH 29 529 4 HOH HOH A . F 5 HOH 30 530 2 HOH HOH A . F 5 HOH 31 531 20 HOH HOH A . F 5 HOH 32 532 19 HOH HOH A . F 5 HOH 33 533 17 HOH HOH A . F 5 HOH 34 534 27 HOH HOH A . F 5 HOH 35 535 11 HOH HOH A . F 5 HOH 36 536 31 HOH HOH A . F 5 HOH 37 537 50 HOH HOH A . F 5 HOH 38 538 23 HOH HOH A . F 5 HOH 39 539 10 HOH HOH A . F 5 HOH 40 540 63 HOH HOH A . F 5 HOH 41 541 28 HOH HOH A . F 5 HOH 42 542 40 HOH HOH A . F 5 HOH 43 543 74 HOH HOH A . F 5 HOH 44 544 3 HOH HOH A . F 5 HOH 45 545 5 HOH HOH A . F 5 HOH 46 546 6 HOH HOH A . F 5 HOH 47 547 38 HOH HOH A . F 5 HOH 48 548 7 HOH HOH A . F 5 HOH 49 549 34 HOH HOH A . F 5 HOH 50 550 51 HOH HOH A . F 5 HOH 51 551 14 HOH HOH A . F 5 HOH 52 552 18 HOH HOH A . F 5 HOH 53 553 12 HOH HOH A . F 5 HOH 54 554 44 HOH HOH A . F 5 HOH 55 555 26 HOH HOH A . F 5 HOH 56 556 24 HOH HOH A . F 5 HOH 57 557 75 HOH HOH A . F 5 HOH 58 558 81 HOH HOH A . F 5 HOH 59 559 41 HOH HOH A . F 5 HOH 60 560 58 HOH HOH A . F 5 HOH 61 561 15 HOH HOH A . F 5 HOH 62 562 55 HOH HOH A . F 5 HOH 63 563 1 HOH HOH A . F 5 HOH 64 564 21 HOH HOH A . F 5 HOH 65 565 57 HOH HOH A . F 5 HOH 66 566 46 HOH HOH A . F 5 HOH 67 567 25 HOH HOH A . F 5 HOH 68 568 29 HOH HOH A . F 5 HOH 69 569 53 HOH HOH A . F 5 HOH 70 570 79 HOH HOH A . F 5 HOH 71 571 59 HOH HOH A . F 5 HOH 72 572 66 HOH HOH A . F 5 HOH 73 573 33 HOH HOH A . F 5 HOH 74 574 61 HOH HOH A . F 5 HOH 75 575 60 HOH HOH A . F 5 HOH 76 576 32 HOH HOH A . F 5 HOH 77 577 69 HOH HOH A . F 5 HOH 78 578 73 HOH HOH A . F 5 HOH 79 579 78 HOH HOH A . F 5 HOH 80 580 70 HOH HOH A . F 5 HOH 81 581 77 HOH HOH A . # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 1 A GLU 62 ? CG ? A GLU 62 CG 2 1 Y 1 A GLU 62 ? CD ? A GLU 62 CD 3 1 Y 1 A GLU 62 ? OE1 ? A GLU 62 OE1 4 1 Y 1 A GLU 62 ? OE2 ? A GLU 62 OE2 5 1 Y 1 A THR 309 ? OG1 ? A THR 309 OG1 6 1 Y 1 A THR 309 ? CG2 ? A THR 309 CG2 7 1 Y 1 A ASP 310 ? CG ? A ASP 310 CG 8 1 Y 1 A ASP 310 ? OD1 ? A ASP 310 OD1 9 1 Y 1 A ASP 310 ? OD2 ? A ASP 310 OD2 10 1 Y 1 A SER 311 ? OG ? A SER 311 OG 11 1 Y 1 A GLU 312 ? CG ? A GLU 312 CG 12 1 Y 1 A GLU 312 ? CD ? A GLU 312 CD 13 1 Y 1 A GLU 312 ? OE1 ? A GLU 312 OE1 14 1 Y 1 A GLU 312 ? OE2 ? A GLU 312 OE2 15 1 Y 1 A LEU 313 ? CG ? A LEU 313 CG 16 1 Y 1 A LEU 313 ? CD1 ? A LEU 313 CD1 17 1 Y 1 A LEU 313 ? CD2 ? A LEU 313 CD2 18 1 Y 1 A LYS 314 ? CG ? A LYS 314 CG 19 1 Y 1 A LYS 314 ? CD ? A LYS 314 CD 20 1 Y 1 A LYS 314 ? CE ? A LYS 314 CE 21 1 Y 1 A LYS 314 ? NZ ? A LYS 314 NZ 22 1 Y 1 A LYS 316 ? CG ? A LYS 316 CG 23 1 Y 1 A LYS 316 ? CD ? A LYS 316 CD 24 1 Y 1 A LYS 316 ? CE ? A LYS 316 CE 25 1 Y 1 A LYS 316 ? NZ ? A LYS 316 NZ 26 1 Y 1 A SER 317 ? OG ? A SER 317 OG 27 1 Y 1 A GLU 318 ? CG ? A GLU 318 CG 28 1 Y 1 A GLU 318 ? CD ? A GLU 318 CD 29 1 Y 1 A GLU 318 ? OE1 ? A GLU 318 OE1 30 1 Y 1 A GLU 318 ? OE2 ? A GLU 318 OE2 31 1 Y 1 A SER 319 ? OG ? A SER 319 OG 32 1 Y 0 A SER 319 ? N ? A SER 319 N 33 1 Y 0 A SER 319 ? CA ? A SER 319 CA 34 1 Y 0 A SER 319 ? C ? A SER 319 C 35 1 Y 0 A SER 319 ? O ? A SER 319 O 36 1 Y 1 A ILE 320 ? CG1 ? A ILE 320 CG1 37 1 Y 1 A ILE 320 ? CG2 ? A ILE 320 CG2 38 1 Y 1 A ILE 320 ? CD1 ? A ILE 320 CD1 39 1 Y 1 A LYS 332 ? CG ? A LYS 332 CG 40 1 Y 1 A LYS 332 ? CD ? A LYS 332 CD 41 1 Y 1 A LYS 332 ? CE ? A LYS 332 CE 42 1 Y 1 A LYS 332 ? NZ ? A LYS 332 NZ 43 1 Y 1 A SER 333 ? OG ? A SER 333 OG 44 1 Y 1 A LEU 337 ? CG ? A LEU 337 CG 45 1 Y 1 A LEU 337 ? CD1 ? A LEU 337 CD1 46 1 Y 1 A LEU 337 ? CD2 ? A LEU 337 CD2 47 1 Y 1 A GLU 338 ? CG ? A GLU 338 CG 48 1 Y 1 A GLU 338 ? CD ? A GLU 338 CD 49 1 Y 1 A GLU 338 ? OE1 ? A GLU 338 OE1 50 1 Y 1 A GLU 338 ? OE2 ? A GLU 338 OE2 51 1 Y 1 A ARG 341 ? CG ? A ARG 341 CG 52 1 Y 1 A ARG 341 ? CD ? A ARG 341 CD 53 1 Y 1 A ARG 341 ? NE ? A ARG 341 NE 54 1 Y 1 A ARG 341 ? CZ ? A ARG 341 CZ 55 1 Y 1 A ARG 341 ? NH1 ? A ARG 341 NH1 56 1 Y 1 A ARG 341 ? NH2 ? A ARG 341 NH2 57 1 Y 1 A ASN 342 ? CG ? A ASN 342 CG 58 1 Y 1 A ASN 342 ? OD1 ? A ASN 342 OD1 59 1 Y 1 A ASN 342 ? ND2 ? A ASN 342 ND2 60 1 Y 1 A HIS 345 ? CG ? A HIS 345 CG 61 1 Y 1 A HIS 345 ? ND1 ? A HIS 345 ND1 62 1 Y 1 A HIS 345 ? CD2 ? A HIS 345 CD2 63 1 Y 1 A HIS 345 ? CE1 ? A HIS 345 CE1 64 1 Y 1 A HIS 345 ? NE2 ? A HIS 345 NE2 65 1 Y 1 A ARG 349 ? CG ? A ARG 349 CG 66 1 Y 1 A ARG 349 ? CD ? A ARG 349 CD 67 1 Y 1 A ARG 349 ? NE ? A ARG 349 NE 68 1 Y 1 A ARG 349 ? CZ ? A ARG 349 CZ 69 1 Y 1 A ARG 349 ? NH1 ? A ARG 349 NH1 70 1 Y 1 A ARG 349 ? NH2 ? A ARG 349 NH2 # 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 reduction' ? ? ? ? ? ? ? ? ? ? ? CrystFEL ? ? ? 0.10.1 1 ? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.20.1_4487 2 ? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot ? ? ? 0.9.8.7 3 # _cell.angle_alpha 90.000 _cell.angle_alpha_esd ? _cell.angle_beta 90.000 _cell.angle_beta_esd ? _cell.angle_gamma 90.000 _cell.angle_gamma_esd ? _cell.entry_id 8QFH _cell.details ? _cell.formula_units_Z ? _cell.length_a 54.300 _cell.length_a_esd ? _cell.length_b 145.800 _cell.length_b_esd ? _cell.length_c 105.300 _cell.length_c_esd ? _cell.volume 833653.782 _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 8QFH _symmetry.cell_setting ? _symmetry.Int_Tables_number 20 _symmetry.space_group_name_Hall 'C 2c 2' _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 8QFH _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 2.65 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 53.62 _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 'BATCH MODE' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH ? _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details ;45% protein at 12 mg/mL : 50 mM TRIS/HCl pH 8.5, 50 mM sodium chloride, 5 mM ATP 45% crystallization buffer : 100 mM SPG buffer pH 7.0, 1.2 M disodium succinate, 100 mM guanidine hydrochloride, 5 mM magnesium chloride 10% seeds from crushed macrocrystals ; _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.temp 277 # _diffrn.ambient_environment ? _diffrn.ambient_temp 293 _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 Y # _diffrn_detector.details ? _diffrn_detector.detector PIXEL _diffrn_detector.diffrn_id 1 _diffrn_detector.type AGIPD _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2021-05-06 _diffrn_detector.pdbx_frequency ? _diffrn_detector.id ? _diffrn_detector.number_of_axes ? # _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.3332 _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 'FREE ELECTRON LASER' _diffrn_source.target ? _diffrn_source.type 'EUROPEAN XFEL BEAMLINE SPB/SFX' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 1.3332 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline SPB/SFX _diffrn_source.pdbx_synchrotron_site 'European XFEL' # _reflns.B_iso_Wilson_estimate 31.44 _reflns.entry_id 8QFH _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 1.8 _reflns.d_resolution_low 31.63 _reflns.details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.number_all ? _reflns.number_obs 39352 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 100 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 3079 _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 11.6 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half 0.997 _reflns.pdbx_CC_star 0.999 _reflns.pdbx_R_split 0.054 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_CC_split_method ? _reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1] ? _reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2] ? _reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3] ? _reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1] ? _reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2] ? _reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3] ? _reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1] ? _reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2] ? _reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3] ? _reflns.pdbx_aniso_diffraction_limit_1 ? _reflns.pdbx_aniso_diffraction_limit_2 ? _reflns.pdbx_aniso_diffraction_limit_3 ? _reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1] ? _reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2] ? _reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3] ? _reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1] ? _reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2] ? _reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3] ? _reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1] ? _reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2] ? _reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3] ? _reflns.pdbx_aniso_B_tensor_eigenvalue_1 ? _reflns.pdbx_aniso_B_tensor_eigenvalue_2 ? _reflns.pdbx_aniso_B_tensor_eigenvalue_3 ? _reflns.pdbx_orthogonalization_convention ? _reflns.pdbx_percent_possible_ellipsoidal ? _reflns.pdbx_percent_possible_spherical ? _reflns.pdbx_percent_possible_ellipsoidal_anomalous ? _reflns.pdbx_percent_possible_spherical_anomalous ? _reflns.pdbx_redundancy_anomalous ? _reflns.pdbx_CC_half_anomalous ? _reflns.pdbx_absDiff_over_sigma_anomalous ? _reflns.pdbx_percent_possible_anomalous ? _reflns.pdbx_observed_signal_threshold ? _reflns.pdbx_signal_type ? _reflns.pdbx_signal_details ? _reflns.pdbx_signal_software_id ? # _reflns_shell.d_res_high 1.8 _reflns_shell.d_res_low 1.864 _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 3858 _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 1 _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_CC_half 0.876 _reflns_shell.pdbx_CC_star 0.966 _reflns_shell.pdbx_R_split ? _reflns_shell.percent_possible_all 100 _reflns_shell.Rmerge_I_all ? _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_percent_possible_ellipsoidal ? _reflns_shell.pdbx_percent_possible_spherical ? _reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous ? _reflns_shell.pdbx_percent_possible_spherical_anomalous ? _reflns_shell.pdbx_redundancy_anomalous ? _reflns_shell.pdbx_CC_half_anomalous ? _reflns_shell.pdbx_absDiff_over_sigma_anomalous ? _reflns_shell.pdbx_percent_possible_anomalous ? # _refine.aniso_B[1][1] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][2] ? _refine.aniso_B[2][3] ? _refine.aniso_B[3][3] ? _refine.B_iso_max ? _refine.B_iso_mean 58.54 _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.details ? _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 8QFH _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 1.80 _refine.ls_d_res_low 31.63 _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 39103 _refine.ls_number_reflns_R_free 3870 _refine.ls_number_reflns_R_work 35233 _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 99.80 _refine.ls_percent_reflns_R_free 9.90 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1708 _refine.ls_R_factor_R_free 0.1970 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.1679 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.pdbx_R_complete ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.63 _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model ? _refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2' _refine.pdbx_R_Free_selection_details ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_solvent_vdw_probe_radii 1.1000 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error 19.7447 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B ? _refine.overall_SU_ML 0.2066 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.details ? _refine_hist.d_res_high 1.80 _refine_hist.d_res_low 31.63 _refine_hist.number_atoms_solvent 81 _refine_hist.number_atoms_total 2837 _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 2692 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 64 _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' ? 0.0054 ? 3170 ? f_bond_d ? ? 'X-RAY DIFFRACTION' ? 0.8754 ? 4372 ? f_angle_d ? ? 'X-RAY DIFFRACTION' ? 0.0603 ? 502 ? f_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.0110 ? 561 ? f_plane_restr ? ? 'X-RAY DIFFRACTION' ? 7.9951 ? 474 ? f_dihedral_angle_d ? ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.R_factor_all _refine_ls_shell.R_factor_obs _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.R_factor_R_work _refine_ls_shell.redundancy_reflns_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.wR_factor_all _refine_ls_shell.wR_factor_obs _refine_ls_shell.wR_factor_R_free _refine_ls_shell.wR_factor_R_work _refine_ls_shell.pdbx_R_complete _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.pdbx_phase_error _refine_ls_shell.pdbx_fsc_work _refine_ls_shell.pdbx_fsc_free _refine_ls_shell.R_factor_R_free 'X-RAY DIFFRACTION' 1.80 1.82 . . 128 1273 99.93 . . . . 0.3416 . . . . . . . . . . . 0.3332 'X-RAY DIFFRACTION' 1.82 1.85 . . 120 1243 99.85 . . . . 0.3222 . . . . . . . . . . . 0.3740 'X-RAY DIFFRACTION' 1.85 1.87 . . 150 1242 99.93 . . . . 0.3045 . . . . . . . . . . . 0.3470 'X-RAY DIFFRACTION' 1.87 1.89 . . 119 1254 99.71 . . . . 0.2507 . . . . . . . . . . . 0.2834 'X-RAY DIFFRACTION' 1.89 1.92 . . 146 1218 99.93 . . . . 0.2012 . . . . . . . . . . . 0.2178 'X-RAY DIFFRACTION' 1.92 1.95 . . 134 1260 99.93 . . . . 0.1849 . . . . . . . . . . . 0.2360 'X-RAY DIFFRACTION' 1.95 1.98 . . 110 1263 99.93 . . . . 0.1761 . . . . . . . . . . . 0.2044 'X-RAY DIFFRACTION' 1.98 2.01 . . 148 1249 99.93 . . . . 0.1758 . . . . . . . . . . . 0.2108 'X-RAY DIFFRACTION' 2.01 2.05 . . 135 1246 99.93 . . . . 0.1769 . . . . . . . . . . . 0.2081 'X-RAY DIFFRACTION' 2.05 2.09 . . 138 1233 100.00 . . . . 0.1874 . . . . . . . . . . . 0.2301 'X-RAY DIFFRACTION' 2.09 2.13 . . 126 1240 99.93 . . . . 0.1946 . . . . . . . . . . . 0.2220 'X-RAY DIFFRACTION' 2.13 2.17 . . 141 1273 100.00 . . . . 0.1864 . . . . . . . . . . . 0.2063 'X-RAY DIFFRACTION' 2.17 2.22 . . 130 1232 98.84 . . . . 0.1937 . . . . . . . . . . . 0.2006 'X-RAY DIFFRACTION' 2.22 2.27 . . 145 1232 98.85 . . . . 0.1824 . . . . . . . . . . . 0.2414 'X-RAY DIFFRACTION' 2.27 2.32 . . 157 1216 99.85 . . . . 0.1600 . . . . . . . . . . . 0.2154 'X-RAY DIFFRACTION' 2.32 2.39 . . 122 1254 99.06 . . . . 0.1831 . . . . . . . . . . . 0.2209 'X-RAY DIFFRACTION' 2.39 2.46 . . 141 1254 99.64 . . . . 0.1822 . . . . . . . . . . . 0.2071 'X-RAY DIFFRACTION' 2.46 2.54 . . 135 1252 99.86 . . . . 0.1738 . . . . . . . . . . . 0.2280 'X-RAY DIFFRACTION' 2.54 2.63 . . 150 1253 100.00 . . . . 0.1715 . . . . . . . . . . . 0.2249 'X-RAY DIFFRACTION' 2.63 2.73 . . 142 1254 99.93 . . . . 0.1853 . . . . . . . . . . . 0.2157 'X-RAY DIFFRACTION' 2.73 2.86 . . 144 1267 99.93 . . . . 0.1741 . . . . . . . . . . . 0.2234 'X-RAY DIFFRACTION' 2.86 3.01 . . 137 1255 99.71 . . . . 0.1792 . . . . . . . . . . . 0.1801 'X-RAY DIFFRACTION' 3.01 3.20 . . 144 1266 100.00 . . . . 0.1666 . . . . . . . . . . . 0.2112 'X-RAY DIFFRACTION' 3.20 3.44 . . 132 1275 100.00 . . . . 0.1634 . . . . . . . . . . . 0.1674 'X-RAY DIFFRACTION' 3.44 3.79 . . 132 1288 100.00 . . . . 0.1431 . . . . . . . . . . . 0.1734 'X-RAY DIFFRACTION' 3.79 4.33 . . 145 1297 100.00 . . . . 0.1346 . . . . . . . . . . . 0.1428 'X-RAY DIFFRACTION' 4.34 5.46 . . 169 1278 100.00 . . . . 0.1272 . . . . . . . . . . . 0.1605 'X-RAY DIFFRACTION' 5.46 31.63 . . 150 1366 100.00 . . . . 0.1815 . . . . . . . . . . . 0.2170 # _struct.entry_id 8QFH _struct.title 'Room temperature crystal structure of the Photoactivated Adenylate Cyclase OaPAC with ATP bound' _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 8QFH _struct_keywords.text 'Photoreceptor, BLUF, Adenylate Cyclase, PAC, LYASE' _struct_keywords.pdbx_keywords LYASE # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 4 ? E N N 4 ? F N N 5 ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code K9TLZ5_9CYAN _struct_ref.pdbx_db_accession K9TLZ5 _struct_ref.pdbx_db_isoform ? _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;MKRLTYISKFSRPLSGDEIEAIGRISSQKNQQANVTGVLLCLDGIFFQILEGEAEKIDRIYERILADERHTDILCLKSEV EVQERMFPDWSMQTINLDENTDFLIRPIKVLLQTLTESHRILEKYTQPSIFKIISQGTNPLNIRPKAVEKIVFFSDIVSF STFAEKLPVEEVVSVVNSYFSVCTAIITRQGGEVTKFIGDCVMAYFDGDCADQAIQASLDILMELEILRNSAPEGSPLRV LYSGIGLAKGKVIEGNIGSELKRDYTILGDAVNVAARLEALTRQLSQALVFSSEVKNSATKSWNFIWLTDSELKGKSESI DIYSIDNEMTRKSSGGLEIARNIGHYLERV ; _struct_ref.pdbx_align_begin 1 # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 8QFH _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 350 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession K9TLZ5 _struct_ref_seq.db_align_beg 1 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 350 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 350 # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details dimeric _pdbx_struct_assembly.oligomeric_count 2 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1,2 A,B,C,D,E,F 1 3 A,B,C,D,E,F # loop_ _pdbx_struct_assembly_auth_evidence.id _pdbx_struct_assembly_auth_evidence.assembly_id _pdbx_struct_assembly_auth_evidence.experimental_support _pdbx_struct_assembly_auth_evidence.details 1 1 SAXS ? 2 1 'gel filtration' ? 3 1 'mass spectrometry' ? # loop_ _pdbx_struct_oper_list.id _pdbx_struct_oper_list.type _pdbx_struct_oper_list.name _pdbx_struct_oper_list.symmetry_operation _pdbx_struct_oper_list.matrix[1][1] _pdbx_struct_oper_list.matrix[1][2] _pdbx_struct_oper_list.matrix[1][3] _pdbx_struct_oper_list.vector[1] _pdbx_struct_oper_list.matrix[2][1] _pdbx_struct_oper_list.matrix[2][2] _pdbx_struct_oper_list.matrix[2][3] _pdbx_struct_oper_list.vector[2] _pdbx_struct_oper_list.matrix[3][1] _pdbx_struct_oper_list.matrix[3][2] _pdbx_struct_oper_list.matrix[3][3] _pdbx_struct_oper_list.vector[3] 1 'identity operation' 1_555 x,y,z 1.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 1.0 0.0 2 'point symmetry operation' ? ? -1.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 -1.0 -52.65 3 'point symmetry operation' ? ? -1.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 -1.0 -52.65 # 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 SER A 15 ? ASN A 34 ? SER A 15 ASN A 34 1 ? 20 HELX_P HELX_P2 AA2 GLU A 53 ? ALA A 66 ? GLU A 53 ALA A 66 1 ? 14 HELX_P HELX_P3 AA3 ASP A 98 ? ASN A 100 ? ASP A 98 ASN A 100 5 ? 3 HELX_P HELX_P4 AA4 LEU A 104 ? THR A 126 ? LEU A 104 THR A 126 1 ? 23 HELX_P HELX_P5 AA5 GLN A 127 ? GLN A 136 ? GLN A 127 GLN A 136 1 ? 10 HELX_P HELX_P6 AA6 ASN A 139 ? ILE A 143 ? ASN A 139 ILE A 143 5 ? 5 HELX_P HELX_P7 AA7 SER A 159 ? LEU A 167 ? SER A 159 LEU A 167 1 ? 9 HELX_P HELX_P8 AA8 PRO A 168 ? GLN A 190 ? PRO A 168 GLN A 190 1 ? 23 HELX_P HELX_P9 AA9 CYS A 210 ? ALA A 232 ? CYS A 210 ALA A 232 1 ? 23 HELX_P HELX_P10 AB1 SER A 236 ? LEU A 241 ? SER A 236 LEU A 241 5 ? 6 HELX_P HELX_P11 AB2 GLY A 269 ? THR A 282 ? GLY A 269 THR A 282 1 ? 14 HELX_P HELX_P12 AB3 SER A 293 ? ALA A 299 ? SER A 293 ALA A 299 1 ? 7 HELX_P HELX_P13 AB4 ASN A 327 ? LYS A 332 ? ASN A 327 LYS A 332 1 ? 6 HELX_P HELX_P14 AB5 LEU A 337 ? ARG A 349 ? LEU A 337 ARG A 349 1 ? 13 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order _struct_conn.pdbx_role metalc1 metalc ? ? A ASP 156 OD1 ? ? ? 1_555 D MG . MG ? ? A ASP 156 A MG 403 1_555 ? ? ? ? ? ? ? 2.001 ? ? metalc2 metalc ? ? A ASP 156 OD2 ? ? ? 1_555 E MG . MG ? ? A ASP 156 A MG 404 1_555 ? ? ? ? ? ? ? 2.335 ? ? metalc3 metalc ? ? A ILE 157 O ? ? ? 1_555 D MG . MG ? ? A ILE 157 A MG 403 1_555 ? ? ? ? ? ? ? 2.130 ? ? metalc4 metalc ? ? A ASP 200 OD2 ? ? ? 1_555 D MG . MG ? ? A ASP 200 A MG 403 1_555 ? ? ? ? ? ? ? 2.096 ? ? metalc5 metalc ? ? A ASP 200 OD1 ? ? ? 1_555 E MG . MG ? ? A ASP 200 A MG 404 1_555 ? ? ? ? ? ? ? 2.252 ? ? metalc6 metalc ? ? C ATP . O2G A ? ? 1_555 D MG . MG ? ? A ATP 402 A MG 403 1_555 ? ? ? ? ? ? ? 2.055 ? ? metalc7 metalc ? ? C ATP . O2G B ? ? 1_555 D MG . MG ? ? A ATP 402 A MG 403 1_555 ? ? ? ? ? ? ? 2.304 ? ? metalc8 metalc ? ? C ATP . O1B A ? ? 1_555 D MG . MG ? ? A ATP 402 A MG 403 1_555 ? ? ? ? ? ? ? 2.160 ? ? metalc9 metalc ? ? C ATP . O1B B ? ? 1_555 D MG . MG ? ? A ATP 402 A MG 403 1_555 ? ? ? ? ? ? ? 2.120 ? ? metalc10 metalc ? ? C ATP . O2A A ? ? 1_555 D MG . MG ? ? A ATP 402 A MG 403 1_555 ? ? ? ? ? ? ? 2.164 ? ? metalc11 metalc ? ? C ATP . O2A B ? ? 1_555 D MG . MG ? ? A ATP 402 A MG 403 1_555 ? ? ? ? ? ? ? 2.306 ? ? metalc12 metalc ? ? C ATP . O2A A ? ? 1_555 E MG . MG ? ? A ATP 402 A MG 404 1_555 ? ? ? ? ? ? ? 2.419 ? ? metalc13 metalc ? ? C ATP . O2A B ? ? 1_555 E MG . MG ? ? A ATP 402 A MG 404 1_555 ? ? ? ? ? ? ? 2.346 ? ? metalc14 metalc ? ? E MG . MG ? ? ? 1_555 F HOH . O ? ? A MG 404 A HOH 542 1_555 ? ? ? ? ? ? ? 2.408 ? ? metalc15 metalc ? ? E MG . MG ? ? ? 1_555 F HOH . O ? ? A MG 404 A HOH 566 1_555 ? ? ? ? ? ? ? 2.490 ? ? # _struct_conn_type.id metalc _struct_conn_type.criteria ? _struct_conn_type.reference ? # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O ? A ILE 157 ? A ILE 157 ? 1_555 84.3 ? 2 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 93.0 ? 3 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 91.5 ? 4 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G A C ATP . ? A ATP 402 ? 1_555 86.9 ? 5 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G A C ATP . ? A ATP 402 ? 1_555 90.8 ? 6 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G A C ATP . ? A ATP 402 ? 1_555 177.7 ? 7 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G B C ATP . ? A ATP 402 ? 1_555 87.2 ? 8 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G B C ATP . ? A ATP 402 ? 1_555 90.7 ? 9 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G B C ATP . ? A ATP 402 ? 1_555 177.8 ? 10 O2G A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2G B C ATP . ? A ATP 402 ? 1_555 0.3 ? 11 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B A C ATP . ? A ATP 402 ? 1_555 173.4 ? 12 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B A C ATP . ? A ATP 402 ? 1_555 89.6 ? 13 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B A C ATP . ? A ATP 402 ? 1_555 89.8 ? 14 O2G A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B A C ATP . ? A ATP 402 ? 1_555 90.5 ? 15 O2G B C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B A C ATP . ? A ATP 402 ? 1_555 90.2 ? 16 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B B C ATP . ? A ATP 402 ? 1_555 173.2 ? 17 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B B C ATP . ? A ATP 402 ? 1_555 94.3 ? 18 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B B C ATP . ? A ATP 402 ? 1_555 93.7 ? 19 O2G A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B B C ATP . ? A ATP 402 ? 1_555 86.4 ? 20 O2G B C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B B C ATP . ? A ATP 402 ? 1_555 86.1 ? 21 O1B A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O1B B C ATP . ? A ATP 402 ? 1_555 6.2 ? 22 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 101.1 ? 23 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 174.4 ? 24 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 89.6 ? 25 O2G A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 88.1 ? 26 O2G B C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 88.2 ? 27 O1B A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 84.9 ? 28 O1B B C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 80.2 ? 29 OD1 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 93.4 ? 30 O ? A ILE 157 ? A ILE 157 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 169.6 ? 31 OD2 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 98.8 ? 32 O2G A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 78.9 ? 33 O2G B C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 79.1 ? 34 O1B A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 92.1 ? 35 O1B B C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 86.8 ? 36 O2A A C ATP . ? A ATP 402 ? 1_555 MG ? D MG . ? A MG 403 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 11.6 ? 37 OD2 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 OD1 ? A ASP 200 ? A ASP 200 ? 1_555 95.5 ? 38 OD2 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 95.7 ? 39 OD1 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O2A A C ATP . ? A ATP 402 ? 1_555 83.3 ? 40 OD2 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 89.6 ? 41 OD1 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 93.3 ? 42 O2A A C ATP . ? A ATP 402 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O2A B C ATP . ? A ATP 402 ? 1_555 11.3 ? 43 OD2 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 542 ? 1_555 109.7 ? 44 OD1 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 542 ? 1_555 102.8 ? 45 O2A A C ATP . ? A ATP 402 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 542 ? 1_555 152.9 ? 46 O2A B C ATP . ? A ATP 402 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 542 ? 1_555 153.1 ? 47 OD2 ? A ASP 156 ? A ASP 156 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 566 ? 1_555 82.8 ? 48 OD1 ? A ASP 200 ? A ASP 200 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 566 ? 1_555 171.1 ? 49 O2A A C ATP . ? A ATP 402 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 566 ? 1_555 88.1 ? 50 O2A B C ATP . ? A ATP 402 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 566 ? 1_555 77.9 ? 51 O ? F HOH . ? A HOH 542 ? 1_555 MG ? E MG . ? A MG 404 ? 1_555 O ? F HOH . ? A HOH 566 ? 1_555 86.0 ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 5 ? AA2 ? 5 ? AA3 ? 7 ? # 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 ? parallel AA2 1 2 ? anti-parallel AA2 2 3 ? anti-parallel AA2 3 4 ? anti-parallel AA2 4 5 ? anti-parallel AA3 1 2 ? anti-parallel AA3 2 3 ? anti-parallel AA3 3 4 ? anti-parallel AA3 4 5 ? parallel AA3 5 6 ? anti-parallel AA3 6 7 ? 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 HIS A 70 ? VAL A 80 ? HIS A 70 VAL A 80 AA1 2 LYS A 2 ? PHE A 10 ? LYS A 2 PHE A 10 AA1 3 ILE A 45 ? GLY A 52 ? ILE A 45 GLY A 52 AA1 4 THR A 36 ? LEU A 42 ? THR A 36 LEU A 42 AA1 5 GLN A 93 ? ASN A 96 ? GLN A 93 ASN A 96 AA2 1 GLU A 193 ? ILE A 198 ? GLU A 193 ILE A 198 AA2 2 CYS A 201 ? ASP A 207 ? CYS A 201 ASP A 207 AA2 3 LYS A 146 ? ILE A 157 ? LYS A 146 ILE A 157 AA2 4 SER A 243 ? GLY A 258 ? SER A 243 GLY A 258 AA2 5 ARG A 263 ? LEU A 268 ? ARG A 263 LEU A 268 AA3 1 GLU A 193 ? ILE A 198 ? GLU A 193 ILE A 198 AA3 2 CYS A 201 ? ASP A 207 ? CYS A 201 ASP A 207 AA3 3 LYS A 146 ? ILE A 157 ? LYS A 146 ILE A 157 AA3 4 SER A 243 ? GLY A 258 ? SER A 243 GLY A 258 AA3 5 LEU A 289 ? SER A 292 ? LEU A 289 SER A 292 AA3 6 ILE A 322 ? ILE A 325 ? ILE A 322 ILE A 325 AA3 7 PHE A 305 ? LEU A 308 ? PHE A 305 LEU A 308 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id AA1 1 2 O GLU A 79 ? O GLU A 79 N ARG A 3 ? N ARG A 3 AA1 2 3 N LYS A 2 ? N LYS A 2 O GLY A 52 ? O GLY A 52 AA1 3 4 O PHE A 47 ? O PHE A 47 N LEU A 40 ? N LEU A 40 AA1 4 5 N LEU A 39 ? N LEU A 39 O GLN A 93 ? O GLN A 93 AA2 1 2 N ILE A 198 ? N ILE A 198 O CYS A 201 ? O CYS A 201 AA2 2 3 O ALA A 204 ? O ALA A 204 N PHE A 153 ? N PHE A 153 AA2 3 4 N VAL A 148 ? N VAL A 148 O VAL A 252 ? O VAL A 252 AA2 4 5 N ILE A 253 ? N ILE A 253 O LEU A 268 ? O LEU A 268 AA3 1 2 N ILE A 198 ? N ILE A 198 O CYS A 201 ? O CYS A 201 AA3 2 3 O ALA A 204 ? O ALA A 204 N PHE A 153 ? N PHE A 153 AA3 3 4 N VAL A 148 ? N VAL A 148 O VAL A 252 ? O VAL A 252 AA3 4 5 N ILE A 245 ? N ILE A 245 O VAL A 290 ? O VAL A 290 AA3 5 6 N PHE A 291 ? N PHE A 291 O TYR A 323 ? O TYR A 323 AA3 6 7 O ILE A 322 ? O ILE A 322 N LEU A 308 ? N LEU A 308 # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 O _pdbx_validate_close_contact.auth_asym_id_1 A _pdbx_validate_close_contact.auth_comp_id_1 ILE _pdbx_validate_close_contact.auth_seq_id_1 325 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 ? _pdbx_validate_close_contact.auth_atom_id_2 HG1 _pdbx_validate_close_contact.auth_asym_id_2 A _pdbx_validate_close_contact.auth_comp_id_2 THR _pdbx_validate_close_contact.auth_seq_id_2 330 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 1.58 # 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 MET A 92 ? ? -167.17 94.90 2 1 THR A 309 ? ? -93.17 50.68 3 1 GLU A 318 ? ? -149.31 47.47 4 1 SER A 319 ? ? 61.36 -158.90 5 1 ILE A 320 ? ? -175.05 131.07 6 1 LEU A 337 ? ? 73.35 -50.04 # loop_ _pdbx_validate_planes.id _pdbx_validate_planes.PDB_model_num _pdbx_validate_planes.auth_comp_id _pdbx_validate_planes.auth_asym_id _pdbx_validate_planes.auth_seq_id _pdbx_validate_planes.PDB_ins_code _pdbx_validate_planes.label_alt_id _pdbx_validate_planes.rmsd _pdbx_validate_planes.type 1 1 ARG A 144 ? ? 0.079 'SIDE CHAIN' 2 1 ARG A 239 ? ? 0.089 'SIDE CHAIN' # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id A _pdbx_struct_special_symmetry.auth_comp_id HOH _pdbx_struct_special_symmetry.auth_seq_id 580 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id F _pdbx_struct_special_symmetry.label_comp_id HOH _pdbx_struct_special_symmetry.label_seq_id . # loop_ _space_group_symop.id _space_group_symop.operation_xyz 1 x,y,z 2 x,-y,-z 3 -x,y,-z+1/2 4 -x,-y,z+1/2 5 x+1/2,y+1/2,z 6 x+1/2,-y+1/2,-z 7 -x+1/2,y+1/2,-z+1/2 8 -x+1/2,-y+1/2,z+1/2 # loop_ _pdbx_refine_tls.id _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[1][1]_esd _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][2]_esd _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[1][3]_esd _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[2][2]_esd _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.T[2][3]_esd _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[3][3]_esd _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[1][1]_esd _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][2]_esd _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[1][3]_esd _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[2][2]_esd _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.L[2][3]_esd _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[3][3]_esd _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][1]_esd _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][2]_esd _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[1][3]_esd _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][1]_esd _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][2]_esd _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][3]_esd _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][1]_esd _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][2]_esd _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[3][3]_esd 1 'X-RAY DIFFRACTION' ? refined -4.26794925351 -10.7547011512 -9.84001972521 0.511426568467 ? -0.0374253538467 ? 0.0168954279328 ? 0.368470596476 ? 0.0147646780734 ? 0.401721289259 ? 5.18681788697 ? 0.314326270359 ? 0.321799457456 ? 5.70885658726 ? -2.84511670941 ? 6.52762291562 ? 0.00308231481315 ? -0.304530101068 ? -0.103976199701 ? 0.174510872594 ? 0.0942087395221 ? 0.226243233303 ? 0.114280169934 ? -0.158041553422 ? -0.087471749014 ? 2 'X-RAY DIFFRACTION' ? refined 4.29169429525 -6.71185837601 -25.4947083991 0.644145308991 ? 0.0275399780558 ? -0.00136221649622 ? 0.374535015799 ? 0.0269706251013 ? 0.410353843438 ? 3.81690808939 ? 1.49756443528 ? 0.403586074439 ? 4.56832027886 ? 0.623959406858 ? 3.27849448218 ? 0.0188676544217 ? 0.0114327685426 ? -0.410572121124 ? 0.161317350371 ? 0.0456313655932 ? 0.0889394608303 ? 0.808639353292 ? 0.182089009152 ? -0.0439868268497 ? 3 'X-RAY DIFFRACTION' ? refined -12.8812034088 7.95657695684 -24.314202617 0.527355849792 ? -0.0522832095373 ? -0.0368461121121 ? 0.531236493539 ? 0.0655227361697 ? 0.62780105537 ? 6.13621883106 ? -5.46623066487 ? 4.65131305929 ? 4.90108845198 ? -4.05897857442 ? 3.70651746486 ? 0.161366816488 ? -0.682694817119 ? -0.507515250994 ? -0.0231366288909 ? 0.347691533555 ? 0.654936768497 ? 0.37008144361 ? -0.123100007065 ? -0.617930791574 ? 4 'X-RAY DIFFRACTION' ? refined 2.21442710377 26.0591379002 -11.8839686728 0.347894932873 ? -0.00373496045696 ? -0.0020207448221 ? 0.319009542605 ? -0.00496977993606 ? 0.336267726822 ? 2.35178359501 ? -0.192645600308 ? 0.651264030141 ? 1.50606597911 ? 0.27622842149 ? 1.76460581947 ? 0.0170853520366 ? 0.0379648218395 ? 0.0163620283488 ? 0.187011942973 ? 0.0477144613355 ? -0.0881708458462 ? 0.0516232633241 ? 0.0393361260464 ? -0.0655198005775 ? 5 'X-RAY DIFFRACTION' ? refined -9.23140120877 33.0236950431 -16.1829536784 0.351893931344 ? 0.0424984070559 ? 0.0314575694947 ? 0.423876947163 ? 0.0322164731985 ? 0.415592439027 ? 0.526239498684 ? 0.090957289126 ? -0.121818278133 ? 3.20131155208 ? 2.26377217762 ? 4.36049626207 ? 0.0436017007783 ? -0.00977754717247 ? 0.101515087986 ? -0.101451500503 ? 0.0198246424711 ? 0.0660873612473 ? -0.293932287964 ? -0.234263149226 ? -0.0515800808446 ? 6 'X-RAY DIFFRACTION' ? refined 4.59210298632 40.6205377256 -4.19968652496 1.49890011716 ? 0.183655526183 ? -0.108726794899 ? 1.09493114984 ? -0.29725615171 ? 1.47599964565 ? 1.45730451044 ? -0.881470354523 ? -0.174505664078 ? 1.57006823852 ? 0.601967406783 ? 0.31036541 ? 0.5956592517 ? 0.251019553918 ? 1.45316641221 ? 0.634371192838 ? -0.684247084968 ? 1.87201698003 ? -1.90541682981 ? -0.717011613589 ? 0.0036532281942 ? 7 'X-RAY DIFFRACTION' ? refined 20.0028141137 36.408307082 -10.6251288455 1.06130661623 ? -0.292078975526 ? -0.100774236827 ? 0.626995261684 ? -0.0425364933096 ? 1.06994206151 ? 9.12555387291 ? 5.58389230449 ? -0.377151649771 ? 5.21867495626 ? -3.09465799889 ? 4.65440016263 ? -1.16468137835 ? 1.16214772242 ? -1.19842043733 ? -1.20005589587 ? 0.374397595298 ? -0.339132236614 ? -0.682528949376 ? 1.02757807333 ? 0.80669434047 ? # 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 1 A 1 ? A 99 A 99 ? ? '(chain A and resid 1:99)' 2 'X-RAY DIFFRACTION' 2 A 100 A 100 ? A 128 A 128 ? ? '(chain A and resid 100:128)' 3 'X-RAY DIFFRACTION' 3 A 129 A 129 ? A 145 A 145 ? ? '(chain A and resid 129:145)' 4 'X-RAY DIFFRACTION' 4 A 146 A 146 ? A 250 A 250 ? ? '(chain A and resid 146:250)' 5 'X-RAY DIFFRACTION' 5 A 251 A 251 ? A 328 A 328 ? ? '(chain A and resid 251:328)' 6 'X-RAY DIFFRACTION' 6 A 329 A 329 ? A 339 A 339 ? ? '(chain A and resid 329:339)' 7 'X-RAY DIFFRACTION' 7 A 340 A 340 ? A 350 A 350 ? ? '(chain A and resid 340:350)' # _pdbx_entry_details.entry_id 8QFH _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ? _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? _pdbx_entry_details.has_ligand_of_interest Y _pdbx_entry_details.has_protein_modification ? # 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 0 A ASP 310 ? A ASP 310 2 1 Y 0 A SER 311 ? A SER 311 3 1 Y 0 A GLU 312 ? A GLU 312 4 1 Y 0 A LEU 313 ? A LEU 313 5 1 Y 0 A LYS 314 ? A LYS 314 6 1 Y 0 A GLY 315 ? A GLY 315 7 1 Y 0 A LYS 316 ? A LYS 316 8 1 Y 0 A SER 317 ? A SER 317 9 1 Y 0 A GLU 318 ? A GLU 318 # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.pdbx_aromatic_flag _chem_comp_atom.pdbx_stereo_config _chem_comp_atom.pdbx_ordinal ALA N N N N 1 ALA CA C N S 2 ALA C C N N 3 ALA O O N N 4 ALA CB C N N 5 ALA OXT O N N 6 ALA H H N N 7 ALA H2 H N N 8 ALA HA H N N 9 ALA HB1 H N N 10 ALA HB2 H N N 11 ALA HB3 H N N 12 ALA HXT H N N 13 ARG N N N N 14 ARG CA C N S 15 ARG C C N N 16 ARG O O N N 17 ARG CB C N N 18 ARG CG C N N 19 ARG CD C N N 20 ARG NE N N N 21 ARG CZ C N N 22 ARG NH1 N N N 23 ARG NH2 N N N 24 ARG OXT O N N 25 ARG H H N N 26 ARG H2 H N N 27 ARG HA H N N 28 ARG HB2 H N N 29 ARG HB3 H N N 30 ARG HG2 H N N 31 ARG HG3 H N N 32 ARG HD2 H N N 33 ARG HD3 H N N 34 ARG HE H N N 35 ARG HH11 H N N 36 ARG HH12 H N N 37 ARG HH21 H N N 38 ARG HH22 H N N 39 ARG HXT H N N 40 ASN N N N N 41 ASN CA C N S 42 ASN C C N N 43 ASN O O N N 44 ASN CB C N N 45 ASN CG C N N 46 ASN OD1 O N N 47 ASN ND2 N N N 48 ASN OXT O N N 49 ASN H H N N 50 ASN H2 H N N 51 ASN HA H N N 52 ASN HB2 H N N 53 ASN HB3 H N N 54 ASN HD21 H N N 55 ASN HD22 H N N 56 ASN HXT H N N 57 ASP N N N N 58 ASP CA C N S 59 ASP C C N N 60 ASP O O N N 61 ASP CB C N N 62 ASP CG C N N 63 ASP OD1 O N N 64 ASP OD2 O N N 65 ASP OXT O N N 66 ASP H H N N 67 ASP H2 H N N 68 ASP HA H N N 69 ASP HB2 H N N 70 ASP HB3 H N N 71 ASP HD2 H N N 72 ASP HXT H N N 73 ATP PG P N N 74 ATP O1G O N N 75 ATP O2G O N N 76 ATP O3G O N N 77 ATP PB P N R 78 ATP O1B O N N 79 ATP O2B O N N 80 ATP O3B O N N 81 ATP PA P N R 82 ATP O1A O N N 83 ATP O2A O N N 84 ATP O3A O N N 85 ATP "O5'" O N N 86 ATP "C5'" C N N 87 ATP "C4'" C N R 88 ATP "O4'" O N N 89 ATP "C3'" C N S 90 ATP "O3'" O N N 91 ATP "C2'" C N R 92 ATP "O2'" O N N 93 ATP "C1'" C N R 94 ATP N9 N Y N 95 ATP C8 C Y N 96 ATP N7 N Y N 97 ATP C5 C Y N 98 ATP C6 C Y N 99 ATP N6 N N N 100 ATP N1 N Y N 101 ATP C2 C Y N 102 ATP N3 N Y N 103 ATP C4 C Y N 104 ATP HOG2 H N N 105 ATP HOG3 H N N 106 ATP HOB2 H N N 107 ATP HOA2 H N N 108 ATP "H5'1" H N N 109 ATP "H5'2" H N N 110 ATP "H4'" H N N 111 ATP "H3'" H N N 112 ATP "HO3'" H N N 113 ATP "H2'" H N N 114 ATP "HO2'" H N N 115 ATP "H1'" H N N 116 ATP H8 H N N 117 ATP HN61 H N N 118 ATP HN62 H N N 119 ATP H2 H N N 120 CYS N N N N 121 CYS CA C N R 122 CYS C C N N 123 CYS O O N N 124 CYS CB C N N 125 CYS SG S N N 126 CYS OXT O N N 127 CYS H H N N 128 CYS H2 H N N 129 CYS HA H N N 130 CYS HB2 H N N 131 CYS HB3 H N N 132 CYS HG H N N 133 CYS HXT H N N 134 FMN N1 N N N 135 FMN C2 C N N 136 FMN O2 O N N 137 FMN N3 N N N 138 FMN C4 C N N 139 FMN O4 O N N 140 FMN C4A C N N 141 FMN N5 N N N 142 FMN C5A C Y N 143 FMN C6 C Y N 144 FMN C7 C Y N 145 FMN C7M C N N 146 FMN C8 C Y N 147 FMN C8M C N N 148 FMN C9 C Y N 149 FMN C9A C Y N 150 FMN N10 N N N 151 FMN C10 C N N 152 FMN "C1'" C N N 153 FMN "C2'" C N S 154 FMN "O2'" O N N 155 FMN "C3'" C N S 156 FMN "O3'" O N N 157 FMN "C4'" C N R 158 FMN "O4'" O N N 159 FMN "C5'" C N N 160 FMN "O5'" O N N 161 FMN P P N N 162 FMN O1P O N N 163 FMN O2P O N N 164 FMN O3P O N N 165 FMN HN3 H N N 166 FMN H6 H N N 167 FMN HM71 H N N 168 FMN HM72 H N N 169 FMN HM73 H N N 170 FMN HM81 H N N 171 FMN HM82 H N N 172 FMN HM83 H N N 173 FMN H9 H N N 174 FMN "H1'1" H N N 175 FMN "H1'2" H N N 176 FMN "H2'" H N N 177 FMN "HO2'" H N N 178 FMN "H3'" H N N 179 FMN "HO3'" H N N 180 FMN "H4'" H N N 181 FMN "HO4'" H N N 182 FMN "H5'1" H N N 183 FMN "H5'2" H N N 184 FMN HOP2 H N N 185 FMN HOP3 H N N 186 GLN N N N N 187 GLN CA C N S 188 GLN C C N N 189 GLN O O N N 190 GLN CB C N N 191 GLN CG C N N 192 GLN CD C N N 193 GLN OE1 O N N 194 GLN NE2 N N N 195 GLN OXT O N N 196 GLN H H N N 197 GLN H2 H N N 198 GLN HA H N N 199 GLN HB2 H N N 200 GLN HB3 H N N 201 GLN HG2 H N N 202 GLN HG3 H N N 203 GLN HE21 H N N 204 GLN HE22 H N N 205 GLN HXT H N N 206 GLU N N N N 207 GLU CA C N S 208 GLU C C N N 209 GLU O O N N 210 GLU CB C N N 211 GLU CG C N N 212 GLU CD C N N 213 GLU OE1 O N N 214 GLU OE2 O N N 215 GLU OXT O N N 216 GLU H H N N 217 GLU H2 H N N 218 GLU HA H N N 219 GLU HB2 H N N 220 GLU HB3 H N N 221 GLU HG2 H N N 222 GLU HG3 H N N 223 GLU HE2 H N N 224 GLU HXT H N N 225 GLY N N N N 226 GLY CA C N N 227 GLY C C N N 228 GLY O O N N 229 GLY OXT O N N 230 GLY H H N N 231 GLY H2 H N N 232 GLY HA2 H N N 233 GLY HA3 H N N 234 GLY HXT H N N 235 HIS N N N N 236 HIS CA C N S 237 HIS C C N N 238 HIS O O N N 239 HIS CB C N N 240 HIS CG C Y N 241 HIS ND1 N Y N 242 HIS CD2 C Y N 243 HIS CE1 C Y N 244 HIS NE2 N Y N 245 HIS OXT O N N 246 HIS H H N N 247 HIS H2 H N N 248 HIS HA H N N 249 HIS HB2 H N N 250 HIS HB3 H N N 251 HIS HD1 H N N 252 HIS HD2 H N N 253 HIS HE1 H N N 254 HIS HE2 H N N 255 HIS HXT H N N 256 HOH O O N N 257 HOH H1 H N N 258 HOH H2 H N N 259 ILE N N N N 260 ILE CA C N S 261 ILE C C N N 262 ILE O O N N 263 ILE CB C N S 264 ILE CG1 C N N 265 ILE CG2 C N N 266 ILE CD1 C N N 267 ILE OXT O N N 268 ILE H H N N 269 ILE H2 H N N 270 ILE HA H N N 271 ILE HB H N N 272 ILE HG12 H N N 273 ILE HG13 H N N 274 ILE HG21 H N N 275 ILE HG22 H N N 276 ILE HG23 H N N 277 ILE HD11 H N N 278 ILE HD12 H N N 279 ILE HD13 H N N 280 ILE HXT H N N 281 LEU N N N N 282 LEU CA C N S 283 LEU C C N N 284 LEU O O N N 285 LEU CB C N N 286 LEU CG C N N 287 LEU CD1 C N N 288 LEU CD2 C N N 289 LEU OXT O N N 290 LEU H H N N 291 LEU H2 H N N 292 LEU HA H N N 293 LEU HB2 H N N 294 LEU HB3 H N N 295 LEU HG H N N 296 LEU HD11 H N N 297 LEU HD12 H N N 298 LEU HD13 H N N 299 LEU HD21 H N N 300 LEU HD22 H N N 301 LEU HD23 H N N 302 LEU HXT H N N 303 LYS N N N N 304 LYS CA C N S 305 LYS C C N N 306 LYS O O N N 307 LYS CB C N N 308 LYS CG C N N 309 LYS CD C N N 310 LYS CE C N N 311 LYS NZ N N N 312 LYS OXT O N N 313 LYS H H N N 314 LYS H2 H N N 315 LYS HA H N N 316 LYS HB2 H N N 317 LYS HB3 H N N 318 LYS HG2 H N N 319 LYS HG3 H N N 320 LYS HD2 H N N 321 LYS HD3 H N N 322 LYS HE2 H N N 323 LYS HE3 H N N 324 LYS HZ1 H N N 325 LYS HZ2 H N N 326 LYS HZ3 H N N 327 LYS HXT H N N 328 MET N N N N 329 MET CA C N S 330 MET C C N N 331 MET O O N N 332 MET CB C N N 333 MET CG C N N 334 MET SD S N N 335 MET CE C N N 336 MET OXT O N N 337 MET H H N N 338 MET H2 H N N 339 MET HA H N N 340 MET HB2 H N N 341 MET HB3 H N N 342 MET HG2 H N N 343 MET HG3 H N N 344 MET HE1 H N N 345 MET HE2 H N N 346 MET HE3 H N N 347 MET HXT H N N 348 MG MG MG N N 349 PHE N N N N 350 PHE CA C N S 351 PHE C C N N 352 PHE O O N N 353 PHE CB C N N 354 PHE CG C Y N 355 PHE CD1 C Y N 356 PHE CD2 C Y N 357 PHE CE1 C Y N 358 PHE CE2 C Y N 359 PHE CZ C Y N 360 PHE OXT O N N 361 PHE H H N N 362 PHE H2 H N N 363 PHE HA H N N 364 PHE HB2 H N N 365 PHE HB3 H N N 366 PHE HD1 H N N 367 PHE HD2 H N N 368 PHE HE1 H N N 369 PHE HE2 H N N 370 PHE HZ H N N 371 PHE HXT H N N 372 PRO N N N N 373 PRO CA C N S 374 PRO C C N N 375 PRO O O N N 376 PRO CB C N N 377 PRO CG C N N 378 PRO CD C N N 379 PRO OXT O N N 380 PRO H H N N 381 PRO HA H N N 382 PRO HB2 H N N 383 PRO HB3 H N N 384 PRO HG2 H N N 385 PRO HG3 H N N 386 PRO HD2 H N N 387 PRO HD3 H N N 388 PRO HXT H N N 389 SER N N N N 390 SER CA C N S 391 SER C C N N 392 SER O O N N 393 SER CB C N N 394 SER OG O N N 395 SER OXT O N N 396 SER H H N N 397 SER H2 H N N 398 SER HA H N N 399 SER HB2 H N N 400 SER HB3 H N N 401 SER HG H N N 402 SER HXT H N N 403 THR N N N N 404 THR CA C N S 405 THR C C N N 406 THR O O N N 407 THR CB C N R 408 THR OG1 O N N 409 THR CG2 C N N 410 THR OXT O N N 411 THR H H N N 412 THR H2 H N N 413 THR HA H N N 414 THR HB H N N 415 THR HG1 H N N 416 THR HG21 H N N 417 THR HG22 H N N 418 THR HG23 H N N 419 THR HXT H N N 420 TRP N N N N 421 TRP CA C N S 422 TRP C C N N 423 TRP O O N N 424 TRP CB C N N 425 TRP CG C Y N 426 TRP CD1 C Y N 427 TRP CD2 C Y N 428 TRP NE1 N Y N 429 TRP CE2 C Y N 430 TRP CE3 C Y N 431 TRP CZ2 C Y N 432 TRP CZ3 C Y N 433 TRP CH2 C Y N 434 TRP OXT O N N 435 TRP H H N N 436 TRP H2 H N N 437 TRP HA H N N 438 TRP HB2 H N N 439 TRP HB3 H N N 440 TRP HD1 H N N 441 TRP HE1 H N N 442 TRP HE3 H N N 443 TRP HZ2 H N N 444 TRP HZ3 H N N 445 TRP HH2 H N N 446 TRP HXT H N N 447 TYR N N N N 448 TYR CA C N S 449 TYR C C N N 450 TYR O O N N 451 TYR CB C N N 452 TYR CG C Y N 453 TYR CD1 C Y N 454 TYR CD2 C Y N 455 TYR CE1 C Y N 456 TYR CE2 C Y N 457 TYR CZ C Y N 458 TYR OH O N N 459 TYR OXT O N N 460 TYR H H N N 461 TYR H2 H N N 462 TYR HA H N N 463 TYR HB2 H N N 464 TYR HB3 H N N 465 TYR HD1 H N N 466 TYR HD2 H N N 467 TYR HE1 H N N 468 TYR HE2 H N N 469 TYR HH H N N 470 TYR HXT H N N 471 VAL N N N N 472 VAL CA C N S 473 VAL C C N N 474 VAL O O N N 475 VAL CB C N N 476 VAL CG1 C N N 477 VAL CG2 C N N 478 VAL OXT O N N 479 VAL H H N N 480 VAL H2 H N N 481 VAL HA H N N 482 VAL HB H N N 483 VAL HG11 H N N 484 VAL HG12 H N N 485 VAL HG13 H N N 486 VAL HG21 H N N 487 VAL HG22 H N N 488 VAL HG23 H N N 489 VAL HXT H N N 490 # loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.value_order _chem_comp_bond.pdbx_aromatic_flag _chem_comp_bond.pdbx_stereo_config _chem_comp_bond.pdbx_ordinal ALA N CA sing N N 1 ALA N H sing N N 2 ALA N H2 sing N N 3 ALA CA C sing N N 4 ALA CA CB sing N N 5 ALA CA HA sing N N 6 ALA C O doub N N 7 ALA C OXT sing N N 8 ALA CB HB1 sing N N 9 ALA CB HB2 sing N N 10 ALA CB HB3 sing N N 11 ALA OXT HXT sing N N 12 ARG N CA sing N N 13 ARG N H sing N N 14 ARG N H2 sing N N 15 ARG CA C sing N N 16 ARG CA CB sing N N 17 ARG CA HA sing N N 18 ARG C O doub N N 19 ARG C OXT sing N N 20 ARG CB CG sing N N 21 ARG CB HB2 sing N N 22 ARG CB HB3 sing N N 23 ARG CG CD sing N N 24 ARG CG HG2 sing N N 25 ARG CG HG3 sing N N 26 ARG CD NE sing N N 27 ARG CD HD2 sing N N 28 ARG CD HD3 sing N N 29 ARG NE CZ sing N N 30 ARG NE HE sing N N 31 ARG CZ NH1 sing N N 32 ARG CZ NH2 doub N N 33 ARG NH1 HH11 sing N N 34 ARG NH1 HH12 sing N N 35 ARG NH2 HH21 sing N N 36 ARG NH2 HH22 sing N N 37 ARG OXT HXT sing N N 38 ASN N CA sing N N 39 ASN N H sing N N 40 ASN N H2 sing N N 41 ASN CA C sing N N 42 ASN CA CB sing N N 43 ASN CA HA sing N N 44 ASN C O doub N N 45 ASN C OXT sing N N 46 ASN CB CG sing N N 47 ASN CB HB2 sing N N 48 ASN CB HB3 sing N N 49 ASN CG OD1 doub N N 50 ASN CG ND2 sing N N 51 ASN ND2 HD21 sing N N 52 ASN ND2 HD22 sing N N 53 ASN OXT HXT sing N N 54 ASP N CA sing N N 55 ASP N H sing N N 56 ASP N H2 sing N N 57 ASP CA C sing N N 58 ASP CA CB sing N N 59 ASP CA HA sing N N 60 ASP C O doub N N 61 ASP C OXT sing N N 62 ASP CB CG sing N N 63 ASP CB HB2 sing N N 64 ASP CB HB3 sing N N 65 ASP CG OD1 doub N N 66 ASP CG OD2 sing N N 67 ASP OD2 HD2 sing N N 68 ASP OXT HXT sing N N 69 ATP PG O1G doub N N 70 ATP PG O2G sing N N 71 ATP PG O3G sing N N 72 ATP PG O3B sing N N 73 ATP O2G HOG2 sing N N 74 ATP O3G HOG3 sing N N 75 ATP PB O1B doub N N 76 ATP PB O2B sing N N 77 ATP PB O3B sing N N 78 ATP PB O3A sing N N 79 ATP O2B HOB2 sing N N 80 ATP PA O1A doub N N 81 ATP PA O2A sing N N 82 ATP PA O3A sing N N 83 ATP PA "O5'" sing N N 84 ATP O2A HOA2 sing N N 85 ATP "O5'" "C5'" sing N N 86 ATP "C5'" "C4'" sing N N 87 ATP "C5'" "H5'1" sing N N 88 ATP "C5'" "H5'2" sing N N 89 ATP "C4'" "O4'" sing N N 90 ATP "C4'" "C3'" sing N N 91 ATP "C4'" "H4'" sing N N 92 ATP "O4'" "C1'" sing N N 93 ATP "C3'" "O3'" sing N N 94 ATP "C3'" "C2'" sing N N 95 ATP "C3'" "H3'" sing N N 96 ATP "O3'" "HO3'" sing N N 97 ATP "C2'" "O2'" sing N N 98 ATP "C2'" "C1'" sing N N 99 ATP "C2'" "H2'" sing N N 100 ATP "O2'" "HO2'" sing N N 101 ATP "C1'" N9 sing N N 102 ATP "C1'" "H1'" sing N N 103 ATP N9 C8 sing Y N 104 ATP N9 C4 sing Y N 105 ATP C8 N7 doub Y N 106 ATP C8 H8 sing N N 107 ATP N7 C5 sing Y N 108 ATP C5 C6 sing Y N 109 ATP C5 C4 doub Y N 110 ATP C6 N6 sing N N 111 ATP C6 N1 doub Y N 112 ATP N6 HN61 sing N N 113 ATP N6 HN62 sing N N 114 ATP N1 C2 sing Y N 115 ATP C2 N3 doub Y N 116 ATP C2 H2 sing N N 117 ATP N3 C4 sing Y N 118 CYS N CA sing N N 119 CYS N H sing N N 120 CYS N H2 sing N N 121 CYS CA C sing N N 122 CYS CA CB sing N N 123 CYS CA HA sing N N 124 CYS C O doub N N 125 CYS C OXT sing N N 126 CYS CB SG sing N N 127 CYS CB HB2 sing N N 128 CYS CB HB3 sing N N 129 CYS SG HG sing N N 130 CYS OXT HXT sing N N 131 FMN N1 C2 sing N N 132 FMN N1 C10 doub N N 133 FMN C2 O2 doub N N 134 FMN C2 N3 sing N N 135 FMN N3 C4 sing N N 136 FMN N3 HN3 sing N N 137 FMN C4 O4 doub N N 138 FMN C4 C4A sing N N 139 FMN C4A N5 doub N N 140 FMN C4A C10 sing N N 141 FMN N5 C5A sing N N 142 FMN C5A C6 doub Y N 143 FMN C5A C9A sing Y N 144 FMN C6 C7 sing Y N 145 FMN C6 H6 sing N N 146 FMN C7 C7M sing N N 147 FMN C7 C8 doub Y N 148 FMN C7M HM71 sing N N 149 FMN C7M HM72 sing N N 150 FMN C7M HM73 sing N N 151 FMN C8 C8M sing N N 152 FMN C8 C9 sing Y N 153 FMN C8M HM81 sing N N 154 FMN C8M HM82 sing N N 155 FMN C8M HM83 sing N N 156 FMN C9 C9A doub Y N 157 FMN C9 H9 sing N N 158 FMN C9A N10 sing N N 159 FMN N10 C10 sing N N 160 FMN N10 "C1'" sing N N 161 FMN "C1'" "C2'" sing N N 162 FMN "C1'" "H1'1" sing N N 163 FMN "C1'" "H1'2" sing N N 164 FMN "C2'" "O2'" sing N N 165 FMN "C2'" "C3'" sing N N 166 FMN "C2'" "H2'" sing N N 167 FMN "O2'" "HO2'" sing N N 168 FMN "C3'" "O3'" sing N N 169 FMN "C3'" "C4'" sing N N 170 FMN "C3'" "H3'" sing N N 171 FMN "O3'" "HO3'" sing N N 172 FMN "C4'" "O4'" sing N N 173 FMN "C4'" "C5'" sing N N 174 FMN "C4'" "H4'" sing N N 175 FMN "O4'" "HO4'" sing N N 176 FMN "C5'" "O5'" sing N N 177 FMN "C5'" "H5'1" sing N N 178 FMN "C5'" "H5'2" sing N N 179 FMN "O5'" P sing N N 180 FMN P O1P doub N N 181 FMN P O2P sing N N 182 FMN P O3P sing N N 183 FMN O2P HOP2 sing N N 184 FMN O3P HOP3 sing N N 185 GLN N CA sing N N 186 GLN N H sing N N 187 GLN N H2 sing N N 188 GLN CA C sing N N 189 GLN CA CB sing N N 190 GLN CA HA sing N N 191 GLN C O doub N N 192 GLN C OXT sing N N 193 GLN CB CG sing N N 194 GLN CB HB2 sing N N 195 GLN CB HB3 sing N N 196 GLN CG CD sing N N 197 GLN CG HG2 sing N N 198 GLN CG HG3 sing N N 199 GLN CD OE1 doub N N 200 GLN CD NE2 sing N N 201 GLN NE2 HE21 sing N N 202 GLN NE2 HE22 sing N N 203 GLN OXT HXT sing N N 204 GLU N CA sing N N 205 GLU N H sing N N 206 GLU N H2 sing N N 207 GLU CA C sing N N 208 GLU CA CB sing N N 209 GLU CA HA sing N N 210 GLU C O doub N N 211 GLU C OXT sing N N 212 GLU CB CG sing N N 213 GLU CB HB2 sing N N 214 GLU CB HB3 sing N N 215 GLU CG CD sing N N 216 GLU CG HG2 sing N N 217 GLU CG HG3 sing N N 218 GLU CD OE1 doub N N 219 GLU CD OE2 sing N N 220 GLU OE2 HE2 sing N N 221 GLU OXT HXT sing N N 222 GLY N CA sing N N 223 GLY N H sing N N 224 GLY N H2 sing N N 225 GLY CA C sing N N 226 GLY CA HA2 sing N N 227 GLY CA HA3 sing N N 228 GLY C O doub N N 229 GLY C OXT sing N N 230 GLY OXT HXT sing N N 231 HIS N CA sing N N 232 HIS N H sing N N 233 HIS N H2 sing N N 234 HIS CA C sing N N 235 HIS CA CB sing N N 236 HIS CA HA sing N N 237 HIS C O doub N N 238 HIS C OXT sing N N 239 HIS CB CG sing N N 240 HIS CB HB2 sing N N 241 HIS CB HB3 sing N N 242 HIS CG ND1 sing Y N 243 HIS CG CD2 doub Y N 244 HIS ND1 CE1 doub Y N 245 HIS ND1 HD1 sing N N 246 HIS CD2 NE2 sing Y N 247 HIS CD2 HD2 sing N N 248 HIS CE1 NE2 sing Y N 249 HIS CE1 HE1 sing N N 250 HIS NE2 HE2 sing N N 251 HIS OXT HXT sing N N 252 HOH O H1 sing N N 253 HOH O H2 sing N N 254 ILE N CA sing N N 255 ILE N H sing N N 256 ILE N H2 sing N N 257 ILE CA C sing N N 258 ILE CA CB sing N N 259 ILE CA HA sing N N 260 ILE C O doub N N 261 ILE C OXT sing N N 262 ILE CB CG1 sing N N 263 ILE CB CG2 sing N N 264 ILE CB HB sing N N 265 ILE CG1 CD1 sing N N 266 ILE CG1 HG12 sing N N 267 ILE CG1 HG13 sing N N 268 ILE CG2 HG21 sing N N 269 ILE CG2 HG22 sing N N 270 ILE CG2 HG23 sing N N 271 ILE CD1 HD11 sing N N 272 ILE CD1 HD12 sing N N 273 ILE CD1 HD13 sing N N 274 ILE OXT HXT sing N N 275 LEU N CA sing N N 276 LEU N H sing N N 277 LEU N H2 sing N N 278 LEU CA C sing N N 279 LEU CA CB sing N N 280 LEU CA HA sing N N 281 LEU C O doub N N 282 LEU C OXT sing N N 283 LEU CB CG sing N N 284 LEU CB HB2 sing N N 285 LEU CB HB3 sing N N 286 LEU CG CD1 sing N N 287 LEU CG CD2 sing N N 288 LEU CG HG sing N N 289 LEU CD1 HD11 sing N N 290 LEU CD1 HD12 sing N N 291 LEU CD1 HD13 sing N N 292 LEU CD2 HD21 sing N N 293 LEU CD2 HD22 sing N N 294 LEU CD2 HD23 sing N N 295 LEU OXT HXT sing N N 296 LYS N CA sing N N 297 LYS N H sing N N 298 LYS N H2 sing N N 299 LYS CA C sing N N 300 LYS CA CB sing N N 301 LYS CA HA sing N N 302 LYS C O doub N N 303 LYS C OXT sing N N 304 LYS CB CG sing N N 305 LYS CB HB2 sing N N 306 LYS CB HB3 sing N N 307 LYS CG CD sing N N 308 LYS CG HG2 sing N N 309 LYS CG HG3 sing N N 310 LYS CD CE sing N N 311 LYS CD HD2 sing N N 312 LYS CD HD3 sing N N 313 LYS CE NZ sing N N 314 LYS CE HE2 sing N N 315 LYS CE HE3 sing N N 316 LYS NZ HZ1 sing N N 317 LYS NZ HZ2 sing N N 318 LYS NZ HZ3 sing N N 319 LYS OXT HXT sing N N 320 MET N CA sing N N 321 MET N H sing N N 322 MET N H2 sing N N 323 MET CA C sing N N 324 MET CA CB sing N N 325 MET CA HA sing N N 326 MET C O doub N N 327 MET C OXT sing N N 328 MET CB CG sing N N 329 MET CB HB2 sing N N 330 MET CB HB3 sing N N 331 MET CG SD sing N N 332 MET CG HG2 sing N N 333 MET CG HG3 sing N N 334 MET SD CE sing N N 335 MET CE HE1 sing N N 336 MET CE HE2 sing N N 337 MET CE HE3 sing N N 338 MET OXT HXT sing N N 339 PHE N CA sing N N 340 PHE N H sing N N 341 PHE N H2 sing N N 342 PHE CA C sing N N 343 PHE CA CB sing N N 344 PHE CA HA sing N N 345 PHE C O doub N N 346 PHE C OXT sing N N 347 PHE CB CG sing N N 348 PHE CB HB2 sing N N 349 PHE CB HB3 sing N N 350 PHE CG CD1 doub Y N 351 PHE CG CD2 sing Y N 352 PHE CD1 CE1 sing Y N 353 PHE CD1 HD1 sing N N 354 PHE CD2 CE2 doub Y N 355 PHE CD2 HD2 sing N N 356 PHE CE1 CZ doub Y N 357 PHE CE1 HE1 sing N N 358 PHE CE2 CZ sing Y N 359 PHE CE2 HE2 sing N N 360 PHE CZ HZ sing N N 361 PHE OXT HXT sing N N 362 PRO N CA sing N N 363 PRO N CD sing N N 364 PRO N H sing N N 365 PRO CA C sing N N 366 PRO CA CB sing N N 367 PRO CA HA sing N N 368 PRO C O doub N N 369 PRO C OXT sing N N 370 PRO CB CG sing N N 371 PRO CB HB2 sing N N 372 PRO CB HB3 sing N N 373 PRO CG CD sing N N 374 PRO CG HG2 sing N N 375 PRO CG HG3 sing N N 376 PRO CD HD2 sing N N 377 PRO CD HD3 sing N N 378 PRO OXT HXT sing N N 379 SER N CA sing N N 380 SER N H sing N N 381 SER N H2 sing N N 382 SER CA C sing N N 383 SER CA CB sing N N 384 SER CA HA sing N N 385 SER C O doub N N 386 SER C OXT sing N N 387 SER CB OG sing N N 388 SER CB HB2 sing N N 389 SER CB HB3 sing N N 390 SER OG HG sing N N 391 SER OXT HXT sing N N 392 THR N CA sing N N 393 THR N H sing N N 394 THR N H2 sing N N 395 THR CA C sing N N 396 THR CA CB sing N N 397 THR CA HA sing N N 398 THR C O doub N N 399 THR C OXT sing N N 400 THR CB OG1 sing N N 401 THR CB CG2 sing N N 402 THR CB HB sing N N 403 THR OG1 HG1 sing N N 404 THR CG2 HG21 sing N N 405 THR CG2 HG22 sing N N 406 THR CG2 HG23 sing N N 407 THR OXT HXT sing N N 408 TRP N CA sing N N 409 TRP N H sing N N 410 TRP N H2 sing N N 411 TRP CA C sing N N 412 TRP CA CB sing N N 413 TRP CA HA sing N N 414 TRP C O doub N N 415 TRP C OXT sing N N 416 TRP CB CG sing N N 417 TRP CB HB2 sing N N 418 TRP CB HB3 sing N N 419 TRP CG CD1 doub Y N 420 TRP CG CD2 sing Y N 421 TRP CD1 NE1 sing Y N 422 TRP CD1 HD1 sing N N 423 TRP CD2 CE2 doub Y N 424 TRP CD2 CE3 sing Y N 425 TRP NE1 CE2 sing Y N 426 TRP NE1 HE1 sing N N 427 TRP CE2 CZ2 sing Y N 428 TRP CE3 CZ3 doub Y N 429 TRP CE3 HE3 sing N N 430 TRP CZ2 CH2 doub Y N 431 TRP CZ2 HZ2 sing N N 432 TRP CZ3 CH2 sing Y N 433 TRP CZ3 HZ3 sing N N 434 TRP CH2 HH2 sing N N 435 TRP OXT HXT sing N N 436 TYR N CA sing N N 437 TYR N H sing N N 438 TYR N H2 sing N N 439 TYR CA C sing N N 440 TYR CA CB sing N N 441 TYR CA HA sing N N 442 TYR C O doub N N 443 TYR C OXT sing N N 444 TYR CB CG sing N N 445 TYR CB HB2 sing N N 446 TYR CB HB3 sing N N 447 TYR CG CD1 doub Y N 448 TYR CG CD2 sing Y N 449 TYR CD1 CE1 sing Y N 450 TYR CD1 HD1 sing N N 451 TYR CD2 CE2 doub Y N 452 TYR CD2 HD2 sing N N 453 TYR CE1 CZ doub Y N 454 TYR CE1 HE1 sing N N 455 TYR CE2 CZ sing Y N 456 TYR CE2 HE2 sing N N 457 TYR CZ OH sing N N 458 TYR OH HH sing N N 459 TYR OXT HXT sing N N 460 VAL N CA sing N N 461 VAL N H sing N N 462 VAL N H2 sing N N 463 VAL CA C sing N N 464 VAL CA CB sing N N 465 VAL CA HA sing N N 466 VAL C O doub N N 467 VAL C OXT sing N N 468 VAL CB CG1 sing N N 469 VAL CB CG2 sing N N 470 VAL CB HB sing N N 471 VAL CG1 HG11 sing N N 472 VAL CG1 HG12 sing N N 473 VAL CG1 HG13 sing N N 474 VAL CG2 HG21 sing N N 475 VAL CG2 HG22 sing N N 476 VAL CG2 HG23 sing N N 477 VAL OXT HXT sing N N 478 # _pdbx_audit_support.funding_organization 'German Federal Ministry for Education and Research' _pdbx_audit_support.country Germany _pdbx_audit_support.grant_number ? _pdbx_audit_support.ordinal 1 # loop_ _pdbx_entity_instance_feature.ordinal _pdbx_entity_instance_feature.comp_id _pdbx_entity_instance_feature.asym_id _pdbx_entity_instance_feature.seq_num _pdbx_entity_instance_feature.auth_comp_id _pdbx_entity_instance_feature.auth_asym_id _pdbx_entity_instance_feature.auth_seq_num _pdbx_entity_instance_feature.feature_type _pdbx_entity_instance_feature.details 1 ATP ? ? ATP ? ? 'SUBJECT OF INVESTIGATION' ? 2 FMN ? ? FMN ? ? 'SUBJECT OF INVESTIGATION' ? 3 MG ? ? MG ? ? 'SUBJECT OF INVESTIGATION' ? # _pdbx_initial_refinement_model.id 1 _pdbx_initial_refinement_model.entity_id_list ? _pdbx_initial_refinement_model.type 'experimental model' _pdbx_initial_refinement_model.source_name PDB _pdbx_initial_refinement_model.accession_code 4YUS _pdbx_initial_refinement_model.details ? # _pdbx_serial_crystallography_sample_delivery.diffrn_id 1 _pdbx_serial_crystallography_sample_delivery.description ? _pdbx_serial_crystallography_sample_delivery.method injection # _space_group.name_H-M_alt 'C 2 2 21' _space_group.name_Hall 'C 2c 2' _space_group.IT_number 20 _space_group.crystal_system orthorhombic _space_group.id 1 # _atom_sites.entry_id 8QFH _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] 0.018416 _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] 0.006859 _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] 0.009497 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 _atom_sites.solution_primary ? _atom_sites.solution_secondary ? _atom_sites.solution_hydrogens ? _atom_sites.special_details ? # loop_ _atom_type.symbol _atom_type.scat_dispersion_real _atom_type.scat_dispersion_imag _atom_type.scat_Cromer_Mann_a1 _atom_type.scat_Cromer_Mann_a2 _atom_type.scat_Cromer_Mann_a3 _atom_type.scat_Cromer_Mann_a4 _atom_type.scat_Cromer_Mann_b1 _atom_type.scat_Cromer_Mann_b2 _atom_type.scat_Cromer_Mann_b3 _atom_type.scat_Cromer_Mann_b4 _atom_type.scat_Cromer_Mann_c _atom_type.scat_source _atom_type.scat_dispersion_source C ? ? 3.54356 2.42580 ? ? 25.62398 1.50364 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? H ? ? 0.51345 0.48472 ? ? 24.73122 6.32584 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? MG ? ? 9.41153 2.53737 ? ? 2.59044 63.03566 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? N ? ? 4.01032 2.96436 ? ? 19.97189 1.75589 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? O ? ? 4.49882 3.47563 ? ? 15.80542 1.70748 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? P ? ? 9.51135 5.44231 ? ? 1.42069 35.72801 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? S ? ? 9.55732 6.39887 ? ? 1.23737 29.19336 ? ? 0.0 ;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; ? # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? -21.56901 -9.00773 -11.74646 1.000 78.67709 ? 1 MET A N 1 ATOM 2 C CA . MET A 1 1 ? -20.13165 -9.36753 -11.64514 1.000 75.46381 ? 1 MET A CA 1 ATOM 3 C C . MET A 1 1 ? -19.27498 -8.26156 -12.23355 1.000 73.84771 ? 1 MET A C 1 ATOM 4 O O . MET A 1 1 ? -19.70597 -7.53576 -13.12873 1.000 71.63665 ? 1 MET A O 1 ATOM 5 C CB . MET A 1 1 ? -19.84475 -10.68122 -12.37201 1.000 72.48786 ? 1 MET A CB 1 ATOM 6 C CG . MET A 1 1 ? -18.68417 -11.47035 -11.78701 1.000 82.02476 ? 1 MET A CG 1 ATOM 7 S SD . MET A 1 1 ? -18.66048 -13.25100 -12.13764 1.000 95.84225 ? 1 MET A SD 1 ATOM 8 C CE . MET A 1 1 ? -20.34543 -13.60670 -12.63376 1.000 85.32503 ? 1 MET A CE 1 ATOM 9 H H1 . MET A 1 1 ? -22.01671 -9.38259 -11.07478 1.000 94.41251 ? 1 MET A H1 1 ATOM 10 H H2 . MET A 1 1 ? -21.65704 -8.12309 -11.70454 1.000 94.41251 ? 1 MET A H2 1 ATOM 11 H H3 . MET A 1 1 ? -21.89459 -9.30192 -12.52077 1.000 94.41251 ? 1 MET A H3 1 ATOM 12 H HA . MET A 1 1 ? -19.90565 -9.49624 -10.71066 1.000 90.55657 ? 1 MET A HA 1 ATOM 13 H HB2 . MET A 1 1 ? -20.63546 -11.24119 -12.32595 1.000 86.98543 ? 1 MET A HB2 1 ATOM 14 H HB3 . MET A 1 1 ? -19.63112 -10.48431 -13.29747 1.000 86.98543 ? 1 MET A HB3 1 ATOM 15 H HG2 . MET A 1 1 ? -17.85956 -11.10030 -12.13910 1.000 98.42971 ? 1 MET A HG2 1 ATOM 16 H HG3 . MET A 1 1 ? -18.70721 -11.37085 -10.82240 1.000 98.42971 ? 1 MET A HG3 1 ATOM 17 H HE1 . MET A 1 1 ? -20.42662 -14.55547 -12.81854 1.000 102.39003 ? 1 MET A HE1 1 ATOM 18 H HE2 . MET A 1 1 ? -20.94591 -13.35733 -11.91394 1.000 102.39003 ? 1 MET A HE2 1 ATOM 19 H HE3 . MET A 1 1 ? -20.55450 -13.09535 -13.43107 1.000 102.39003 ? 1 MET A HE3 1 ATOM 20 N N . LYS A 1 2 ? -18.05319 -8.15201 -11.73136 1.000 68.68196 ? 2 LYS A N 1 ATOM 21 C CA . LYS A 1 2 ? -17.08851 -7.16509 -12.19084 1.000 61.35739 ? 2 LYS A CA 1 ATOM 22 C C . LYS A 1 2 ? -15.82933 -7.88484 -12.65083 1.000 58.49219 ? 2 LYS A C 1 ATOM 23 O O . LYS A 1 2 ? -15.46024 -8.92836 -12.10448 1.000 58.82324 ? 2 LYS A O 1 ATOM 24 C CB . LYS A 1 2 ? -16.77320 -6.17470 -11.06767 1.000 69.53490 ? 2 LYS A CB 1 ATOM 25 C CG . LYS A 1 2 ? -15.94777 -4.97753 -11.47536 1.000 70.47077 ? 2 LYS A CG 1 ATOM 26 C CD . LYS A 1 2 ? -15.76573 -4.03776 -10.29062 1.000 73.65344 ? 2 LYS A CD 1 ATOM 27 C CE . LYS A 1 2 ? -15.15636 -2.71124 -10.70862 1.000 80.88257 ? 2 LYS A CE 1 ATOM 28 N NZ . LYS A 1 2 ? -15.29071 -1.67838 -9.64655 1.000 69.02609 ? 2 LYS A NZ 1 ATOM 29 H H . LYS A 1 2 ? -17.75025 -8.65490 -11.10293 1.000 82.41835 ? 2 LYS A H 1 ATOM 30 H HA . LYS A 1 2 ? -17.43231 -6.66054 -12.94459 1.000 73.62887 ? 2 LYS A HA 1 ATOM 31 H HB2 . LYS A 1 2 ? -17.61090 -5.84067 -10.71046 1.000 83.44188 ? 2 LYS A HB2 1 ATOM 32 H HB3 . LYS A 1 2 ? -16.28100 -6.64363 -10.37576 1.000 83.44188 ? 2 LYS A HB3 1 ATOM 33 H HG2 . LYS A 1 2 ? -15.07351 -5.27095 -11.77615 1.000 84.56492 ? 2 LYS A HG2 1 ATOM 34 H HG3 . LYS A 1 2 ? -16.39920 -4.49669 -12.18663 1.000 84.56492 ? 2 LYS A HG3 1 ATOM 35 H HD2 . LYS A 1 2 ? -16.62987 -3.86071 -9.88713 1.000 88.38413 ? 2 LYS A HD2 1 ATOM 36 H HD3 . LYS A 1 2 ? -15.17521 -4.45166 -9.64188 1.000 88.38413 ? 2 LYS A HD3 1 ATOM 37 H HE2 . LYS A 1 2 ? -14.21209 -2.83701 -10.89146 1.000 97.05908 ? 2 LYS A HE2 1 ATOM 38 H HE3 . LYS A 1 2 ? -15.60821 -2.38870 -11.50404 1.000 97.05908 ? 2 LYS A HE3 1 ATOM 39 H HZ1 . LYS A 1 2 ? -16.15070 -1.53839 -9.46513 1.000 82.83131 ? 2 LYS A HZ1 1 ATOM 40 H HZ2 . LYS A 1 2 ? -14.87942 -1.94890 -8.90509 1.000 82.83131 ? 2 LYS A HZ2 1 ATOM 41 H HZ3 . LYS A 1 2 ? -14.92448 -0.91379 -9.91743 1.000 82.83131 ? 2 LYS A HZ3 1 ATOM 42 N N . ARG A 1 3 ? -15.17288 -7.33771 -13.67177 1.000 57.20586 ? 3 ARG A N 1 ATOM 43 C CA . ARG A 1 3 ? -13.90741 -7.89777 -14.12884 1.000 50.94323 ? 3 ARG A CA 1 ATOM 44 C C . ARG A 1 3 ? -12.91775 -6.77186 -14.39322 1.000 55.43765 ? 3 ARG A C 1 ATOM 45 O O . ARG A 1 3 ? -13.21892 -5.82194 -15.12481 1.000 56.60865 ? 3 ARG A O 1 ATOM 46 C CB . ARG A 1 3 ? -14.10023 -8.76218 -15.38333 1.000 53.22337 ? 3 ARG A CB 1 ATOM 47 C CG . ARG A 1 3 ? -12.81484 -9.40783 -15.89780 1.000 53.93142 ? 3 ARG A CG 1 ATOM 48 C CD . ARG A 1 3 ? -13.11734 -10.61759 -16.76947 1.000 61.42110 ? 3 ARG A CD 1 ATOM 49 N NE . ARG A 1 3 ? -14.03170 -10.26399 -17.84760 1.000 66.41082 ? 3 ARG A NE 1 ATOM 50 C CZ . ARG A 1 3 ? -15.16563 -10.89521 -18.12747 1.000 71.33185 ? 3 ARG A CZ 1 ATOM 51 N NH1 . ARG A 1 3 ? -15.53486 -11.98627 -17.47470 1.000 74.62286 ? 3 ARG A NH1 1 ATOM 52 N NH2 . ARG A 1 3 ? -15.94665 -10.42103 -19.09311 1.000 71.02732 ? 3 ARG A NH2 1 ATOM 53 H H . ARG A 1 3 ? -15.43937 -6.64784 -14.11070 1.000 68.64704 ? 3 ARG A H 1 ATOM 54 H HA . ARG A 1 3 ? -13.53325 -8.45941 -13.43208 1.000 61.13188 ? 3 ARG A HA 1 ATOM 55 H HB2 . ARG A 1 3 ? -14.72578 -9.47420 -15.17689 1.000 63.86804 ? 3 ARG A HB2 1 ATOM 56 H HB3 . ARG A 1 3 ? -14.45485 -8.20453 -16.09339 1.000 63.86804 ? 3 ARG A HB3 1 ATOM 57 H HG2 . ARG A 1 3 ? -12.32069 -8.76382 -16.42882 1.000 64.71771 ? 3 ARG A HG2 1 ATOM 58 H HG3 . ARG A 1 3 ? -12.27698 -9.69964 -15.14518 1.000 64.71771 ? 3 ARG A HG3 1 ATOM 59 H HD2 . ARG A 1 3 ? -12.29374 -10.94881 -17.16048 1.000 73.70532 ? 3 ARG A HD2 1 ATOM 60 H HD3 . ARG A 1 3 ? -13.53043 -11.30993 -16.23009 1.000 73.70532 ? 3 ARG A HD3 1 ATOM 61 H HE . ARG A 1 3 ? -13.81991 -9.59293 -18.34200 1.000 79.69299 ? 3 ARG A HE 1 ATOM 62 H HH11 . ARG A 1 3 ? -15.03527 -12.30393 -16.85092 1.000 89.54743 ? 3 ARG A HH11 1 ATOM 63 H HH12 . ARG A 1 3 ? -16.27429 -12.37734 -17.67446 1.000 89.54743 ? 3 ARG A HH12 1 ATOM 64 H HH21 . ARG A 1 3 ? -15.71460 -9.71519 -19.52617 1.000 85.23278 ? 3 ARG A HH21 1 ATOM 65 H HH22 . ARG A 1 3 ? -16.68395 -10.82011 -19.28473 1.000 85.23278 ? 3 ARG A HH22 1 ATOM 66 N N . LEU A 1 4 ? -11.73694 -6.89699 -13.78777 1.000 52.11109 ? 4 LEU A N 1 ATOM 67 C CA . LEU A 1 4 ? -10.66578 -5.91755 -13.86198 1.000 52.97874 ? 4 LEU A CA 1 ATOM 68 C C . LEU A 1 4 ? -9.45190 -6.50243 -14.57201 1.000 50.38178 ? 4 LEU A C 1 ATOM 69 O O . LEU A 1 4 ? -9.05580 -7.64455 -14.31778 1.000 48.43783 ? 4 LEU A O 1 ATOM 70 C CB . LEU A 1 4 ? -10.24396 -5.46760 -12.46113 1.000 51.89459 ? 4 LEU A CB 1 ATOM 71 C CG . LEU A 1 4 ? -10.55580 -4.03257 -12.05129 1.000 69.76760 ? 4 LEU A CG 1 ATOM 72 C CD1 . LEU A 1 4 ? -12.03344 -3.73262 -12.18325 1.000 78.18859 ? 4 LEU A CD1 1 ATOM 73 C CD2 . LEU A 1 4 ? -10.07195 -3.81149 -10.62213 1.000 70.15577 ? 4 LEU A CD2 1 ATOM 74 H H . LEU A 1 4 ? -11.52690 -7.57694 -13.30491 1.000 62.53331 ? 4 LEU A H 1 ATOM 75 H HA . LEU A 1 4 ? -10.97800 -5.15289 -14.37061 1.000 63.57449 ? 4 LEU A HA 1 ATOM 76 H HB2 . LEU A 1 4 ? -10.68782 -6.04412 -11.81964 1.000 62.27350 ? 4 LEU A HB2 1 ATOM 77 H HB3 . LEU A 1 4 ? -9.28225 -5.57474 -12.39365 1.000 62.27350 ? 4 LEU A HB3 1 ATOM 78 H HG . LEU A 1 4 ? -10.09543 -3.41417 -12.63997 1.000 83.72113 ? 4 LEU A HG 1 ATOM 79 H HD11 . LEU A 1 4 ? -12.19448 -2.81444 -11.91508 1.000 93.82630 ? 4 LEU A HD11 1 ATOM 80 H HD12 . LEU A 1 4 ? -12.30004 -3.85894 -13.10729 1.000 93.82630 ? 4 LEU A HD12 1 ATOM 81 H HD13 . LEU A 1 4 ? -12.53074 -4.33671 -11.60996 1.000 93.82630 ? 4 LEU A HD13 1 ATOM 82 H HD21 . LEU A 1 4 ? -10.26948 -2.89887 -10.35946 1.000 84.18693 ? 4 LEU A HD21 1 ATOM 83 H HD22 . LEU A 1 4 ? -10.53061 -4.43163 -10.03394 1.000 84.18693 ? 4 LEU A HD22 1 ATOM 84 H HD23 . LEU A 1 4 ? -9.11515 -3.96663 -10.58509 1.000 84.18693 ? 4 LEU A HD23 1 ATOM 85 N N . THR A 1 5 ? -8.85095 -5.70357 -15.44547 1.000 46.49387 ? 5 THR A N 1 ATOM 86 C CA . THR A 1 5 ? -7.62522 -6.07044 -16.14572 1.000 45.47903 ? 5 THR A CA 1 ATOM 87 C C . THR A 1 5 ? -6.61622 -4.95474 -15.92548 1.000 48.65754 ? 5 THR A C 1 ATOM 88 O O . THR A 1 5 ? -6.90284 -3.79668 -16.24678 1.000 48.04917 ? 5 THR A O 1 ATOM 89 C CB . THR A 1 5 ? -7.86863 -6.26455 -17.64782 1.000 49.49514 ? 5 THR A CB 1 ATOM 90 O OG1 . THR A 1 5 ? -8.94528 -7.18311 -17.86454 1.000 48.85422 ? 5 THR A OG1 1 ATOM 91 C CG2 . THR A 1 5 ? -6.61735 -6.79002 -18.31751 1.000 51.71791 ? 5 THR A CG2 1 ATOM 92 H H . THR A 1 5 ? -9.14193 -4.92200 -15.65541 1.000 55.79265 ? 5 THR A H 1 ATOM 93 H HA . THR A 1 5 ? -7.27980 -6.90166 -15.78424 1.000 54.57483 ? 5 THR A HA 1 ATOM 94 H HB . THR A 1 5 ? -8.10165 -5.41091 -18.04521 1.000 59.39416 ? 5 THR A HB 1 ATOM 95 H HG1 . THR A 1 5 ? -9.65680 -6.87266 -17.54365 1.000 58.62507 ? 5 THR A HG1 1 ATOM 96 H HG21 . THR A 1 5 ? -6.80729 -7.02214 -19.23998 1.000 62.06149 ? 5 THR A HG21 1 ATOM 97 H HG22 . THR A 1 5 ? -5.92250 -6.11343 -18.29982 1.000 62.06149 ? 5 THR A HG22 1 ATOM 98 H HG23 . THR A 1 5 ? -6.29935 -7.58005 -17.85317 1.000 62.06149 ? 5 THR A HG23 1 ATOM 99 N N . TYR A 1 6 ? -5.44335 -5.28484 -15.38509 1.000 46.53407 ? 6 TYR A N 1 ATOM 100 C CA . TYR A 1 6 ? -4.41545 -4.27030 -15.19124 1.000 44.48282 ? 6 TYR A CA 1 ATOM 101 C C . TYR A 1 6 ? -3.04470 -4.83535 -15.54448 1.000 43.90153 ? 6 TYR A C 1 ATOM 102 O O . TYR A 1 6 ? -2.85414 -6.04538 -15.67631 1.000 43.45961 ? 6 TYR A O 1 ATOM 103 C CB . TYR A 1 6 ? -4.42433 -3.71566 -13.74765 1.000 46.98088 ? 6 TYR A CB 1 ATOM 104 C CG . TYR A 1 6 ? -3.83440 -4.64648 -12.71101 1.000 42.37939 ? 6 TYR A CG 1 ATOM 105 C CD1 . TYR A 1 6 ? -2.46642 -4.68264 -12.48117 1.000 42.66362 ? 6 TYR A CD1 1 ATOM 106 C CD2 . TYR A 1 6 ? -4.64614 -5.50392 -11.97223 1.000 49.04819 ? 6 TYR A CD2 1 ATOM 107 C CE1 . TYR A 1 6 ? -1.91742 -5.54623 -11.55002 1.000 52.06047 ? 6 TYR A CE1 1 ATOM 108 C CE2 . TYR A 1 6 ? -4.10605 -6.36561 -11.03030 1.000 46.94735 ? 6 TYR A CE2 1 ATOM 109 C CZ . TYR A 1 6 ? -2.74271 -6.38038 -10.82479 1.000 49.06347 ? 6 TYR A CZ 1 ATOM 110 O OH . TYR A 1 6 ? -2.20142 -7.24626 -9.90452 1.000 49.90036 ? 6 TYR A OH 1 ATOM 111 H H . TYR A 1 6 ? -5.22575 -6.07620 -15.12818 1.000 55.84088 ? 6 TYR A H 1 ATOM 112 H HA . TYR A 1 6 ? -4.58484 -3.53328 -15.79870 1.000 53.37939 ? 6 TYR A HA 1 ATOM 113 H HB2 . TYR A 1 6 ? -3.90916 -2.89397 -13.72971 1.000 56.37706 ? 6 TYR A HB2 1 ATOM 114 H HB3 . TYR A 1 6 ? -5.34268 -3.53712 -13.49142 1.000 56.37706 ? 6 TYR A HB3 1 ATOM 115 H HD1 . TYR A 1 6 ? -1.90794 -4.11554 -12.96222 1.000 51.19634 ? 6 TYR A HD1 1 ATOM 116 H HD2 . TYR A 1 6 ? -5.56538 -5.49823 -12.11318 1.000 58.85783 ? 6 TYR A HD2 1 ATOM 117 H HE1 . TYR A 1 6 ? -0.99762 -5.56424 -11.41389 1.000 62.47256 ? 6 TYR A HE1 1 ATOM 118 H HE2 . TYR A 1 6 ? -4.65950 -6.92994 -10.54028 1.000 56.33682 ? 6 TYR A HE2 1 ATOM 119 H HH . TYR A 1 6 ? -2.80670 -7.71871 -9.56389 1.000 59.88044 ? 6 TYR A HH 1 ATOM 120 N N . ILE A 1 7 ? -2.09624 -3.91816 -15.72906 1.000 45.01542 ? 7 ILE A N 1 ATOM 121 C CA . ILE A 1 7 ? -0.68521 -4.23848 -15.90255 1.000 45.76783 ? 7 ILE A CA 1 ATOM 122 C C . ILE A 1 7 ? 0.12175 -3.44993 -14.88087 1.000 49.38158 ? 7 ILE A C 1 ATOM 123 O O . ILE A 1 7 ? -0.28017 -2.36958 -14.43801 1.000 46.31029 ? 7 ILE A O 1 ATOM 124 C CB . ILE A 1 7 ? -0.21493 -3.95525 -17.35734 1.000 46.92428 ? 7 ILE A CB 1 ATOM 125 C CG1 . ILE A 1 7 ? 0.00143 -2.46125 -17.60915 1.000 51.87776 ? 7 ILE A CG1 1 ATOM 126 C CG2 . ILE A 1 7 ? -1.19811 -4.56057 -18.34985 1.000 57.74996 ? 7 ILE A CG2 1 ATOM 127 C CD1 . ILE A 1 7 ? 0.84939 -2.18324 -18.84730 1.000 60.84328 ? 7 ILE A CD1 1 ATOM 128 H H . ILE A 1 7 ? -2.25372 -3.07320 -15.75825 1.000 54.01850 ? 7 ILE A H 1 ATOM 129 H HA . ILE A 1 7 ? -0.53334 -5.17959 -15.72325 1.000 54.92140 ? 7 ILE A HA 1 ATOM 130 H HB . ILE A 1 7 ? 0.64850 -4.37946 -17.48161 1.000 56.30914 ? 7 ILE A HB 1 ATOM 131 H HG12 . ILE A 1 7 ? -0.86073 -2.03485 -17.73468 1.000 62.25332 ? 7 ILE A HG12 1 ATOM 132 H HG13 . ILE A 1 7 ? 0.45418 -2.07501 -16.84316 1.000 62.25332 ? 7 ILE A HG13 1 ATOM 133 H HG21 . ILE A 1 7 ? -0.89440 -4.37029 -19.25121 1.000 69.29996 ? 7 ILE A HG21 1 ATOM 134 H HG22 . ILE A 1 7 ? -1.23810 -5.51958 -18.20980 1.000 69.29996 ? 7 ILE A HG22 1 ATOM 135 H HG23 . ILE A 1 7 ? -2.07363 -4.16851 -18.20612 1.000 69.29996 ? 7 ILE A HG23 1 ATOM 136 H HD11 . ILE A 1 7 ? 0.95833 -1.22451 -18.94669 1.000 73.01193 ? 7 ILE A HD11 1 ATOM 137 H HD12 . ILE A 1 7 ? 1.71599 -2.60502 -18.73778 1.000 73.01193 ? 7 ILE A HD12 1 ATOM 138 H HD13 . ILE A 1 7 ? 0.40022 -2.54760 -19.62601 1.000 73.01193 ? 7 ILE A HD13 1 ATOM 139 N N . SER A 1 8 ? 1.26335 -4.00610 -14.48808 1.000 43.95348 ? 8 SER A N 1 ATOM 140 C CA . SER A 1 8 ? 2.13535 -3.32913 -13.54078 1.000 44.97338 ? 8 SER A CA 1 ATOM 141 C C . SER A 1 8 ? 3.57448 -3.73459 -13.81651 1.000 48.24144 ? 8 SER A C 1 ATOM 142 O O . SER A 1 8 ? 3.84443 -4.66012 -14.58120 1.000 46.98958 ? 8 SER A O 1 ATOM 143 C CB . SER A 1 8 ? 1.75385 -3.65282 -12.09058 1.000 47.36354 ? 8 SER A CB 1 ATOM 144 O OG . SER A 1 8 ? 1.99338 -5.02380 -11.80674 1.000 50.16524 ? 8 SER A OG 1 ATOM 145 H H . SER A 1 8 ? 1.55178 -4.77086 -14.75557 1.000 52.74418 ? 8 SER A H 1 ATOM 146 H HA . SER A 1 8 ? 2.05522 -2.37144 -13.67233 1.000 53.96805 ? 8 SER A HA 1 ATOM 147 H HB2 . SER A 1 8 ? 2.28850 -3.10720 -11.49279 1.000 56.83625 ? 8 SER A HB2 1 ATOM 148 H HB3 . SER A 1 8 ? 0.81175 -3.46203 -11.96046 1.000 56.83625 ? 8 SER A HB3 1 ATOM 149 H HG . SER A 1 8 ? 1.41484 -5.50090 -12.18526 1.000 60.19829 ? 8 SER A HG 1 ATOM 150 N N . LYS A 1 9 ? 4.49982 -3.02272 -13.17726 1.000 50.26411 ? 9 LYS A N 1 ATOM 151 C CA . LYS A 1 9 ? 5.92943 -3.25410 -13.31829 1.000 50.03369 ? 9 LYS A CA 1 ATOM 152 C C . LYS A 1 9 ? 6.49523 -3.80553 -12.01546 1.000 53.85095 ? 9 LYS A C 1 ATOM 153 O O . LYS A 1 9 ? 6.11045 -3.35997 -10.92853 1.000 54.00695 ? 9 LYS A O 1 ATOM 154 C CB . LYS A 1 9 ? 6.64974 -1.94960 -13.68745 1.000 57.80125 ? 9 LYS A CB 1 ATOM 155 C CG . LYS A 1 9 ? 8.10313 -2.13504 -14.09691 1.000 69.92290 ? 9 LYS A CG 1 ATOM 156 C CD . LYS A 1 9 ? 8.87245 -0.80895 -14.21803 1.000 83.28784 ? 9 LYS A CD 1 ATOM 157 C CE . LYS A 1 9 ? 9.57201 -0.39099 -12.92441 1.000 114.69245 ? 9 LYS A CE 1 ATOM 158 N NZ . LYS A 1 9 ? 11.05856 -0.43414 -13.05468 1.000 109.77229 ? 9 LYS A NZ 1 ATOM 159 H H . LYS A 1 9 ? 4.31437 -2.37868 -12.63835 1.000 60.31693 ? 9 LYS A H 1 ATOM 160 H HA . LYS A 1 9 ? 6.09012 -3.90661 -14.01779 1.000 60.04043 ? 9 LYS A HA 1 ATOM 161 H HB2 . LYS A 1 9 ? 6.18419 -1.53830 -14.43242 1.000 69.36150 ? 9 LYS A HB2 1 ATOM 162 H HB3 . LYS A 1 9 ? 6.63360 -1.35812 -12.91883 1.000 69.36150 ? 9 LYS A HB3 1 ATOM 163 H HG2 . LYS A 1 9 ? 8.55099 -2.67913 -13.43037 1.000 83.90748 ? 9 LYS A HG2 1 ATOM 164 H HG3 . LYS A 1 9 ? 8.13311 -2.57642 -14.96015 1.000 83.90748 ? 9 LYS A HG3 1 ATOM 165 H HD2 . LYS A 1 9 ? 9.55058 -0.90120 -14.90544 1.000 99.94541 ? 9 LYS A HD2 1 ATOM 166 H HD3 . LYS A 1 9 ? 8.24943 -0.10557 -14.45888 1.000 99.94541 ? 9 LYS A HD3 1 ATOM 167 H HE2 . LYS A 1 9 ? 9.31358 0.51674 -12.70047 1.000 137.63094 ? 9 LYS A HE2 1 ATOM 168 H HE3 . LYS A 1 9 ? 9.31254 -0.99528 -12.21138 1.000 137.63094 ? 9 LYS A HE3 1 ATOM 169 H HZ1 . LYS A 1 9 ? 11.43854 -0.19109 -12.28745 1.000 131.72675 ? 9 LYS A HZ1 1 ATOM 170 H HZ2 . LYS A 1 9 ? 11.32239 -1.25921 -13.25902 1.000 131.72675 ? 9 LYS A HZ2 1 ATOM 171 H HZ3 . LYS A 1 9 ? 11.32407 0.12147 -13.69725 1.000 131.72675 ? 9 LYS A HZ3 1 ATOM 172 N N . PHE A 1 10 ? 7.40252 -4.77998 -12.12387 1.000 54.88724 ? 10 PHE A N 1 ATOM 173 C CA . PHE A 1 10 ? 8.14216 -5.24031 -10.95217 1.000 51.78182 ? 10 PHE A CA 1 ATOM 174 C C . PHE A 1 10 ? 8.84056 -4.05490 -10.28543 1.000 58.21228 ? 10 PHE A C 1 ATOM 175 O O . PHE A 1 10 ? 9.57005 -3.30565 -10.94066 1.000 57.01695 ? 10 PHE A O 1 ATOM 176 C CB . PHE A 1 10 ? 9.20153 -6.28242 -11.34185 1.000 61.98272 ? 10 PHE A CB 1 ATOM 177 C CG . PHE A 1 10 ? 8.65967 -7.65098 -11.73310 1.000 55.27352 ? 10 PHE A CG 1 ATOM 178 C CD1 . PHE A 1 10 ? 7.33941 -7.84165 -12.09919 1.000 52.33465 ? 10 PHE A CD1 1 ATOM 179 C CD2 . PHE A 1 10 ? 9.51655 -8.74699 -11.75794 1.000 63.25909 ? 10 PHE A CD2 1 ATOM 180 C CE1 . PHE A 1 10 ? 6.87796 -9.10179 -12.46957 1.000 53.04933 ? 10 PHE A CE1 1 ATOM 181 C CE2 . PHE A 1 10 ? 9.06147 -10.00589 -12.12526 1.000 63.54220 ? 10 PHE A CE2 1 ATOM 182 C CZ . PHE A 1 10 ? 7.74449 -10.18197 -12.48342 1.000 61.17933 ? 10 PHE A CZ 1 ATOM 183 H H . PHE A 1 10 ? 7.60416 -5.18418 -12.85569 1.000 65.86469 ? 10 PHE A H 1 ATOM 184 H HA . PHE A 1 10 ? 7.51892 -5.65341 -10.33425 1.000 62.13818 ? 10 PHE A HA 1 ATOM 185 H HB2 . PHE A 1 10 ? 9.70056 -5.94159 -12.10061 1.000 74.37926 ? 10 PHE A HB2 1 ATOM 186 H HB3 . PHE A 1 10 ? 9.79501 -6.41208 -10.58564 1.000 74.37926 ? 10 PHE A HB3 1 ATOM 187 H HD1 . PHE A 1 10 ? 6.75323 -7.11965 -12.09787 1.000 62.80158 ? 10 PHE A HD1 1 ATOM 188 H HD2 . PHE A 1 10 ? 10.40965 -8.63415 -11.52440 1.000 75.91091 ? 10 PHE A HD2 1 ATOM 189 H HE1 . PHE A 1 10 ? 5.98664 -9.21837 -12.70800 1.000 63.65920 ? 10 PHE A HE1 1 ATOM 190 H HE2 . PHE A 1 10 ? 9.64583 -10.72936 -12.12931 1.000 76.25064 ? 10 PHE A HE2 1 ATOM 191 H HZ . PHE A 1 10 ? 7.43747 -11.02334 -12.73387 1.000 73.41519 ? 10 PHE A HZ 1 ATOM 192 N N A SER A 1 11 ? 8.62164 -3.88306 -8.97881 0.696 58.64704 ? 11 SER A N 1 ATOM 193 N N B SER A 1 11 ? 8.61785 -3.88933 -8.97825 0.304 58.71689 ? 11 SER A N 1 ATOM 194 C CA A SER A 1 11 ? 9.37756 -2.87665 -8.24290 0.696 61.15171 ? 11 SER A CA 1 ATOM 195 C CA B SER A 1 11 ? 9.36899 -2.89455 -8.22168 0.304 61.20148 ? 11 SER A CA 1 ATOM 196 C C A SER A 1 11 ? 10.82749 -3.29691 -8.05556 0.696 61.19481 ? 11 SER A C 1 ATOM 197 C C B SER A 1 11 ? 10.81809 -3.31531 -8.02090 0.304 61.39257 ? 11 SER A C 1 ATOM 198 O O A SER A 1 11 ? 11.69471 -2.44052 -7.85096 0.696 66.97652 ? 11 SER A O 1 ATOM 199 O O B SER A 1 11 ? 11.67834 -2.45821 -7.79252 0.304 67.01436 ? 11 SER A O 1 ATOM 200 C CB A SER A 1 11 ? 8.73741 -2.62276 -6.87876 0.696 62.14118 ? 11 SER A CB 1 ATOM 201 C CB B SER A 1 11 ? 8.71407 -2.65496 -6.86010 0.304 62.19665 ? 11 SER A CB 1 ATOM 202 O OG A SER A 1 11 ? 9.00124 -3.69852 -5.99389 0.696 67.00836 ? 11 SER A OG 1 ATOM 203 O OG B SER A 1 11 ? 7.57009 -1.82991 -6.97550 0.304 63.44261 ? 11 SER A OG 1 ATOM 204 H H A SER A 1 11 ? 8.05412 -4.32709 -8.50937 0.696 70.37645 ? 11 SER A H 1 ATOM 205 H H B SER A 1 11 ? 8.04558 -4.33494 -8.51614 0.304 70.46027 ? 11 SER A H 1 ATOM 206 H HA A SER A 1 11 ? 9.35591 -2.04276 -8.73792 0.696 73.38205 ? 11 SER A HA 1 ATOM 207 H HA B SER A 1 11 ? 9.35428 -2.05655 -8.70998 0.304 73.44178 ? 11 SER A HA 1 ATOM 208 H HB2 A SER A 1 11 ? 9.10484 -1.80715 -6.50369 0.696 74.56942 ? 11 SER A HB2 1 ATOM 209 H HB2 B SER A 1 11 ? 8.44804 -3.50923 -6.48545 0.304 74.63598 ? 11 SER A HB2 1 ATOM 210 H HB3 A SER A 1 11 ? 7.77808 -2.53348 -6.99111 0.696 74.56942 ? 11 SER A HB3 1 ATOM 211 H HB3 B SER A 1 11 ? 9.35549 -2.22164 -6.27554 0.304 74.63598 ? 11 SER A HB3 1 ATOM 212 H HG A SER A 1 11 ? 8.65950 -3.54289 -5.24250 0.696 80.41004 ? 11 SER A HG 1 ATOM 213 H HG B SER A 1 11 ? 7.22499 -1.70983 -6.21914 0.304 76.13113 ? 11 SER A HG 1 ATOM 214 N N A ARG A 1 12 ? 11.10030 -4.59449 -8.13066 0.696 64.25468 ? 12 ARG A N 1 ATOM 215 N N B ARG A 1 12 ? 11.10029 -4.61111 -8.10439 0.304 64.34206 ? 12 ARG A N 1 ATOM 216 C CA A ARG A 1 12 ? 12.43326 -5.14109 -7.93490 0.696 71.50143 ? 12 ARG A CA 1 ATOM 217 C CA B ARG A 1 12 ? 12.43996 -5.14487 -7.90903 0.304 71.46020 ? 12 ARG A CA 1 ATOM 218 C C A ARG A 1 12 ? 12.48887 -6.50350 -8.60803 0.696 68.48802 ? 12 ARG A C 1 ATOM 219 C C B ARG A 1 12 ? 12.49118 -6.53055 -8.53436 0.304 68.57768 ? 12 ARG A C 1 ATOM 220 O O A ARG A 1 12 ? 11.44568 -7.07716 -8.94272 0.696 63.37626 ? 12 ARG A O 1 ATOM 221 O O B ARG A 1 12 ? 11.44382 -7.14399 -8.77425 0.304 63.99968 ? 12 ARG A O 1 ATOM 222 C CB A ARG A 1 12 ? 12.76968 -5.26277 -6.43893 0.696 72.89226 ? 12 ARG A CB 1 ATOM 223 C CB B ARG A 1 12 ? 12.80270 -5.19959 -6.41398 0.304 72.90185 ? 12 ARG A CB 1 ATOM 224 C CG A ARG A 1 12 ? 12.09887 -6.44333 -5.73847 0.696 77.27116 ? 12 ARG A CG 1 ATOM 225 C CG B ARG A 1 12 ? 12.75539 -6.58660 -5.77838 0.304 79.52028 ? 12 ARG A CG 1 ATOM 226 C CD A ARG A 1 12 ? 12.24998 -6.35462 -4.22015 0.696 85.30567 ? 12 ARG A CD 1 ATOM 227 C CD B ARG A 1 12 ? 12.97208 -6.50735 -4.26639 0.304 82.81030 ? 12 ARG A CD 1 ATOM 228 N NE A ARG A 1 12 ? 11.25615 -7.15554 -3.51258 0.696 88.11977 ? 12 ARG A NE 1 ATOM 229 N NE B ARG A 1 12 ? 12.03535 -7.33560 -3.51324 0.304 87.89089 ? 12 ARG A NE 1 ATOM 230 C CZ A ARG A 1 12 ? 11.25719 -8.48139 -3.45968 0.696 90.62473 ? 12 ARG A CZ 1 ATOM 231 C CZ B ARG A 1 12 ? 10.81546 -6.96046 -3.14844 0.304 87.28171 ? 12 ARG A CZ 1 ATOM 232 N NH1 A ARG A 1 12 ? 12.19088 -9.19733 -4.06567 0.696 90.09563 ? 12 ARG A NH1 1 ATOM 233 N NH1 B ARG A 1 12 ? 10.33452 -5.76754 -3.46028 0.304 82.06473 ? 12 ARG A NH1 1 ATOM 234 N NH2 A ARG A 1 12 ? 10.29794 -9.10457 -2.78048 0.696 88.58008 ? 12 ARG A NH2 1 ATOM 235 N NH2 B ARG A 1 12 ? 10.06024 -7.80339 -2.44960 0.304 86.21970 ? 12 ARG A NH2 1 ATOM 236 H H A ARG A 1 12 ? 10.50976 -5.19648 -8.29939 0.696 77.10561 ? 12 ARG A H 1 ATOM 237 H H B ARG A 1 12 ? 10.51519 -5.21700 -8.27807 0.304 77.21047 ? 12 ARG A H 1 ATOM 238 H HA A ARG A 1 12 ? 13.09161 -4.56304 -8.35122 0.696 85.80172 ? 12 ARG A HA 1 ATOM 239 H HA B ARG A 1 12 ? 13.09162 -4.58372 -8.35774 0.304 85.75223 ? 12 ARG A HA 1 ATOM 240 H HB2 A ARG A 1 12 ? 13.72896 -5.37164 -6.34496 0.696 87.47071 ? 12 ARG A HB2 1 ATOM 241 H HB2 B ARG A 1 12 ? 13.70610 -4.86313 -6.30651 0.304 87.48222 ? 12 ARG A HB2 1 ATOM 242 H HB3 A ARG A 1 12 ? 12.48218 -4.45249 -5.98982 0.696 87.47071 ? 12 ARG A HB3 1 ATOM 243 H HB3 B ARG A 1 12 ? 12.17931 -4.63751 -5.92781 0.304 87.48222 ? 12 ARG A HB3 1 ATOM 244 H HG2 A ARG A 1 12 ? 11.15239 -6.44709 -5.95074 0.696 92.72539 ? 12 ARG A HG2 1 ATOM 245 H HG2 B ARG A 1 12 ? 11.88769 -6.98771 -5.94305 0.304 95.42434 ? 12 ARG A HG2 1 ATOM 246 H HG3 A ARG A 1 12 ? 12.50928 -7.26971 -6.03773 0.696 92.72539 ? 12 ARG A HG3 1 ATOM 247 H HG3 B ARG A 1 12 ? 13.45460 -7.14038 -6.15960 0.304 95.42434 ? 12 ARG A HG3 1 ATOM 248 H HD2 A ARG A 1 12 ? 13.12992 -6.67677 -3.96948 0.696 102.36680 ? 12 ARG A HD2 1 ATOM 249 H HD2 B ARG A 1 12 ? 13.87059 -6.80905 -4.06011 0.304 99.37237 ? 12 ARG A HD2 1 ATOM 250 H HD3 A ARG A 1 12 ? 12.14385 -5.43079 -3.94414 0.696 102.36680 ? 12 ARG A HD3 1 ATOM 251 H HD3 B ARG A 1 12 ? 12.85652 -5.58821 -3.97877 0.304 99.37237 ? 12 ARG A HD3 1 ATOM 252 H HE A ARG A 1 12 ? 10.62597 -6.73923 -3.10129 0.696 105.74373 ? 12 ARG A HE 1 ATOM 253 H HE B ARG A 1 12 ? 12.29286 -8.12499 -3.28930 0.304 105.46907 ? 12 ARG A HE 1 ATOM 254 H HH11 A ARG A 1 12 ? 12.17266 -10.05585 -4.01857 0.696 108.11476 ? 12 ARG A HH11 1 ATOM 255 H HH11 B ARG A 1 12 ? 10.81538 -5.21414 -3.90986 0.304 98.47768 ? 12 ARG A HH11 1 ATOM 256 H HH12 A ARG A 1 12 ? 12.81581 -8.80404 -4.50656 0.696 108.11476 ? 12 ARG A HH12 1 ATOM 257 H HH12 B ARG A 1 12 ? 9.54115 -5.54579 -3.21334 0.304 98.47768 ? 12 ARG A HH12 1 ATOM 258 H HH21 A ARG A 1 12 ? 9.68709 -8.64846 -2.38245 0.696 106.29610 ? 12 ARG A HH21 1 ATOM 259 H HH21 B ARG A 1 12 ? 9.26821 -7.57163 -2.20755 0.304 103.46364 ? 12 ARG A HH21 1 ATOM 260 H HH22 A ARG A 1 12 ? 10.28868 -9.96354 -2.73943 0.696 106.29610 ? 12 ARG A HH22 1 ATOM 261 H HH22 B ARG A 1 12 ? 10.36397 -8.58013 -2.23981 0.304 103.46364 ? 12 ARG A HH22 1 ATOM 262 N N . PRO A 1 13 ? 13.68418 -7.03771 -8.83801 1.000 74.22189 ? 13 PRO A N 1 ATOM 263 C CA . PRO A 1 13 ? 13.78555 -8.41142 -9.34269 1.000 72.39822 ? 13 PRO A CA 1 ATOM 264 C C . PRO A 1 13 ? 13.04775 -9.38822 -8.43807 1.000 77.09740 ? 13 PRO A C 1 ATOM 265 O O . PRO A 1 13 ? 13.23070 -9.39610 -7.21765 1.000 79.86554 ? 13 PRO A O 1 ATOM 266 C CB . PRO A 1 13 ? 15.29500 -8.68551 -9.35298 1.000 80.88639 ? 13 PRO A CB 1 ATOM 267 C CG . PRO A 1 13 ? 15.97644 -7.38432 -9.03297 1.000 85.68164 ? 13 PRO A CG 1 ATOM 268 C CD . PRO A 1 13 ? 14.95397 -6.30238 -8.95969 1.000 86.50057 ? 13 PRO A CD 1 ATOM 269 H HA . PRO A 1 13 ? 13.43720 -8.46702 -10.24627 1.000 86.87787 ? 13 PRO A HA 1 ATOM 270 H HB2 . PRO A 1 13 ? 15.50600 -9.35408 -8.68261 1.000 97.06367 ? 13 PRO A HB2 1 ATOM 271 H HB3 . PRO A 1 13 ? 15.55952 -9.00125 -10.23118 1.000 97.06367 ? 13 PRO A HB3 1 ATOM 272 H HG2 . PRO A 1 13 ? 16.43042 -7.46954 -8.18001 1.000 102.81796 ? 13 PRO A HG2 1 ATOM 273 H HG3 . PRO A 1 13 ? 16.61877 -7.18640 -9.73236 1.000 102.81796 ? 13 PRO A HG3 1 ATOM 274 H HD2 . PRO A 1 13 ? 15.10229 -5.74021 -8.18325 1.000 103.80068 ? 13 PRO A HD2 1 ATOM 275 H HD3 . PRO A 1 13 ? 14.96413 -5.76357 -9.76622 1.000 103.80068 ? 13 PRO A HD3 1 ATOM 276 N N . LEU A 1 14 ? 12.20103 -10.21070 -9.04862 1.000 74.14846 ? 14 LEU A N 1 ATOM 277 C CA . LEU A 1 14 ? 11.49018 -11.27921 -8.36188 1.000 65.34509 ? 14 LEU A CA 1 ATOM 278 C C . LEU A 1 14 ? 11.90501 -12.60854 -8.97460 1.000 72.42652 ? 14 LEU A C 1 ATOM 279 O O . LEU A 1 14 ? 11.91837 -12.75184 -10.20266 1.000 69.65838 ? 14 LEU A O 1 ATOM 280 C CB . LEU A 1 14 ? 9.97409 -11.10394 -8.47178 1.000 61.08731 ? 14 LEU A CB 1 ATOM 281 C CG . LEU A 1 14 ? 9.37972 -9.76240 -8.05121 1.000 59.92989 ? 14 LEU A CG 1 ATOM 282 C CD1 . LEU A 1 14 ? 7.87419 -9.76966 -8.26656 1.000 63.03485 ? 14 LEU A CD1 1 ATOM 283 C CD2 . LEU A 1 14 ? 9.70665 -9.45951 -6.59837 1.000 74.84819 ? 14 LEU A CD2 1 ATOM 284 H H . LEU A 1 14 ? 12.01727 -10.16654 -9.88759 1.000 88.97815 ? 14 LEU A H 1 ATOM 285 H HA . LEU A 1 14 ? 11.72550 -11.27481 -7.42086 1.000 78.41411 ? 14 LEU A HA 1 ATOM 286 H HB2 . LEU A 1 14 ? 9.72772 -11.23987 -9.40007 1.000 73.30477 ? 14 LEU A HB2 1 ATOM 287 H HB3 . LEU A 1 14 ? 9.55759 -11.78066 -7.91548 1.000 73.30477 ? 14 LEU A HB3 1 ATOM 288 H HG . LEU A 1 14 ? 9.76680 -9.05879 -8.59527 1.000 71.91587 ? 14 LEU A HG 1 ATOM 289 H HD11 . LEU A 1 14 ? 7.51226 -8.91152 -7.99546 1.000 75.64182 ? 14 LEU A HD11 1 ATOM 290 H HD12 . LEU A 1 14 ? 7.69035 -9.92420 -9.20635 1.000 75.64182 ? 14 LEU A HD12 1 ATOM 291 H HD13 . LEU A 1 14 ? 7.48213 -10.47778 -7.73201 1.000 75.64182 ? 14 LEU A HD13 1 ATOM 292 H HD21 . LEU A 1 14 ? 9.27511 -8.62883 -6.34412 1.000 89.81782 ? 14 LEU A HD21 1 ATOM 293 H HD22 . LEU A 1 14 ? 9.38046 -10.18509 -6.04337 1.000 89.81782 ? 14 LEU A HD22 1 ATOM 294 H HD23 . LEU A 1 14 ? 10.66820 -9.37577 -6.50189 1.000 89.81782 ? 14 LEU A HD23 1 ATOM 295 N N . SER A 1 15 ? 12.23857 -13.57480 -8.12665 1.000 66.14339 ? 15 SER A N 1 ATOM 296 C CA . SER A 1 15 ? 12.58794 -14.89349 -8.62517 1.000 73.53055 ? 15 SER A CA 1 ATOM 297 C C . SER A 1 15 ? 11.32485 -15.65719 -9.00949 1.000 67.72343 ? 15 SER A C 1 ATOM 298 O O . SER A 1 15 ? 10.20535 -15.28681 -8.65011 1.000 59.65351 ? 15 SER A O 1 ATOM 299 C CB . SER A 1 15 ? 13.37557 -15.68053 -7.58149 1.000 74.92544 ? 15 SER A CB 1 ATOM 300 O OG . SER A 1 15 ? 12.83215 -15.49215 -6.28818 1.000 81.21953 ? 15 SER A OG 1 ATOM 301 H H . SER A 1 15 ? 12.26900 -13.49089 -7.27130 1.000 79.37206 ? 15 SER A H 1 ATOM 302 H HA . SER A 1 15 ? 13.14882 -14.79523 -9.41044 1.000 88.23666 ? 15 SER A HA 1 ATOM 303 H HB2 . SER A 1 15 ? 13.33904 -16.62386 -7.80439 1.000 89.91053 ? 15 SER A HB2 1 ATOM 304 H HB3 . SER A 1 15 ? 14.29598 -15.37436 -7.58431 1.000 89.91053 ? 15 SER A HB3 1 ATOM 305 H HG . SER A 1 15 ? 13.26808 -15.93832 -5.72560 1.000 97.46344 ? 15 SER A HG 1 ATOM 306 N N . GLY A 1 16 ? 11.51426 -16.74475 -9.75274 1.000 66.08777 ? 16 GLY A N 1 ATOM 307 C CA . GLY A 1 16 ? 10.37922 -17.57670 -10.10441 1.000 70.84422 ? 16 GLY A CA 1 ATOM 308 C C . GLY A 1 16 ? 9.64419 -18.08863 -8.88093 1.000 66.84697 ? 16 GLY A C 1 ATOM 309 O O . GLY A 1 16 ? 8.41371 -18.18002 -8.87521 1.000 60.85203 ? 16 GLY A O 1 ATOM 310 H H . GLY A 1 16 ? 12.27241 -17.01355 -10.05698 1.000 79.30533 ? 16 GLY A H 1 ATOM 311 H HA2 . GLY A 1 16 ? 9.75758 -17.06220 -10.64268 1.000 85.01306 ? 16 GLY A HA2 1 ATOM 312 H HA3 . GLY A 1 16 ? 10.68639 -18.33938 -10.61906 1.000 85.01306 ? 16 GLY A HA3 1 ATOM 313 N N A ASP A 1 17 ? 10.38409 -18.40571 -7.81600 0.531 64.96397 ? 17 ASP A N 1 ATOM 314 N N B ASP A 1 17 ? 10.38777 -18.43405 -7.82762 0.469 64.99213 ? 17 ASP A N 1 ATOM 315 C CA A ASP A 1 17 ? 9.74157 -18.96666 -6.63199 0.531 67.95160 ? 17 ASP A CA 1 ATOM 316 C CA B ASP A 1 17 ? 9.75013 -18.95363 -6.62302 0.469 67.95723 ? 17 ASP A CA 1 ATOM 317 C C A ASP A 1 17 ? 8.90259 -17.92171 -5.90544 0.531 64.83575 ? 17 ASP A C 1 ATOM 318 C C B ASP A 1 17 ? 8.85186 -17.90300 -5.98618 0.469 64.83405 ? 17 ASP A C 1 ATOM 319 O O A ASP A 1 17 ? 7.87371 -18.26398 -5.31168 0.531 61.40249 ? 17 ASP A O 1 ATOM 320 O O B ASP A 1 17 ? 7.74120 -18.21206 -5.53876 0.469 61.02645 ? 17 ASP A O 1 ATOM 321 C CB A ASP A 1 17 ? 10.79074 -19.58720 -5.70045 0.531 69.49396 ? 17 ASP A CB 1 ATOM 322 C CB B ASP A 1 17 ? 10.80695 -19.42488 -5.62426 0.469 69.55083 ? 17 ASP A CB 1 ATOM 323 C CG A ASP A 1 17 ? 11.77676 -18.57274 -5.14637 0.531 73.90852 ? 17 ASP A CG 1 ATOM 324 C CG B ASP A 1 17 ? 11.42233 -20.75554 -6.00872 0.469 75.18405 ? 17 ASP A CG 1 ATOM 325 O OD1 A ASP A 1 17 ? 12.52981 -17.96896 -5.93970 0.531 75.99186 ? 17 ASP A OD1 1 ATOM 326 O OD1 B ASP A 1 17 ? 10.87968 -21.42991 -6.91061 0.469 79.60493 ? 17 ASP A OD1 1 ATOM 327 O OD2 A ASP A 1 17 ? 11.82166 -18.40659 -3.90716 0.531 77.98239 ? 17 ASP A OD2 1 ATOM 328 O OD2 B ASP A 1 17 ? 12.44597 -21.13342 -5.39939 0.469 85.93020 ? 17 ASP A OD2 1 ATOM 329 H H A ASP A 1 17 ? 11.23646 -18.30797 -7.75674 0.531 77.95676 ? 17 ASP A H 1 ATOM 330 H H B ASP A 1 17 ? 11.24500 -18.37784 -7.78749 0.469 77.99056 ? 17 ASP A H 1 ATOM 331 H HA A ASP A 1 17 ? 9.14483 -19.68155 -6.90352 0.531 81.54192 ? 17 ASP A HA 1 ATOM 332 H HA B ASP A 1 17 ? 9.20494 -19.71872 -6.86447 0.469 81.54868 ? 17 ASP A HA 1 ATOM 333 H HB2 A ASP A 1 17 ? 10.33792 -20.00283 -4.95004 0.531 83.39275 ? 17 ASP A HB2 1 ATOM 334 H HB2 B ASP A 1 17 ? 11.51792 -18.76640 -5.58166 0.469 83.46099 ? 17 ASP A HB2 1 ATOM 335 H HB3 A ASP A 1 17 ? 11.29450 -20.25309 -6.19412 0.531 83.39275 ? 17 ASP A HB3 1 ATOM 336 H HB3 B ASP A 1 17 ? 10.39516 -19.52541 -4.75177 0.469 83.46099 ? 17 ASP A HB3 1 ATOM 337 N N . GLU A 1 18 ? 9.30369 -16.64768 -5.96152 1.000 61.23049 ? 18 GLU A N 1 ATOM 338 C CA . GLU A 1 18 ? 8.50455 -15.59402 -5.34485 1.000 66.44575 ? 18 GLU A CA 1 ATOM 339 C C . GLU A 1 18 ? 7.21069 -15.37642 -6.11470 1.000 57.31559 ? 18 GLU A C 1 ATOM 340 O O . GLU A 1 18 ? 6.15946 -15.11901 -5.51560 1.000 58.40167 ? 18 GLU A O 1 ATOM 341 C CB . GLU A 1 18 ? 9.29823 -14.29006 -5.27136 1.000 65.00607 ? 18 GLU A CB 1 ATOM 342 C CG . GLU A 1 18 ? 10.54794 -14.36718 -4.40648 1.000 73.89272 ? 18 GLU A CG 1 ATOM 343 C CD . GLU A 1 18 ? 11.31360 -13.05561 -4.38668 1.000 91.16710 ? 18 GLU A CD 1 ATOM 344 O OE1 . GLU A 1 18 ? 11.00695 -12.20486 -3.52333 1.000 87.75901 ? 18 GLU A OE1 1 ATOM 345 O OE2 . GLU A 1 18 ? 12.20586 -12.86870 -5.24683 1.000 77.11141 ? 18 GLU A OE2 1 ATOM 346 H H . GLU A 1 18 ? 10.02398 -16.37737 -6.34586 1.000 73.47659 ? 18 GLU A H 1 ATOM 347 H HA . GLU A 1 18 ? 8.28807 -15.86114 -4.43783 1.000 79.73490 ? 18 GLU A HA 1 ATOM 348 H HB2 . GLU A 1 18 ? 9.57576 -14.04522 -6.16798 1.000 78.00729 ? 18 GLU A HB2 1 ATOM 349 H HB3 . GLU A 1 18 ? 8.72638 -13.59964 -4.90092 1.000 78.00729 ? 18 GLU A HB3 1 ATOM 350 H HG2 . GLU A 1 18 ? 10.29201 -14.58165 -3.49577 1.000 88.67126 ? 18 GLU A HG2 1 ATOM 351 H HG3 . GLU A 1 18 ? 11.13545 -15.05499 -4.75671 1.000 88.67126 ? 18 GLU A HG3 1 ATOM 352 N N . ILE A 1 19 ? 7.26938 -15.46623 -7.44706 1.000 57.00147 ? 19 ILE A N 1 ATOM 353 C CA . ILE A 1 19 ? 6.06236 -15.31485 -8.25337 1.000 56.99423 ? 19 ILE A CA 1 ATOM 354 C C . ILE A 1 19 ? 5.09761 -16.45852 -7.97368 1.000 54.44378 ? 19 ILE A C 1 ATOM 355 O O . ILE A 1 19 ? 3.88115 -16.25180 -7.86696 1.000 52.27619 ? 19 ILE A O 1 ATOM 356 C CB . ILE A 1 19 ? 6.42334 -15.22766 -9.74844 1.000 65.54161 ? 19 ILE A CB 1 ATOM 357 C CG1 . ILE A 1 19 ? 7.10057 -13.88632 -10.05431 1.000 63.01709 ? 19 ILE A CG1 1 ATOM 358 C CG2 . ILE A 1 19 ? 5.17726 -15.39889 -10.62311 1.000 53.91816 ? 19 ILE A CG2 1 ATOM 359 C CD1 . ILE A 1 19 ? 8.24411 -13.99406 -11.04990 1.000 71.67967 ? 19 ILE A CD1 1 ATOM 360 H H . ILE A 1 19 ? 7.98609 -15.61209 -7.89944 1.000 68.40177 ? 19 ILE A H 1 ATOM 361 H HA . ILE A 1 19 ? 5.62593 -14.48473 -8.00574 1.000 68.39307 ? 19 ILE A HA 1 ATOM 362 H HB . ILE A 1 19 ? 7.04150 -15.94767 -9.94933 1.000 78.64993 ? 19 ILE A HB 1 ATOM 363 H HG12 . ILE A 1 19 ? 6.44023 -13.28049 -10.42554 1.000 75.62051 ? 19 ILE A HG12 1 ATOM 364 H HG13 . ILE A 1 19 ? 7.45860 -13.52197 -9.22971 1.000 75.62051 ? 19 ILE A HG13 1 ATOM 365 H HG21 . ILE A 1 19 ? 5.37268 -15.07814 -11.51744 1.000 64.70179 ? 19 ILE A HG21 1 ATOM 366 H HG22 . ILE A 1 19 ? 4.93941 -16.33879 -10.65341 1.000 64.70179 ? 19 ILE A HG22 1 ATOM 367 H HG23 . ILE A 1 19 ? 4.44911 -14.88562 -10.23937 1.000 64.70179 ? 19 ILE A HG23 1 ATOM 368 H HD11 . ILE A 1 19 ? 8.47046 -13.10615 -11.36816 1.000 86.01561 ? 19 ILE A HD11 1 ATOM 369 H HD12 . ILE A 1 19 ? 9.01050 -14.39263 -10.60866 1.000 86.01561 ? 19 ILE A HD12 1 ATOM 370 H HD13 . ILE A 1 19 ? 7.96413 -14.55055 -11.79343 1.000 86.01561 ? 19 ILE A HD13 1 ATOM 371 N N A GLU A 1 20 ? 5.62068 -17.68394 -7.86584 0.654 56.93936 ? 20 GLU A N 1 ATOM 372 N N B GLU A 1 20 ? 5.61793 -17.67817 -7.83363 0.346 57.03645 ? 20 GLU A N 1 ATOM 373 C CA A GLU A 1 20 ? 4.77738 -18.82217 -7.51668 0.654 60.29067 ? 20 GLU A CA 1 ATOM 374 C CA B GLU A 1 20 ? 4.75032 -18.81156 -7.53844 0.346 60.26061 ? 20 GLU A CA 1 ATOM 375 C C A GLU A 1 20 ? 4.10739 -18.60758 -6.16833 0.654 57.28791 ? 20 GLU A C 1 ATOM 376 C C B GLU A 1 20 ? 4.14610 -18.70529 -6.14151 0.346 57.30191 ? 20 GLU A C 1 ATOM 377 O O A GLU A 1 20 ? 2.92783 -18.93381 -5.98971 0.654 52.44527 ? 20 GLU A O 1 ATOM 378 O O B GLU A 1 20 ? 3.03846 -19.20249 -5.90904 0.346 53.32445 ? 20 GLU A O 1 ATOM 379 C CB A GLU A 1 20 ? 5.60381 -20.11044 -7.48226 0.654 58.82704 ? 20 GLU A CB 1 ATOM 380 C CB B GLU A 1 20 ? 5.52756 -20.12098 -7.68306 0.346 59.65205 ? 20 GLU A CB 1 ATOM 381 C CG A GLU A 1 20 ? 5.50508 -20.96372 -8.73916 0.654 66.38468 ? 20 GLU A CG 1 ATOM 382 C CG B GLU A 1 20 ? 5.82741 -20.53853 -9.12811 0.346 64.78300 ? 20 GLU A CG 1 ATOM 383 C CD A GLU A 1 20 ? 4.10552 -21.50162 -8.98014 0.654 76.12385 ? 20 GLU A CD 1 ATOM 384 C CD B GLU A 1 20 ? 4.60957 -20.49647 -10.03772 0.346 69.28216 ? 20 GLU A CD 1 ATOM 385 O OE1 A GLU A 1 20 ? 3.59834 -22.26418 -8.12734 0.654 67.30663 ? 20 GLU A OE1 1 ATOM 386 O OE1 B GLU A 1 20 ? 3.61768 -21.19561 -9.74310 0.346 71.88065 ? 20 GLU A OE1 1 ATOM 387 O OE2 A GLU A 1 20 ? 3.51055 -21.15915 -10.02553 0.654 71.84544 ? 20 GLU A OE2 1 ATOM 388 O OE2 B GLU A 1 20 ? 4.64897 -19.77025 -11.05502 0.346 70.46094 ? 20 GLU A OE2 1 ATOM 389 H H A GLU A 1 20 ? 6.44953 -17.87773 -7.98857 0.654 68.32723 ? 20 GLU A H 1 ATOM 390 H H B GLU A 1 20 ? 6.45320 -17.87062 -7.90354 0.346 68.44374 ? 20 GLU A H 1 ATOM 391 H HA A GLU A 1 20 ? 4.09354 -18.91758 -8.19798 0.654 72.34881 ? 20 GLU A HA 1 ATOM 392 H HA B GLU A 1 20 ? 4.02320 -18.82360 -8.18035 0.346 72.31273 ? 20 GLU A HA 1 ATOM 393 H HB2 A GLU A 1 20 ? 6.53699 -19.87470 -7.36187 0.654 70.59245 ? 20 GLU A HB2 1 ATOM 394 H HB2 B GLU A 1 20 ? 6.37738 -20.02602 -7.22515 0.346 71.58246 ? 20 GLU A HB2 1 ATOM 395 H HB3 A GLU A 1 20 ? 5.29959 -20.65181 -6.73710 0.654 70.59245 ? 20 GLU A HB3 1 ATOM 396 H HB3 B GLU A 1 20 ? 5.00907 -20.83259 -7.27602 0.346 71.58246 ? 20 GLU A HB3 1 ATOM 397 H HG2 A GLU A 1 20 ? 5.75502 -20.42540 -9.50639 0.654 79.66161 ? 20 GLU A HG2 1 ATOM 398 H HG2 B GLU A 1 20 ? 6.49334 -19.93683 -9.49606 0.346 77.73960 ? 20 GLU A HG2 1 ATOM 399 H HG3 A GLU A 1 20 ? 6.10611 -21.72039 -8.65484 0.654 79.66161 ? 20 GLU A HG3 1 ATOM 400 H HG3 B GLU A 1 20 ? 6.16587 -21.44757 -9.12749 0.346 77.73960 ? 20 GLU A HG3 1 ATOM 401 N N . ALA A 1 21 ? 4.85000 -18.06875 -5.20119 1.000 51.54227 ? 21 ALA A N 1 ATOM 402 C CA . ALA A 1 21 ? 4.29052 -17.89003 -3.86440 1.000 52.79075 ? 21 ALA A CA 1 ATOM 403 C C . ALA A 1 21 ? 3.17039 -16.85792 -3.88010 1.000 50.17159 ? 21 ALA A C 1 ATOM 404 O O . ALA A 1 21 ? 2.17699 -17.00260 -3.15804 1.000 52.05695 ? 21 ALA A O 1 ATOM 405 C CB . ALA A 1 21 ? 5.38678 -17.48505 -2.88100 1.000 63.27589 ? 21 ALA A CB 1 ATOM 406 H H A ALA A 1 21 ? 5.66325 -17.80398 -5.29129 0.654 61.85072 ? 21 ALA A H 1 ATOM 407 H H B ALA A 1 21 ? 5.63653 -17.73867 -5.31085 0.346 61.85072 ? 21 ALA A H 1 ATOM 408 H HA . ALA A 1 21 ? 3.92216 -18.73443 -3.56077 1.000 63.34890 ? 21 ALA A HA 1 ATOM 409 H HB1 . ALA A 1 21 ? 4.99436 -17.36651 -2.00187 1.000 75.93107 ? 21 ALA A HB1 1 ATOM 410 H HB2 . ALA A 1 21 ? 6.05875 -18.18398 -2.85177 1.000 75.93107 ? 21 ALA A HB2 1 ATOM 411 H HB3 . ALA A 1 21 ? 5.78721 -16.65346 -3.17936 1.000 75.93107 ? 21 ALA A HB3 1 ATOM 412 N N . ILE A 1 22 ? 3.30702 -15.81738 -4.70697 1.000 51.98679 ? 22 ILE A N 1 ATOM 413 C CA . ILE A 1 22 ? 2.21596 -14.86276 -4.88708 1.000 51.33918 ? 22 ILE A CA 1 ATOM 414 C C . ILE A 1 22 ? 0.98440 -15.57017 -5.42958 1.000 56.50119 ? 22 ILE A C 1 ATOM 415 O O . ILE A 1 22 ? -0.14026 -15.33268 -4.97155 1.000 51.22048 ? 22 ILE A O 1 ATOM 416 C CB . ILE A 1 22 ? 2.65508 -13.70809 -5.80687 1.000 55.19133 ? 22 ILE A CB 1 ATOM 417 C CG1 . ILE A 1 22 ? 3.65619 -12.80285 -5.08143 1.000 56.51998 ? 22 ILE A CG1 1 ATOM 418 C CG2 . ILE A 1 22 ? 1.43454 -12.90839 -6.29101 1.000 57.02747 ? 22 ILE A CG2 1 ATOM 419 C CD1 . ILE A 1 22 ? 4.45548 -11.91307 -6.00814 1.000 59.42791 ? 22 ILE A CD1 1 ATOM 420 H H . ILE A 1 22 ? 4.01210 -15.64525 -5.16831 1.000 62.38414 ? 22 ILE A H 1 ATOM 421 H HA . ILE A 1 22 ? 1.99237 -14.48426 -4.02242 1.000 61.60701 ? 22 ILE A HA 1 ATOM 422 H HB . ILE A 1 22 ? 3.09499 -14.08370 -6.58552 1.000 66.22959 ? 22 ILE A HB 1 ATOM 423 H HG12 . ILE A 1 22 ? 3.17077 -12.23039 -4.46697 1.000 67.82398 ? 22 ILE A HG12 1 ATOM 424 H HG13 . ILE A 1 22 ? 4.28226 -13.35926 -4.59219 1.000 67.82398 ? 22 ILE A HG13 1 ATOM 425 H HG21 . ILE A 1 22 ? 1.73409 -12.05235 -6.63505 1.000 68.43296 ? 22 ILE A HG21 1 ATOM 426 H HG22 . ILE A 1 22 ? 0.98716 -13.40825 -6.99165 1.000 68.43296 ? 22 ILE A HG22 1 ATOM 427 H HG23 . ILE A 1 22 ? 0.83022 -12.77177 -5.54466 1.000 68.43296 ? 22 ILE A HG23 1 ATOM 428 H HD11 . ILE A 1 22 ? 5.12182 -11.43505 -5.49008 1.000 71.31349 ? 22 ILE A HD11 1 ATOM 429 H HD12 . ILE A 1 22 ? 4.88993 -12.46396 -6.67798 1.000 71.31349 ? 22 ILE A HD12 1 ATOM 430 H HD13 . ILE A 1 22 ? 3.85516 -11.28307 -6.43664 1.000 71.31349 ? 22 ILE A HD13 1 ATOM 431 N N . GLY A 1 23 ? 1.17782 -16.46493 -6.40094 1.000 51.25449 ? 23 GLY A N 1 ATOM 432 C CA . GLY A 1 23 ? 0.05104 -17.19726 -6.95060 1.000 51.21008 ? 23 GLY A CA 1 ATOM 433 C C . GLY A 1 23 ? -0.58562 -18.14128 -5.94981 1.000 48.99748 ? 23 GLY A C 1 ATOM 434 O O . GLY A 1 23 ? -1.80899 -18.30721 -5.93638 1.000 51.31204 ? 23 GLY A O 1 ATOM 435 H H . GLY A 1 23 ? 1.93941 -16.65966 -6.74974 1.000 61.50538 ? 23 GLY A H 1 ATOM 436 H HA2 . GLY A 1 23 ? -0.62495 -16.56742 -7.24595 1.000 61.45210 ? 23 GLY A HA2 1 ATOM 437 H HA3 . GLY A 1 23 ? 0.35059 -17.71894 -7.71154 1.000 61.45210 ? 23 GLY A HA3 1 ATOM 438 N N . ARG A 1 24 ? 0.23284 -18.79543 -5.11801 1.000 51.58396 ? 24 ARG A N 1 ATOM 439 C CA . ARG A 1 24 ? -0.30269 -19.68888 -4.09647 1.000 52.73883 ? 24 ARG A CA 1 ATOM 440 C C . ARG A 1 24 ? -1.18838 -18.93081 -3.11796 1.000 56.11222 ? 24 ARG A C 1 ATOM 441 O O . ARG A 1 24 ? -2.31663 -19.34635 -2.83060 1.000 52.95476 ? 24 ARG A O 1 ATOM 442 C CB . ARG A 1 24 ? 0.82913 -20.37676 -3.32550 1.000 67.42071 ? 24 ARG A CB 1 ATOM 443 C CG . ARG A 1 24 ? 1.40814 -21.59143 -3.99962 1.000 67.99922 ? 24 ARG A CG 1 ATOM 444 C CD . ARG A 1 24 ? 2.01688 -22.57255 -3.00323 1.000 63.12027 ? 24 ARG A CD 1 ATOM 445 N NE . ARG A 1 24 ? 3.02896 -21.99357 -2.12145 1.000 56.01803 ? 24 ARG A NE 1 ATOM 446 C CZ . ARG A 1 24 ? 4.21393 -21.55209 -2.52472 1.000 64.55707 ? 24 ARG A CZ 1 ATOM 447 N NH1 . ARG A 1 24 ? 4.55111 -21.54877 -3.80302 1.000 54.88797 ? 24 ARG A NH1 1 ATOM 448 N NH2 . ARG A 1 24 ? 5.08343 -21.10950 -1.62116 1.000 62.91752 ? 24 ARG A NH2 1 ATOM 449 H H . ARG A 1 24 ? 1.09086 -18.73779 -5.12686 1.000 61.90076 ? 24 ARG A H 1 ATOM 450 H HA . ARG A 1 24 ? -0.82776 -20.37029 -4.54467 1.000 63.28659 ? 24 ARG A HA 1 ATOM 451 H HB2 . ARG A 1 24 ? 1.55022 -19.73935 -3.20445 1.000 80.90485 ? 24 ARG A HB2 1 ATOM 452 H HB3 . ARG A 1 24 ? 0.48661 -20.65801 -2.46267 1.000 80.90485 ? 24 ARG A HB3 1 ATOM 453 H HG2 . ARG A 1 24 ? 0.70519 -22.05158 -4.48442 1.000 81.59907 ? 24 ARG A HG2 1 ATOM 454 H HG3 . ARG A 1 24 ? 2.10621 -21.31257 -4.61268 1.000 81.59907 ? 24 ARG A HG3 1 ATOM 455 H HD2 . ARG A 1 24 ? 1.30765 -22.92406 -2.44257 1.000 75.74433 ? 24 ARG A HD2 1 ATOM 456 H HD3 . ARG A 1 24 ? 2.43773 -23.29368 -3.49695 1.000 75.74433 ? 24 ARG A HD3 1 ATOM 457 H HE . ARG A 1 24 ? 2.84381 -21.93497 -1.28366 1.000 67.22164 ? 24 ARG A HE 1 ATOM 458 H HH11 . ARG A 1 24 ? 3.99739 -21.83705 -4.39453 1.000 65.86557 ? 24 ARG A HH11 1 ATOM 459 H HH12 . ARG A 1 24 ? 5.32417 -21.25833 -4.04306 1.000 65.86557 ? 24 ARG A HH12 1 ATOM 460 H HH21 . ARG A 1 24 ? 4.87507 -21.11162 -0.78678 1.000 75.50103 ? 24 ARG A HH21 1 ATOM 461 H HH22 . ARG A 1 24 ? 5.85411 -20.82116 -1.87118 1.000 75.50103 ? 24 ARG A HH22 1 ATOM 462 N N . ILE A 1 25 ? -0.67150 -17.83549 -2.55462 1.000 47.00815 ? 25 ILE A N 1 ATOM 463 C CA . ILE A 1 25 ? -1.45688 -17.09176 -1.57597 1.000 53.93154 ? 25 ILE A CA 1 ATOM 464 C C . ILE A 1 25 ? -2.68627 -16.50094 -2.24723 1.000 49.20444 ? 25 ILE A C 1 ATOM 465 O O . ILE A 1 25 ? -3.77990 -16.48132 -1.66803 1.000 50.37679 ? 25 ILE A O 1 ATOM 466 C CB . ILE A 1 25 ? -0.59842 -16.00346 -0.90987 1.000 55.41676 ? 25 ILE A CB 1 ATOM 467 C CG1 . ILE A 1 25 ? 0.37568 -16.63060 0.08493 1.000 62.76578 ? 25 ILE A CG1 1 ATOM 468 C CG2 . ILE A 1 25 ? -1.47751 -14.97788 -0.20735 1.000 57.80221 ? 25 ILE A CG2 1 ATOM 469 C CD1 . ILE A 1 25 ? 1.59704 -15.77798 0.34627 1.000 70.29757 ? 25 ILE A CD1 1 ATOM 470 H H . ILE A 1 25 ? 0.10885 -17.51338 -2.71858 1.000 56.40978 ? 25 ILE A H 1 ATOM 471 H HA . ILE A 1 25 ? -1.74812 -17.70141 -0.87999 1.000 64.71784 ? 25 ILE A HA 1 ATOM 472 H HB . ILE A 1 25 ? -0.09215 -15.55299 -1.60390 1.000 66.50011 ? 25 ILE A HB 1 ATOM 473 H HG12 . ILE A 1 25 ? -0.08141 -16.76313 0.93016 1.000 75.31894 ? 25 ILE A HG12 1 ATOM 474 H HG13 . ILE A 1 25 ? 0.67715 -17.48298 -0.26642 1.000 75.31894 ? 25 ILE A HG13 1 ATOM 475 H HG21 . ILE A 1 25 ? -0.93960 -14.48679 0.43326 1.000 69.36265 ? 25 ILE A HG21 1 ATOM 476 H HG22 . ILE A 1 25 ? -1.84251 -14.36907 -0.86843 1.000 69.36265 ? 25 ILE A HG22 1 ATOM 477 H HG23 . ILE A 1 25 ? -2.19744 -15.43961 0.25027 1.000 69.36265 ? 25 ILE A HG23 1 ATOM 478 H HD11 . ILE A 1 25 ? 2.17402 -16.23746 0.97625 1.000 84.35708 ? 25 ILE A HD11 1 ATOM 479 H HD12 . ILE A 1 25 ? 2.06748 -15.63544 -0.48994 1.000 84.35708 ? 25 ILE A HD12 1 ATOM 480 H HD13 . ILE A 1 25 ? 1.31476 -14.92689 0.71624 1.000 84.35708 ? 25 ILE A HD13 1 ATOM 481 N N . SER A 1 26 ? -2.52327 -16.01125 -3.47557 1.000 48.87482 ? 26 SER A N 1 ATOM 482 C CA A SER A 1 26 ? -3.65049 -15.45090 -4.21704 0.817 52.73177 ? 26 SER A CA 1 ATOM 483 C CA B SER A 1 26 ? -3.66084 -15.44453 -4.18388 0.183 52.71352 ? 26 SER A CA 1 ATOM 484 C C . SER A 1 26 ? -4.73634 -16.49523 -4.43179 1.000 52.06290 ? 26 SER A C 1 ATOM 485 O O . SER A 1 26 ? -5.93074 -16.20506 -4.29772 1.000 50.88395 ? 26 SER A O 1 ATOM 486 C CB A SER A 1 26 ? -3.18366 -14.90870 -5.57106 0.817 49.31523 ? 26 SER A CB 1 ATOM 487 C CB B SER A 1 26 ? -3.20579 -14.82581 -5.49971 0.183 49.57611 ? 26 SER A CB 1 ATOM 488 O OG A SER A 1 26 ? -2.29838 -13.81582 -5.43308 0.817 47.01738 ? 26 SER A OG 1 ATOM 489 O OG B SER A 1 26 ? -4.33534 -14.49144 -6.27471 0.183 51.15963 ? 26 SER A OG 1 ATOM 490 H H A SER A 1 26 ? -1.77558 -15.99140 -3.90001 0.817 58.64979 ? 26 SER A H 1 ATOM 491 H H B SER A 1 26 ? -1.78070 -15.99658 -3.90913 0.183 58.64979 ? 26 SER A H 1 ATOM 492 H HA A SER A 1 26 ? -4.01823 -14.71498 -3.70314 0.817 63.27813 ? 26 SER A HA 1 ATOM 493 H HA B SER A 1 26 ? -4.04670 -14.74078 -3.63913 0.183 63.25623 ? 26 SER A HA 1 ATOM 494 H HB2 A SER A 1 26 ? -2.72752 -15.61892 -6.04900 0.817 59.17827 ? 26 SER A HB2 1 ATOM 495 H HB2 B SER A 1 26 ? -2.69205 -14.02352 -5.31719 0.183 59.49133 ? 26 SER A HB2 1 ATOM 496 H HB3 A SER A 1 26 ? -3.96075 -14.61693 -6.07295 0.817 59.17827 ? 26 SER A HB3 1 ATOM 497 H HB3 B SER A 1 26 ? -2.66105 -15.46546 -5.98449 0.183 59.49133 ? 26 SER A HB3 1 ATOM 498 H HG A SER A 1 26 ? -1.61588 -14.05137 -5.00378 0.817 56.42085 ? 26 SER A HG 1 ATOM 499 H HG B SER A 1 26 ? -4.99742 -14.35856 -5.77512 0.183 61.39156 ? 26 SER A HG 1 ATOM 500 N N . SER A 1 27 ? -4.33303 -17.71834 -4.79037 1.000 52.60859 ? 27 SER A N 1 ATOM 501 C CA A SER A 1 27 ? -5.29595 -18.79752 -4.97562 0.558 58.26671 ? 27 SER A CA 1 ATOM 502 C CA B SER A 1 27 ? -5.29832 -18.79454 -4.97747 0.442 58.25801 ? 27 SER A CA 1 ATOM 503 C C . SER A 1 27 ? -6.08387 -19.05220 -3.69800 1.000 57.19201 ? 27 SER A C 1 ATOM 504 O O . SER A 1 27 ? -7.31254 -19.18913 -3.72578 1.000 60.07076 ? 27 SER A O 1 ATOM 505 C CB A SER A 1 27 ? -4.57260 -20.07204 -5.41309 0.558 60.82480 ? 27 SER A CB 1 ATOM 506 C CB B SER A 1 27 ? -4.57803 -20.06671 -5.42616 0.442 60.83188 ? 27 SER A CB 1 ATOM 507 O OG A SER A 1 27 ? -5.49927 -21.09466 -5.72373 0.558 72.19516 ? 27 SER A OG 1 ATOM 508 O OG B SER A 1 27 ? -5.48956 -20.99404 -5.98272 0.442 71.87871 ? 27 SER A OG 1 ATOM 509 H H A SER A 1 27 ? -3.51504 -17.94387 -4.93042 0.558 63.13030 ? 27 SER A H 1 ATOM 510 H H B SER A 1 27 ? -3.51511 -17.94495 -4.92909 0.442 63.13030 ? 27 SER A H 1 ATOM 511 H HA A SER A 1 27 ? -5.91897 -18.54262 -5.67403 0.558 69.92005 ? 27 SER A HA 1 ATOM 512 H HA B SER A 1 27 ? -5.92444 -18.53678 -5.67205 0.442 69.90961 ? 27 SER A HA 1 ATOM 513 H HB2 A SER A 1 27 ? -4.04004 -19.87856 -6.20039 0.558 72.98977 ? 27 SER A HB2 1 ATOM 514 H HB2 B SER A 1 27 ? -3.91579 -19.83467 -6.09587 0.442 72.99826 ? 27 SER A HB2 1 ATOM 515 H HB3 A SER A 1 27 ? -3.99962 -20.37374 -4.69089 0.558 72.98977 ? 27 SER A HB3 1 ATOM 516 H HB3 B SER A 1 27 ? -4.14545 -20.47176 -4.65824 0.442 72.99826 ? 27 SER A HB3 1 ATOM 517 H HG A SER A 1 27 ? -5.09161 -21.78709 -5.96859 0.558 86.63419 ? 27 SER A HG 1 ATOM 518 H HG B SER A 1 27 ? -5.79194 -20.69922 -6.70884 0.442 86.25446 ? 27 SER A HG 1 ATOM 519 N N . GLN A 1 28 ? -5.38514 -19.12828 -2.56261 1.000 53.64491 ? 28 GLN A N 1 ATOM 520 C CA . GLN A 1 28 ? -6.04101 -19.45308 -1.30462 1.000 53.38893 ? 28 GLN A CA 1 ATOM 521 C C . GLN A 1 28 ? -7.07086 -18.40258 -0.92068 1.000 58.07370 ? 28 GLN A C 1 ATOM 522 O O . GLN A 1 28 ? -8.17258 -18.73762 -0.47438 1.000 59.65419 ? 28 GLN A O 1 ATOM 523 C CB . GLN A 1 28 ? -4.99653 -19.58940 -0.19794 1.000 54.06379 ? 28 GLN A CB 1 ATOM 524 C CG . GLN A 1 28 ? -4.11235 -20.81674 -0.34309 1.000 61.91716 ? 28 GLN A CG 1 ATOM 525 C CD . GLN A 1 28 ? -2.87367 -20.75471 0.53351 1.000 67.67674 ? 28 GLN A CD 1 ATOM 526 O OE1 . GLN A 1 28 ? -2.86962 -20.10197 1.57776 1.000 64.21541 ? 28 GLN A OE1 1 ATOM 527 N NE2 . GLN A 1 28 ? -1.81667 -21.44475 0.11383 1.000 65.12235 ? 28 GLN A NE2 1 ATOM 528 H H . GLN A 1 28 ? -4.53772 -18.99679 -2.49792 1.000 64.37389 ? 28 GLN A H 1 ATOM 529 H HA . GLN A 1 28 ? -6.50098 -20.30090 -1.40721 1.000 64.06672 ? 28 GLN A HA 1 ATOM 530 H HB2 . GLN A 1 28 ? -4.42302 -18.80723 -0.21168 1.000 64.87654 ? 28 GLN A HB2 1 ATOM 531 H HB3 . GLN A 1 28 ? -5.45251 -19.65149 0.65595 1.000 64.87654 ? 28 GLN A HB3 1 ATOM 532 H HG2 . GLN A 1 28 ? -4.61984 -21.60374 -0.09013 1.000 74.30060 ? 28 GLN A HG2 1 ATOM 533 H HG3 . GLN A 1 28 ? -3.82334 -20.89086 -1.26607 1.000 74.30060 ? 28 GLN A HG3 1 ATOM 534 H HE21 . GLN A 1 28 ? -1.85933 -21.89363 -0.61849 1.000 78.14682 ? 28 GLN A HE21 1 ATOM 535 H HE22 . GLN A 1 28 ? -1.09067 -21.44198 0.57482 1.000 78.14682 ? 28 GLN A HE22 1 ATOM 536 N N A LYS A 1 29 ? -6.72600 -17.12282 -1.07562 0.452 51.27096 ? 29 LYS A N 1 ATOM 537 N N B LYS A 1 29 ? -6.72555 -17.12342 -1.07449 0.548 51.20160 ? 29 LYS A N 1 ATOM 538 C CA A LYS A 1 29 ? -7.64006 -16.05854 -0.67282 0.452 57.81215 ? 29 LYS A CA 1 ATOM 539 C CA B LYS A 1 29 ? -7.64126 -16.05993 -0.67349 0.548 57.80683 ? 29 LYS A CA 1 ATOM 540 C C A LYS A 1 29 ? -8.78803 -15.90991 -1.66504 0.452 57.71654 ? 29 LYS A C 1 ATOM 541 C C B LYS A 1 29 ? -8.78969 -15.91659 -1.66549 0.548 57.73550 ? 29 LYS A C 1 ATOM 542 O O A LYS A 1 29 ? -9.94731 -15.74921 -1.26431 0.452 56.34410 ? 29 LYS A O 1 ATOM 543 O O B LYS A 1 29 ? -9.95144 -15.77247 -1.26523 0.548 56.29735 ? 29 LYS A O 1 ATOM 544 C CB A LYS A 1 29 ? -6.86738 -14.74624 -0.53012 0.452 59.49009 ? 29 LYS A CB 1 ATOM 545 C CB B LYS A 1 29 ? -6.86825 -14.74778 -0.53227 0.548 59.49087 ? 29 LYS A CB 1 ATOM 546 C CG A LYS A 1 29 ? -5.84838 -14.77161 0.60989 0.452 60.61367 ? 29 LYS A CG 1 ATOM 547 C CG B LYS A 1 29 ? -5.86614 -14.77396 0.62453 0.548 60.60515 ? 29 LYS A CG 1 ATOM 548 C CD A LYS A 1 29 ? -5.13087 -13.44002 0.77789 0.452 63.05930 ? 29 LYS A CD 1 ATOM 549 C CD B LYS A 1 29 ? -5.01348 -13.51348 0.69417 0.548 63.00161 ? 29 LYS A CD 1 ATOM 550 C CE A LYS A 1 29 ? -5.96895 -12.44840 1.56722 0.452 66.17146 ? 29 LYS A CE 1 ATOM 551 C CE B LYS A 1 29 ? -5.73946 -12.37602 1.39492 0.548 66.28130 ? 29 LYS A CE 1 ATOM 552 N NZ A LYS A 1 29 ? -5.55722 -11.04073 1.30163 0.452 65.04542 ? 29 LYS A NZ 1 ATOM 553 N NZ B LYS A 1 29 ? -6.16411 -12.73500 2.77736 0.548 69.03691 ? 29 LYS A NZ 1 ATOM 554 H H A LYS A 1 29 ? -5.98053 -16.84965 -1.40615 0.452 61.52515 ? 29 LYS A H 1 ATOM 555 H H B LYS A 1 29 ? -5.97928 -16.85005 -1.40305 0.548 61.44192 ? 29 LYS A H 1 ATOM 556 H HA A LYS A 1 29 ? -8.02494 -16.27766 0.19017 0.452 69.37458 ? 29 LYS A HA 1 ATOM 557 H HA B LYS A 1 29 ? -8.02734 -16.27612 0.18970 0.548 69.36820 ? 29 LYS A HA 1 ATOM 558 H HB2 A LYS A 1 29 ? -6.38847 -14.57199 -1.35546 0.452 71.38810 ? 29 LYS A HB2 1 ATOM 559 H HB2 B LYS A 1 29 ? -6.37699 -14.58081 -1.35184 0.548 71.38905 ? 29 LYS A HB2 1 ATOM 560 H HB3 A LYS A 1 29 ? -7.49593 -14.02887 -0.35347 0.452 71.38810 ? 29 LYS A HB3 1 ATOM 561 H HB3 B LYS A 1 29 ? -7.49660 -14.02697 -0.36941 0.548 71.38905 ? 29 LYS A HB3 1 ATOM 562 H HG2 A LYS A 1 29 ? -6.30629 -14.97351 1.44083 0.452 72.73641 ? 29 LYS A HG2 1 ATOM 563 H HG2 B LYS A 1 29 ? -6.35049 -14.85455 1.46108 0.548 72.72618 ? 29 LYS A HG2 1 ATOM 564 H HG3 A LYS A 1 29 ? -5.18160 -15.45137 0.42489 0.452 72.73641 ? 29 LYS A HG3 1 ATOM 565 H HG3 B LYS A 1 29 ? -5.27155 -15.53191 0.51109 0.548 72.72618 ? 29 LYS A HG3 1 ATOM 566 H HD2 A LYS A 1 29 ? -4.29816 -13.58213 1.25465 0.452 75.67117 ? 29 LYS A HD2 1 ATOM 567 H HD2 B LYS A 1 29 ? -4.20058 -13.70412 1.18788 0.548 75.60193 ? 29 LYS A HD2 1 ATOM 568 H HD3 A LYS A 1 29 ? -4.95193 -13.05942 -0.09619 0.452 75.67117 ? 29 LYS A HD3 1 ATOM 569 H HD3 B LYS A 1 29 ? -4.79509 -13.22496 -0.20581 0.548 75.60193 ? 29 LYS A HD3 1 ATOM 570 H HE2 A LYS A 1 29 ? -6.90067 -12.54504 1.31529 0.452 79.40575 ? 29 LYS A HE2 1 ATOM 571 H HE2 B LYS A 1 29 ? -5.14781 -11.60946 1.45170 0.548 79.53756 ? 29 LYS A HE2 1 ATOM 572 H HE3 A LYS A 1 29 ? -5.86190 -12.62244 2.51545 0.452 79.40575 ? 29 LYS A HE3 1 ATOM 573 H HE3 B LYS A 1 29 ? -6.53306 -12.14567 0.88695 0.548 79.53756 ? 29 LYS A HE3 1 ATOM 574 H HZ1 A LYS A 1 29 ? -5.62153 -10.86373 0.43178 0.452 78.05450 ? 29 LYS A HZ1 1 ATOM 575 H HZ1 B LYS A 1 29 ? -5.48580 -13.10727 3.21715 0.548 82.84429 ? 29 LYS A HZ1 1 ATOM 576 H HZ2 A LYS A 1 29 ? -6.08307 -10.48000 1.75014 0.452 78.05450 ? 29 LYS A HZ2 1 ATOM 577 H HZ2 B LYS A 1 29 ? -6.42604 -12.00533 3.21448 0.548 82.84429 ? 29 LYS A HZ2 1 ATOM 578 H HZ3 A LYS A 1 29 ? -4.71480 -10.91603 1.56025 0.452 78.05450 ? 29 LYS A HZ3 1 ATOM 579 H HZ3 B LYS A 1 29 ? -6.84074 -13.31241 2.74768 0.548 82.84429 ? 29 LYS A HZ3 1 ATOM 580 N N . ASN A 1 30 ? -8.48968 -15.98206 -2.96211 1.000 54.10741 ? 30 ASN A N 1 ATOM 581 C CA . ASN A 1 30 ? -9.53044 -15.80406 -3.96980 1.000 56.01383 ? 30 ASN A CA 1 ATOM 582 C C . ASN A 1 30 ? -10.59475 -16.89018 -3.86575 1.000 56.19145 ? 30 ASN A C 1 ATOM 583 O O . ASN A 1 30 ? -11.79269 -16.61245 -3.99782 1.000 57.45804 ? 30 ASN A O 1 ATOM 584 C CB . ASN A 1 30 ? -8.90765 -15.79911 -5.36550 1.000 50.98149 ? 30 ASN A CB 1 ATOM 585 C CG . ASN A 1 30 ? -8.11603 -14.53354 -5.65890 1.000 53.47783 ? 30 ASN A CG 1 ATOM 586 O OD1 . ASN A 1 30 ? -8.00345 -13.63518 -4.82050 1.000 50.02497 ? 30 ASN A OD1 1 ATOM 587 N ND2 . ASN A 1 30 ? -7.55873 -14.46086 -6.86171 1.000 50.06509 ? 30 ASN A ND2 1 ATOM 588 H H A ASN A 1 30 ? -7.70445 -16.13071 -3.27978 0.452 64.92890 ? 30 ASN A H 1 ATOM 589 H H B ASN A 1 30 ? -7.70354 -16.12614 -3.27963 0.548 64.92890 ? 30 ASN A H 1 ATOM 590 H HA . ASN A 1 30 ? -9.96162 -14.94719 -3.82568 1.000 67.21660 ? 30 ASN A HA 1 ATOM 591 H HB2 . ASN A 1 30 ? -8.30385 -16.55422 -5.44383 1.000 61.17779 ? 30 ASN A HB2 1 ATOM 592 H HB3 . ASN A 1 30 ? -9.61436 -15.86950 -6.02619 1.000 61.17779 ? 30 ASN A HB3 1 ATOM 593 H HD21 . ASN A 1 30 ? -7.09959 -13.76776 -7.08172 1.000 60.07811 ? 30 ASN A HD21 1 ATOM 594 H HD22 . ASN A 1 30 ? -7.65687 -15.10688 -7.42084 1.000 60.07811 ? 30 ASN A HD22 1 ATOM 595 N N . GLN A 1 31 ? -10.17759 -18.13755 -3.62608 1.000 55.83102 ? 31 GLN A N 1 ATOM 596 C CA . GLN A 1 31 ? -11.14110 -19.22192 -3.47630 1.000 56.35902 ? 31 GLN A CA 1 ATOM 597 C C . GLN A 1 31 ? -12.18509 -18.89003 -2.41902 1.000 63.50733 ? 31 GLN A C 1 ATOM 598 O O . GLN A 1 31 ? -13.38036 -19.14495 -2.60992 1.000 67.39195 ? 31 GLN A O 1 ATOM 599 C CB . GLN A 1 31 ? -10.40963 -20.51395 -3.11112 1.000 63.06563 ? 31 GLN A CB 1 ATOM 600 C CG . GLN A 1 31 ? -11.29801 -21.74608 -3.06969 1.000 83.28293 ? 31 GLN A CG 1 ATOM 601 C CD . GLN A 1 31 ? -10.58412 -22.98662 -3.56750 1.000 98.37242 ? 31 GLN A CD 1 ATOM 602 O OE1 . GLN A 1 31 ? -9.56330 -23.39508 -3.00949 1.000 93.24921 ? 31 GLN A OE1 1 ATOM 603 N NE2 . GLN A 1 31 ? -11.10676 -23.58333 -4.63375 1.000 113.30251 ? 31 GLN A NE2 1 ATOM 604 H H . GLN A 1 31 ? -9.35487 -18.37539 -3.54755 1.000 66.99723 ? 31 GLN A H 1 ATOM 605 H HA . GLN A 1 31 ? -11.59900 -19.35679 -4.32072 1.000 67.63082 ? 31 GLN A HA 1 ATOM 606 H HB2 . GLN A 1 31 ? -9.71613 -20.67394 -3.77017 1.000 75.67876 ? 31 GLN A HB2 1 ATOM 607 H HB3 . GLN A 1 31 ? -10.01371 -20.40766 -2.23201 1.000 75.67876 ? 31 GLN A HB3 1 ATOM 608 H HG2 . GLN A 1 31 ? -11.57790 -21.90553 -2.15474 1.000 99.93952 ? 31 GLN A HG2 1 ATOM 609 H HG3 . GLN A 1 31 ? -12.07374 -21.59773 -3.63285 1.000 99.93952 ? 31 GLN A HG3 1 ATOM 610 H HE21 . GLN A 1 31 ? -11.81375 -23.26182 -5.00308 1.000 135.96301 ? 31 GLN A HE21 1 ATOM 611 H HE22 . GLN A 1 31 ? -10.73799 -24.29098 -4.95443 1.000 135.96301 ? 31 GLN A HE22 1 ATOM 612 N N . GLN A 1 32 ? -11.75041 -18.32849 -1.28823 1.000 61.36952 ? 32 GLN A N 1 ATOM 613 C CA . GLN A 1 32 ? -12.68791 -17.99796 -0.22423 1.000 65.28838 ? 32 GLN A CA 1 ATOM 614 C C . GLN A 1 32 ? -13.64989 -16.89583 -0.64452 1.000 69.30597 ? 32 GLN A C 1 ATOM 615 O O . GLN A 1 32 ? -14.79926 -16.87079 -0.18317 1.000 70.48215 ? 32 GLN A O 1 ATOM 616 C CB . GLN A 1 32 ? -11.93380 -17.56402 1.03107 1.000 75.68673 ? 32 GLN A CB 1 ATOM 617 C CG . GLN A 1 32 ? -11.04802 -18.62392 1.62663 1.000 73.09702 ? 32 GLN A CG 1 ATOM 618 C CD . GLN A 1 32 ? -10.38456 -18.15111 2.89968 1.000 61.84111 ? 32 GLN A CD 1 ATOM 619 O OE1 . GLN A 1 32 ? -11.01041 -18.10090 3.95626 1.000 70.57676 ? 32 GLN A OE1 1 ATOM 620 N NE2 . GLN A 1 32 ? -9.12050 -17.76325 2.79669 1.000 76.68651 ? 32 GLN A NE2 1 ATOM 621 H H . GLN A 1 32 ? -10.93036 -18.13312 -1.11808 1.000 73.64342 ? 32 GLN A H 1 ATOM 622 H HA . GLN A 1 32 ? -13.20151 -18.79357 -0.01420 1.000 78.34605 ? 32 GLN A HA 1 ATOM 623 H HB2 . GLN A 1 32 ? -11.37236 -16.80541 0.80702 1.000 90.82408 ? 32 GLN A HB2 1 ATOM 624 H HB3 . GLN A 1 32 ? -12.58095 -17.30955 1.70734 1.000 90.82408 ? 32 GLN A HB3 1 ATOM 625 H HG2 . GLN A 1 32 ? -11.58167 -19.40677 1.83465 1.000 87.71642 ? 32 GLN A HG2 1 ATOM 626 H HG3 . GLN A 1 32 ? -10.35379 -18.85528 0.98991 1.000 87.71642 ? 32 GLN A HG3 1 ATOM 627 H HE21 . GLN A 1 32 ? -8.72340 -17.78951 2.03431 1.000 92.02382 ? 32 GLN A HE21 1 ATOM 628 H HE22 . GLN A 1 32 ? -8.69791 -17.48548 3.49229 1.000 92.02382 ? 32 GLN A HE22 1 ATOM 629 N N . ALA A 1 33 ? -13.19612 -15.97839 -1.49865 1.000 67.60538 ? 33 ALA A N 1 ATOM 630 C CA . ALA A 1 33 ? -13.98257 -14.82921 -1.91762 1.000 67.88684 ? 33 ALA A CA 1 ATOM 631 C C . ALA A 1 33 ? -14.75477 -15.08006 -3.20479 1.000 72.57110 ? 33 ALA A C 1 ATOM 632 O O . ALA A 1 33 ? -15.38162 -14.15179 -3.72871 1.000 72.19605 ? 33 ALA A O 1 ATOM 633 C CB . ALA A 1 33 ? -13.07328 -13.61081 -2.09538 1.000 65.17591 ? 33 ALA A CB 1 ATOM 634 H H . ALA A 1 33 ? -12.41438 -16.00444 -1.85615 1.000 81.12646 ? 33 ALA A H 1 ATOM 635 H HA . ALA A 1 33 ? -14.62572 -14.62805 -1.21992 1.000 81.46420 ? 33 ALA A HA 1 ATOM 636 H HB1 . ALA A 1 33 ? -13.61057 -12.85437 -2.37827 1.000 78.21110 ? 33 ALA A HB1 1 ATOM 637 H HB2 . ALA A 1 33 ? -12.64216 -13.41239 -1.24941 1.000 78.21110 ? 33 ALA A HB2 1 ATOM 638 H HB3 . ALA A 1 33 ? -12.40431 -13.81154 -2.76850 1.000 78.21110 ? 33 ALA A HB3 1 ATOM 639 N N A ASN A 1 34 ? -14.73555 -16.30838 -3.71959 0.457 67.35630 ? 34 ASN A N 1 ATOM 640 N N B ASN A 1 34 ? -14.72717 -16.30739 -3.72194 0.543 67.34387 ? 34 ASN A N 1 ATOM 641 C CA A ASN A 1 34 ? -15.38979 -16.62802 -4.98611 0.457 66.94567 ? 34 ASN A CA 1 ATOM 642 C CA B ASN A 1 34 ? -15.38395 -16.63066 -4.98521 0.543 66.93190 ? 34 ASN A CA 1 ATOM 643 C C A ASN A 1 34 ? -14.90364 -15.69065 -6.08712 0.457 66.42149 ? 34 ASN A C 1 ATOM 644 C C B ASN A 1 34 ? -14.90359 -15.69001 -6.08483 0.543 66.41341 ? 34 ASN A C 1 ATOM 645 O O A ASN A 1 34 ? -15.68742 -15.16014 -6.87703 0.457 67.82356 ? 34 ASN A O 1 ATOM 646 O O B ASN A 1 34 ? -15.69109 -15.15492 -6.86804 0.543 67.83596 ? 34 ASN A O 1 ATOM 647 C CB A ASN A 1 34 ? -16.91240 -16.57049 -4.85182 0.457 70.34336 ? 34 ASN A CB 1 ATOM 648 C CB B ASN A 1 34 ? -16.90508 -16.58168 -4.84224 0.543 70.33588 ? 34 ASN A CB 1 ATOM 649 C CG A ASN A 1 34 ? -17.46737 -17.69546 -3.99818 0.457 73.74833 ? 34 ASN A CG 1 ATOM 650 C CG B ASN A 1 34 ? -17.61759 -17.38648 -5.91473 0.543 74.53110 ? 34 ASN A CG 1 ATOM 651 O OD1 A ASN A 1 34 ? -16.97655 -18.82352 -4.04021 0.457 76.11103 ? 34 ASN A OD1 1 ATOM 652 O OD1 B ASN A 1 34 ? -17.07397 -18.35632 -6.44279 0.543 76.65047 ? 34 ASN A OD1 1 ATOM 653 N ND2 A ASN A 1 34 ? -18.50152 -17.39396 -3.22278 0.457 77.58800 ? 34 ASN A ND2 1 ATOM 654 N ND2 B ASN A 1 34 ? -18.84308 -16.98756 -6.23937 0.543 75.61426 ? 34 ASN A ND2 1 ATOM 655 H H A ASN A 1 34 ? -14.34611 -16.98033 -3.35024 0.457 80.82755 ? 34 ASN A H 1 ATOM 656 H H B ASN A 1 34 ? -14.33012 -16.97650 -3.35554 0.543 80.81265 ? 34 ASN A H 1 ATOM 657 H HA A ASN A 1 34 ? -15.15305 -17.53453 -5.23730 0.457 80.33480 ? 34 ASN A HA 1 ATOM 658 H HA B ASN A 1 34 ? -15.14616 -17.53566 -5.24083 0.543 80.31827 ? 34 ASN A HA 1 ATOM 659 H HB2 A ASN A 1 34 ? -17.16203 -15.72902 -4.43888 0.457 84.41204 ? 34 ASN A HB2 1 ATOM 660 H HB2 B ASN A 1 34 ? -17.15394 -16.94548 -3.97817 0.543 84.40306 ? 34 ASN A HB2 1 ATOM 661 H HB3 A ASN A 1 34 ? -17.31059 -16.63827 -5.73372 0.457 84.41204 ? 34 ASN A HB3 1 ATOM 662 H HB3 B ASN A 1 34 ? -17.20030 -15.66031 -4.91176 0.543 84.40306 ? 34 ASN A HB3 1 ATOM 663 H HD21 A ASN A 1 34 ? -18.85224 -17.99710 -2.71998 0.457 93.10560 ? 34 ASN A HD21 1 ATOM 664 H HD21 B ASN A 1 34 ? -19.28774 -17.41100 -6.84151 0.543 90.73711 ? 34 ASN A HD21 1 ATOM 665 H HD22 A ASN A 1 34 ? -18.82089 -16.59546 -3.22318 0.457 93.10560 ? 34 ASN A HD22 1 ATOM 666 H HD22 B ASN A 1 34 ? -19.19141 -16.30598 -5.84731 0.543 90.73711 ? 34 ASN A HD22 1 ATOM 667 N N . VAL A 1 35 ? -13.59162 -15.47317 -6.12177 1.000 59.57859 ? 35 VAL A N 1 ATOM 668 C CA . VAL A 1 35 ? -12.93388 -14.66947 -7.14229 1.000 60.26795 ? 35 VAL A CA 1 ATOM 669 C C . VAL A 1 35 ? -12.11935 -15.61257 -8.01514 1.000 54.32734 ? 35 VAL A C 1 ATOM 670 O O . VAL A 1 35 ? -11.55809 -16.59549 -7.52211 1.000 54.38212 ? 35 VAL A O 1 ATOM 671 C CB . VAL A 1 35 ? -12.04320 -13.58944 -6.49781 1.000 52.83581 ? 35 VAL A CB 1 ATOM 672 C CG1 . VAL A 1 35 ? -11.08006 -13.00467 -7.50984 1.000 52.76341 ? 35 VAL A CG1 1 ATOM 673 C CG2 . VAL A 1 35 ? -12.91102 -12.50543 -5.85322 1.000 61.29064 ? 35 VAL A CG2 1 ATOM 674 H H A VAL A 1 35 ? -13.04328 -15.79379 -5.54200 0.457 71.49430 ? 35 VAL A H 1 ATOM 675 H H B VAL A 1 35 ? -13.04267 -15.79458 -5.54302 0.543 71.49430 ? 35 VAL A H 1 ATOM 676 H HA . VAL A 1 35 ? -13.59056 -14.22323 -7.69955 1.000 72.32154 ? 35 VAL A HA 1 ATOM 677 H HB . VAL A 1 35 ? -11.50696 -13.99580 -5.79908 1.000 63.40297 ? 35 VAL A HB 1 ATOM 678 H HG11 . VAL A 1 35 ? -10.73888 -12.16225 -7.17098 1.000 63.31609 ? 35 VAL A HG11 1 ATOM 679 H HG12 . VAL A 1 35 ? -10.34859 -13.62704 -7.64593 1.000 63.31609 ? 35 VAL A HG12 1 ATOM 680 H HG13 . VAL A 1 35 ? -11.55021 -12.85893 -8.34567 1.000 63.31609 ? 35 VAL A HG13 1 ATOM 681 H HG21 . VAL A 1 35 ? -12.33457 -11.82763 -5.46696 1.000 73.54877 ? 35 VAL A HG21 1 ATOM 682 H HG22 . VAL A 1 35 ? -13.47806 -12.10909 -6.53313 1.000 73.54877 ? 35 VAL A HG22 1 ATOM 683 H HG23 . VAL A 1 35 ? -13.45747 -12.90872 -5.16066 1.000 73.54877 ? 35 VAL A HG23 1 ATOM 684 N N . THR A 1 36 ? -12.07850 -15.33608 -9.31524 1.000 52.86640 ? 36 THR A N 1 ATOM 685 C CA . THR A 1 36 ? -11.28893 -16.13212 -10.24219 1.000 48.22616 ? 36 THR A CA 1 ATOM 686 C C . THR A 1 36 ? -10.46175 -15.18996 -11.10192 1.000 53.64698 ? 36 THR A C 1 ATOM 687 O O . THR A 1 36 ? -10.72976 -13.98811 -11.17139 1.000 53.38122 ? 36 THR A O 1 ATOM 688 C CB . THR A 1 36 ? -12.16058 -17.01797 -11.14002 1.000 55.17175 ? 36 THR A CB 1 ATOM 689 O OG1 . THR A 1 36 ? -13.15293 -16.21796 -11.79865 1.000 57.01649 ? 36 THR A OG1 1 ATOM 690 C CG2 . THR A 1 36 ? -12.83910 -18.09539 -10.33353 1.000 60.67250 ? 36 THR A CG2 1 ATOM 691 H H . THR A 1 36 ? -12.50403 -14.68655 -9.68487 1.000 63.43968 ? 36 THR A H 1 ATOM 692 H HA . THR A 1 36 ? -10.69765 -16.71628 -9.74213 1.000 57.87139 ? 36 THR A HA 1 ATOM 693 H HB . THR A 1 36 ? -11.59946 -17.44553 -11.80578 1.000 66.20610 ? 36 THR A HB 1 ATOM 694 H HG1 . THR A 1 36 ? -12.86253 -15.95390 -12.54131 1.000 68.41978 ? 36 THR A HG1 1 ATOM 695 H HG21 . THR A 1 36 ? -13.38664 -18.64822 -10.91273 1.000 72.80700 ? 36 THR A HG21 1 ATOM 696 H HG22 . THR A 1 36 ? -12.17460 -18.65426 -9.90108 1.000 72.80700 ? 36 THR A HG22 1 ATOM 697 H HG23 . THR A 1 36 ? -13.40411 -17.69517 -9.65420 1.000 72.80700 ? 36 THR A HG23 1 ATOM 698 N N . GLY A 1 37 ? -9.45137 -15.73537 -11.76531 1.000 49.64122 ? 37 GLY A N 1 ATOM 699 C CA . GLY A 1 37 ? -8.63250 -14.90107 -12.61856 1.000 53.89017 ? 37 GLY A CA 1 ATOM 700 C C . GLY A 1 37 ? -7.33816 -15.58219 -13.01660 1.000 53.92793 ? 37 GLY A C 1 ATOM 701 O O . GLY A 1 37 ? -7.12545 -16.77194 -12.77371 1.000 50.73448 ? 37 GLY A O 1 ATOM 702 H H . GLY A 1 37 ? -9.22768 -16.56527 -11.73683 1.000 59.56946 ? 37 GLY A H 1 ATOM 703 H HA2 . GLY A 1 37 ? -9.12486 -14.68476 -13.42583 1.000 64.66821 ? 37 GLY A HA2 1 ATOM 704 H HA3 . GLY A 1 37 ? -8.41441 -14.07916 -12.15187 1.000 64.66821 ? 37 GLY A HA3 1 ATOM 705 N N . VAL A 1 38 ? -6.47394 -14.77920 -13.63228 1.000 51.03041 ? 38 VAL A N 1 ATOM 706 C CA A VAL A 1 38 ? -5.20481 -15.25371 -14.16034 0.767 49.05475 ? 38 VAL A CA 1 ATOM 707 C CA B VAL A 1 38 ? -5.20916 -15.24018 -14.18968 0.233 49.36237 ? 38 VAL A CA 1 ATOM 708 C C . VAL A 1 38 ? -4.15186 -14.17903 -13.92484 1.000 53.16140 ? 38 VAL A C 1 ATOM 709 O O . VAL A 1 38 ? -4.44105 -12.97954 -13.94352 1.000 48.75080 ? 38 VAL A O 1 ATOM 710 C CB A VAL A 1 38 ? -5.34626 -15.61601 -15.65773 0.767 55.67185 ? 38 VAL A CB 1 ATOM 711 C CB B VAL A 1 38 ? -5.32056 -15.52477 -15.70242 0.233 55.78758 ? 38 VAL A CB 1 ATOM 712 C CG1 A VAL A 1 38 ? -5.52511 -14.36053 -16.49284 0.767 53.89402 ? 38 VAL A CG1 1 ATOM 713 C CG1 B VAL A 1 38 ? -4.00018 -16.04968 -16.24856 0.233 59.30292 ? 38 VAL A CG1 1 ATOM 714 C CG2 A VAL A 1 38 ? -4.16249 -16.43281 -16.12604 0.767 58.99842 ? 38 VAL A CG2 1 ATOM 715 C CG2 B VAL A 1 38 ? -6.44473 -16.50204 -15.97250 0.233 58.43931 ? 38 VAL A CG2 1 ATOM 716 H H A VAL A 1 38 ? -6.60593 -13.93864 -13.75729 0.767 61.23650 ? 38 VAL A H 1 ATOM 717 H H B VAL A 1 38 ? -6.60383 -13.93620 -13.74215 0.233 61.23650 ? 38 VAL A H 1 ATOM 718 H HA A VAL A 1 38 ? -4.90711 -16.04572 -13.68600 0.767 58.86570 ? 38 VAL A HA 1 ATOM 719 H HA B VAL A 1 38 ? -4.94578 -16.06005 -13.74319 0.233 59.23485 ? 38 VAL A HA 1 ATOM 720 H HB A VAL A 1 38 ? -6.13833 -16.16289 -15.77796 0.767 66.80623 ? 38 VAL A HB 1 ATOM 721 H HB B VAL A 1 38 ? -5.52374 -14.69680 -16.16513 0.233 66.94509 ? 38 VAL A HB 1 ATOM 722 H HG11 A VAL A 1 38 ? -5.83900 -14.61069 -17.37590 0.767 64.67282 ? 38 VAL A HG11 1 ATOM 723 H HG11 B VAL A 1 38 ? -4.13033 -16.33922 -17.16515 0.233 71.16350 ? 38 VAL A HG11 1 ATOM 724 H HG12 A VAL A 1 38 ? -6.17543 -13.78435 -16.06156 0.767 64.67282 ? 38 VAL A HG12 1 ATOM 725 H HG12 B VAL A 1 38 ? -3.34046 -15.33929 -16.21659 0.233 71.16350 ? 38 VAL A HG12 1 ATOM 726 H HG13 A VAL A 1 38 ? -4.67249 -13.90321 -16.56212 0.767 64.67282 ? 38 VAL A HG13 1 ATOM 727 H HG13 B VAL A 1 38 ? -3.70798 -16.79722 -15.70386 0.233 71.16350 ? 38 VAL A HG13 1 ATOM 728 H HG21 A VAL A 1 38 ? -4.28159 -16.65291 -17.06320 0.767 70.79811 ? 38 VAL A HG21 1 ATOM 729 H HG21 B VAL A 1 38 ? -6.23256 -17.01557 -16.76760 0.233 70.12717 ? 38 VAL A HG21 1 ATOM 730 H HG22 A VAL A 1 38 ? -3.35294 -15.91143 -16.00900 0.767 70.79811 ? 38 VAL A HG22 1 ATOM 731 H HG22 B VAL A 1 38 ? -6.53742 -17.09518 -15.21060 0.233 70.12717 ? 38 VAL A HG22 1 ATOM 732 H HG23 A VAL A 1 38 ? -4.11146 -17.24569 -15.59924 0.767 70.79811 ? 38 VAL A HG23 1 ATOM 733 H HG23 B VAL A 1 38 ? -7.26775 -16.00697 -16.10834 0.233 70.12717 ? 38 VAL A HG23 1 ATOM 734 N N . LEU A 1 39 ? -2.92404 -14.62701 -13.67255 1.000 48.06106 ? 39 LEU A N 1 ATOM 735 C CA . LEU A 1 39 ? -1.78664 -13.75323 -13.41508 1.000 44.51960 ? 39 LEU A CA 1 ATOM 736 C C . LEU A 1 39 ? -0.65872 -14.17660 -14.34061 1.000 49.72612 ? 39 LEU A C 1 ATOM 737 O O . LEU A 1 39 ? -0.20527 -15.32178 -14.28180 1.000 49.27648 ? 39 LEU A O 1 ATOM 738 C CB . LEU A 1 39 ? -1.34726 -13.83700 -11.95225 1.000 45.45694 ? 39 LEU A CB 1 ATOM 739 C CG . LEU A 1 39 ? -0.09429 -13.05722 -11.55256 1.000 53.40917 ? 39 LEU A CG 1 ATOM 740 C CD1 . LEU A 1 39 ? -0.28353 -11.57989 -11.84202 1.000 49.43660 ? 39 LEU A CD1 1 ATOM 741 C CD2 . LEU A 1 39 ? 0.25204 -13.28611 -10.07729 1.000 60.54054 ? 39 LEU A CD2 1 ATOM 742 H H . LEU A 1 39 ? -2.72000 -15.46199 -13.64465 1.000 57.67327 ? 39 LEU A H 1 ATOM 743 H HA . LEU A 1 39 ? -2.02195 -12.83169 -13.60558 1.000 53.42352 ? 39 LEU A HA 1 ATOM 744 H HB2 . LEU A 1 39 ? -2.07414 -13.50301 -11.40362 1.000 54.54833 ? 39 LEU A HB2 1 ATOM 745 H HB3 . LEU A 1 39 ? -1.17696 -14.76931 -11.74562 1.000 54.54833 ? 39 LEU A HB3 1 ATOM 746 H HG . LEU A 1 39 ? 0.65645 -13.37664 -12.07721 1.000 64.09100 ? 39 LEU A HG 1 ATOM 747 H HD11 . LEU A 1 39 ? 0.49583 -11.09444 -11.52924 1.000 59.32392 ? 39 LEU A HD11 1 ATOM 748 H HD12 . LEU A 1 39 ? -0.38834 -11.45637 -12.79840 1.000 59.32392 ? 39 LEU A HD12 1 ATOM 749 H HD13 . LEU A 1 39 ? -1.07625 -11.26641 -11.37917 1.000 59.32392 ? 39 LEU A HD13 1 ATOM 750 H HD21 . LEU A 1 39 ? 1.04723 -12.77624 -9.85680 1.000 72.64865 ? 39 LEU A HD21 1 ATOM 751 H HD22 . LEU A 1 39 ? -0.49207 -12.99204 -9.52891 1.000 72.64865 ? 39 LEU A HD22 1 ATOM 752 H HD23 . LEU A 1 39 ? 0.41507 -14.23154 -9.93417 1.000 72.64865 ? 39 LEU A HD23 1 ATOM 753 N N . LEU A 1 40 ? -0.21761 -13.26976 -15.20333 1.000 49.39918 ? 40 LEU A N 1 ATOM 754 C CA . LEU A 1 40 ? 0.87875 -13.54445 -16.11757 1.000 47.43542 ? 40 LEU A CA 1 ATOM 755 C C . LEU A 1 40 ? 2.03219 -12.60983 -15.80470 1.000 50.66639 ? 40 LEU A C 1 ATOM 756 O O . LEU A 1 40 ? 1.82862 -11.47648 -15.36609 1.000 49.92561 ? 40 LEU A O 1 ATOM 757 C CB . LEU A 1 40 ? 0.45477 -13.35921 -17.57246 1.000 54.14824 ? 40 LEU A CB 1 ATOM 758 C CG . LEU A 1 40 ? -0.65868 -14.29678 -18.01561 1.000 66.95986 ? 40 LEU A CG 1 ATOM 759 C CD1 . LEU A 1 40 ? -1.87991 -13.49801 -18.30986 1.000 69.45158 ? 40 LEU A CD1 1 ATOM 760 C CD2 . LEU A 1 40 ? -0.22472 -15.05194 -19.25156 1.000 69.91125 ? 40 LEU A CD2 1 ATOM 761 H H . LEU A 1 40 ? -0.54326 -12.47728 -15.27759 1.000 59.27902 ? 40 LEU A H 1 ATOM 762 H HA . LEU A 1 40 ? 1.17486 -14.46146 -16.00659 1.000 56.92251 ? 40 LEU A HA 1 ATOM 763 H HB2 . LEU A 1 40 ? 0.14006 -12.44933 -17.69062 1.000 64.97789 ? 40 LEU A HB2 1 ATOM 764 H HB3 . LEU A 1 40 ? 1.22262 -13.52135 -18.14258 1.000 64.97789 ? 40 LEU A HB3 1 ATOM 765 H HG . LEU A 1 40 ? -0.85866 -14.93751 -17.31534 1.000 80.35183 ? 40 LEU A HG 1 ATOM 766 H HD11 . LEU A 1 40 ? -2.59164 -14.09804 -18.58244 1.000 83.34189 ? 40 LEU A HD11 1 ATOM 767 H HD12 . LEU A 1 40 ? -2.14203 -13.01564 -17.51017 1.000 83.34189 ? 40 LEU A HD12 1 ATOM 768 H HD13 . LEU A 1 40 ? -1.68327 -12.87200 -19.02424 1.000 83.34189 ? 40 LEU A HD13 1 ATOM 769 H HD21 . LEU A 1 40 ? -0.93922 -15.64867 -19.52416 1.000 83.89350 ? 40 LEU A HD21 1 ATOM 770 H HD22 . LEU A 1 40 ? -0.03605 -14.41660 -19.95983 1.000 83.89350 ? 40 LEU A HD22 1 ATOM 771 H HD23 . LEU A 1 40 ? 0.57300 -15.56371 -19.04511 1.000 83.89350 ? 40 LEU A HD23 1 ATOM 772 N N . CYS A 1 41 ? 3.24806 -13.08315 -16.02483 1.000 47.90482 ? 41 CYS A N 1 ATOM 773 C CA . CYS A 1 41 ? 4.38828 -12.18811 -15.97330 1.000 51.87651 ? 41 CYS A CA 1 ATOM 774 C C . CYS A 1 41 ? 5.27534 -12.42199 -17.18537 1.000 52.45584 ? 41 CYS A C 1 ATOM 775 O O . CYS A 1 41 ? 5.35495 -13.52270 -17.73737 1.000 54.55492 ? 41 CYS A O 1 ATOM 776 C CB . CYS A 1 41 ? 5.18457 -12.33648 -14.67843 1.000 55.46250 ? 41 CYS A CB 1 ATOM 777 S SG . CYS A 1 41 ? 6.03166 -13.87736 -14.47486 1.000 61.43480 ? 41 CYS A SG 1 ATOM 778 H H . CYS A 1 41 ? 3.43312 -13.90397 -16.20260 1.000 57.48578 ? 41 CYS A H 1 ATOM 779 H HA . CYS A 1 41 ? 4.07757 -11.26988 -16.00802 1.000 62.25181 ? 41 CYS A HA 1 ATOM 780 H HB2 . CYS A 1 41 ? 5.85276 -11.63392 -14.64949 1.000 66.55500 ? 41 CYS A HB2 1 ATOM 781 H HB3 . CYS A 1 41 ? 4.57235 -12.24301 -13.93187 1.000 66.55500 ? 41 CYS A HB3 1 ATOM 782 H HG . CYS A 1 41 ? 6.61489 -13.86699 -13.42618 1.000 73.72176 ? 41 CYS A HG 1 ATOM 783 N N . LEU A 1 42 ? 5.91718 -11.34463 -17.60634 1.000 51.07637 ? 42 LEU A N 1 ATOM 784 C CA . LEU A 1 42 ? 6.78810 -11.38686 -18.77283 1.000 54.39616 ? 42 LEU A CA 1 ATOM 785 C C . LEU A 1 42 ? 7.78461 -10.25617 -18.62466 1.000 55.81087 ? 42 LEU A C 1 ATOM 786 O O . LEU A 1 42 ? 7.38517 -9.08497 -18.59962 1.000 53.82168 ? 42 LEU A O 1 ATOM 787 C CB . LEU A 1 42 ? 5.97849 -11.24351 -20.06216 1.000 53.43562 ? 42 LEU A CB 1 ATOM 788 C CG . LEU A 1 42 ? 6.76505 -11.33540 -21.37115 1.000 61.05810 ? 42 LEU A CG 1 ATOM 789 C CD1 . LEU A 1 42 ? 7.47275 -12.67871 -21.51356 1.000 68.57194 ? 42 LEU A CD1 1 ATOM 790 C CD2 . LEU A 1 42 ? 5.82516 -11.08831 -22.53941 1.000 64.91075 ? 42 LEU A CD2 1 ATOM 791 H H . LEU A 1 42 ? 5.86621 -10.57154 -17.23308 1.000 61.29164 ? 42 LEU A H 1 ATOM 792 H HA . LEU A 1 42 ? 7.26459 -12.23084 -18.81221 1.000 65.27539 ? 42 LEU A HA 1 ATOM 793 H HB2 . LEU A 1 42 ? 5.31209 -11.94816 -20.07914 1.000 64.12275 ? 42 LEU A HB2 1 ATOM 794 H HB3 . LEU A 1 42 ? 5.54410 -10.37630 -20.05007 1.000 64.12275 ? 42 LEU A HB3 1 ATOM 795 H HG . LEU A 1 42 ? 7.45924 -10.65790 -21.37337 1.000 73.26972 ? 42 LEU A HG 1 ATOM 796 H HD11 . LEU A 1 42 ? 7.87241 -12.73314 -22.39572 1.000 82.28633 ? 42 LEU A HD11 1 ATOM 797 H HD12 . LEU A 1 42 ? 8.16130 -12.74654 -20.83371 1.000 82.28633 ? 42 LEU A HD12 1 ATOM 798 H HD13 . LEU A 1 42 ? 6.82420 -13.39097 -21.39972 1.000 82.28633 ? 42 LEU A HD13 1 ATOM 799 H HD21 . LEU A 1 42 ? 6.32533 -11.15889 -23.36751 1.000 77.89290 ? 42 LEU A HD21 1 ATOM 800 H HD22 . LEU A 1 42 ? 5.11850 -11.75256 -22.52216 1.000 77.89290 ? 42 LEU A HD22 1 ATOM 801 H HD23 . LEU A 1 42 ? 5.44570 -10.19944 -22.45691 1.000 77.89290 ? 42 LEU A HD23 1 ATOM 802 N N . ASP A 1 43 ? 9.06020 -10.59881 -18.50938 1.000 59.33438 ? 43 ASP A N 1 ATOM 803 C CA . ASP A 1 43 ? 10.15309 -9.63572 -18.51047 1.000 67.44787 ? 43 ASP A CA 1 ATOM 804 C C . ASP A 1 43 ? 9.83341 -8.41977 -17.64090 1.000 67.23757 ? 43 ASP A C 1 ATOM 805 O O . ASP A 1 43 ? 9.85661 -7.27441 -18.08521 1.000 63.37643 ? 43 ASP A O 1 ATOM 806 C CB . ASP A 1 43 ? 10.48431 -9.18772 -19.93275 1.000 76.08991 ? 43 ASP A CB 1 ATOM 807 C CG . ASP A 1 43 ? 11.80979 -8.45817 -20.01288 1.000 86.87381 ? 43 ASP A CG 1 ATOM 808 O OD1 . ASP A 1 43 ? 12.75167 -8.86508 -19.29896 1.000 79.90481 ? 43 ASP A OD1 1 ATOM 809 O OD2 . ASP A 1 43 ? 11.90506 -7.46444 -20.76403 1.000 78.50756 ? 43 ASP A OD2 1 ATOM 810 H H . ASP A 1 43 ? 9.32765 -11.41193 -18.42631 1.000 71.20126 ? 43 ASP A H 1 ATOM 811 H HA . ASP A 1 43 ? 10.92729 -10.07815 -18.12868 1.000 80.93744 ? 43 ASP A HA 1 ATOM 812 H HB2 . ASP A 1 43 ? 10.53372 -9.96720 -20.50796 1.000 91.30790 ? 43 ASP A HB2 1 ATOM 813 H HB3 . ASP A 1 43 ? 9.79005 -8.58734 -20.24651 1.000 91.30790 ? 43 ASP A HB3 1 ATOM 814 N N . GLY A 1 44 ? 9.51903 -8.69944 -16.37933 1.000 58.21218 ? 44 GLY A N 1 ATOM 815 C CA . GLY A 1 44 ? 9.36371 -7.64382 -15.39576 1.000 59.43987 ? 44 GLY A CA 1 ATOM 816 C C . GLY A 1 44 ? 8.03693 -6.92956 -15.41754 1.000 54.19757 ? 44 GLY A C 1 ATOM 817 O O . GLY A 1 44 ? 7.90234 -5.89137 -14.75444 1.000 52.83400 ? 44 GLY A O 1 ATOM 818 H H . GLY A 1 44 ? 9.39141 -9.49257 -16.07232 1.000 69.85462 ? 44 GLY A H 1 ATOM 819 H HA2 . GLY A 1 44 ? 9.47618 -8.02705 -14.51180 1.000 71.32784 ? 44 GLY A HA2 1 ATOM 820 H HA3 . GLY A 1 44 ? 10.05631 -6.98086 -15.54301 1.000 71.32784 ? 44 GLY A HA3 1 ATOM 821 N N . ILE A 1 45 ? 7.06120 -7.43922 -16.17500 1.000 53.61327 ? 45 ILE A N 1 ATOM 822 C CA . ILE A 1 45 ? 5.70872 -6.90259 -16.22838 1.000 49.56131 ? 45 ILE A CA 1 ATOM 823 C C . ILE A 1 45 ? 4.74384 -7.95544 -15.70716 1.000 49.56469 ? 45 ILE A C 1 ATOM 824 O O . ILE A 1 45 ? 4.84983 -9.13325 -16.05900 1.000 48.04395 ? 45 ILE A O 1 ATOM 825 C CB . ILE A 1 45 ? 5.30583 -6.48637 -17.66571 1.000 50.58297 ? 45 ILE A CB 1 ATOM 826 C CG1 . ILE A 1 45 ? 6.33805 -5.53162 -18.25671 1.000 54.02202 ? 45 ILE A CG1 1 ATOM 827 C CG2 . ILE A 1 45 ? 3.91074 -5.88385 -17.66742 1.000 52.81412 ? 45 ILE A CG2 1 ATOM 828 C CD1 . ILE A 1 45 ? 6.41930 -4.20598 -17.51434 1.000 64.82055 ? 45 ILE A CD1 1 ATOM 829 H H . ILE A 1 45 ? 7.16837 -8.12328 -16.68508 1.000 64.33593 ? 45 ILE A H 1 ATOM 830 H HA . ILE A 1 45 ? 5.66418 -6.12153 -15.65492 1.000 59.47358 ? 45 ILE A HA 1 ATOM 831 H HB . ILE A 1 45 ? 5.28806 -7.27686 -18.22759 1.000 60.69956 ? 45 ILE A HB 1 ATOM 832 H HG12 . ILE A 1 45 ? 7.21222 -5.95017 -18.21743 1.000 64.82642 ? 45 ILE A HG12 1 ATOM 833 H HG13 . ILE A 1 45 ? 6.10123 -5.34390 -19.17844 1.000 64.82642 ? 45 ILE A HG13 1 ATOM 834 H HG21 . ILE A 1 45 ? 3.74532 -5.47282 -18.53031 1.000 63.37694 ? 45 ILE A HG21 1 ATOM 835 H HG22 . ILE A 1 45 ? 3.26268 -6.58743 -17.50650 1.000 63.37694 ? 45 ILE A HG22 1 ATOM 836 H HG23 . ILE A 1 45 ? 3.85446 -5.21567 -16.96651 1.000 63.37694 ? 45 ILE A HG23 1 ATOM 837 H HD11 . ILE A 1 45 ? 7.07128 -3.63760 -17.95339 1.000 77.78466 ? 45 ILE A HD11 1 ATOM 838 H HD12 . ILE A 1 45 ? 5.54716 -3.78166 -17.52934 1.000 77.78466 ? 45 ILE A HD12 1 ATOM 839 H HD13 . ILE A 1 45 ? 6.69005 -4.37325 -16.59804 1.000 77.78466 ? 45 ILE A HD13 1 ATOM 840 N N . PHE A 1 46 ? 3.80979 -7.52706 -14.85909 1.000 45.25464 ? 46 PHE A N 1 ATOM 841 C CA . PHE A 1 46 ? 2.66814 -8.33688 -14.45913 1.000 45.48144 ? 46 PHE A CA 1 ATOM 842 C C . PHE A 1 46 ? 1.45726 -7.95176 -15.30426 1.000 44.26639 ? 46 PHE A C 1 ATOM 843 O O . PHE A 1 46 ? 1.23909 -6.77017 -15.58113 1.000 46.97241 ? 46 PHE A O 1 ATOM 844 C CB . PHE A 1 46 ? 2.30284 -8.11760 -12.98778 1.000 43.76415 ? 46 PHE A CB 1 ATOM 845 C CG . PHE A 1 46 ? 3.18930 -8.82474 -11.99656 1.000 49.27784 ? 46 PHE A CG 1 ATOM 846 C CD1 . PHE A 1 46 ? 3.28642 -10.20459 -11.97464 1.000 51.49205 ? 46 PHE A CD1 1 ATOM 847 C CD2 . PHE A 1 46 ? 3.88046 -8.09354 -11.04580 1.000 46.87474 ? 46 PHE A CD2 1 ATOM 848 C CE1 . PHE A 1 46 ? 4.08001 -10.84088 -11.03318 1.000 50.51202 ? 46 PHE A CE1 1 ATOM 849 C CE2 . PHE A 1 46 ? 4.67297 -8.72105 -10.10061 1.000 54.15073 ? 46 PHE A CE2 1 ATOM 850 C CZ . PHE A 1 46 ? 4.77353 -10.09626 -10.09628 1.000 52.24020 ? 46 PHE A CZ 1 ATOM 851 H H . PHE A 1 46 ? 3.81877 -6.74863 -14.49362 1.000 54.30557 ? 46 PHE A H 1 ATOM 852 H HA . PHE A 1 46 ? 2.89105 -9.27194 -14.58905 1.000 54.57772 ? 46 PHE A HA 1 ATOM 853 H HB2 . PHE A 1 46 ? 2.35445 -7.16788 -12.79734 1.000 52.51699 ? 46 PHE A HB2 1 ATOM 854 H HB3 . PHE A 1 46 ? 1.39751 -8.43568 -12.84599 1.000 52.51699 ? 46 PHE A HB3 1 ATOM 855 H HD1 . PHE A 1 46 ? 2.81503 -10.70972 -12.59716 1.000 61.79046 ? 46 PHE A HD1 1 ATOM 856 H HD2 . PHE A 1 46 ? 3.81113 -7.16613 -11.04218 1.000 56.24969 ? 46 PHE A HD2 1 ATOM 857 H HE1 . PHE A 1 46 ? 4.14621 -11.76852 -11.03140 1.000 60.61442 ? 46 PHE A HE1 1 ATOM 858 H HE2 . PHE A 1 46 ? 5.13594 -8.21717 -9.47079 1.000 64.98087 ? 46 PHE A HE2 1 ATOM 859 H HZ . PHE A 1 46 ? 5.30668 -10.52237 -9.46455 1.000 62.68824 ? 46 PHE A HZ 1 ATOM 860 N N . PHE A 1 47 ? 0.65891 -8.94685 -15.68253 1.000 44.20481 ? 47 PHE A N 1 ATOM 861 C CA . PHE A 1 47 ? -0.67150 -8.74129 -16.24340 1.000 46.17736 ? 47 PHE A CA 1 ATOM 862 C C . PHE A 1 47 ? -1.63945 -9.56927 -15.40634 1.000 46.96169 ? 47 PHE A C 1 ATOM 863 O O . PHE A 1 47 ? -1.37257 -10.74991 -15.16530 1.000 47.59408 ? 47 PHE A O 1 ATOM 864 C CB . PHE A 1 47 ? -0.79554 -9.19494 -17.70926 1.000 46.76634 ? 47 PHE A CB 1 ATOM 865 C CG . PHE A 1 47 ? 0.35453 -8.79673 -18.60427 1.000 54.32268 ? 47 PHE A CG 1 ATOM 866 C CD1 . PHE A 1 47 ? 1.60118 -9.39118 -18.47197 1.000 50.04912 ? 47 PHE A CD1 1 ATOM 867 C CD2 . PHE A 1 47 ? 0.16078 -7.88760 -19.63327 1.000 57.53698 ? 47 PHE A CD2 1 ATOM 868 C CE1 . PHE A 1 47 ? 2.64468 -9.04329 -19.29908 1.000 51.42440 ? 47 PHE A CE1 1 ATOM 869 C CE2 . PHE A 1 47 ? 1.20303 -7.53386 -20.47198 1.000 56.09885 ? 47 PHE A CE2 1 ATOM 870 C CZ . PHE A 1 47 ? 2.44662 -8.11523 -20.30927 1.000 50.71031 ? 47 PHE A CZ 1 ATOM 871 H H . PHE A 1 47 ? 0.87396 -9.77729 -15.62159 1.000 53.04578 ? 47 PHE A H 1 ATOM 872 H HA . PHE A 1 47 ? -0.88052 -7.79459 -16.21207 1.000 55.41283 ? 47 PHE A HA 1 ATOM 873 H HB2 . PHE A 1 47 ? -0.85479 -10.16297 -17.72650 1.000 56.11961 ? 47 PHE A HB2 1 ATOM 874 H HB3 . PHE A 1 47 ? -1.60195 -8.80650 -18.08307 1.000 56.11961 ? 47 PHE A HB3 1 ATOM 875 H HD1 . PHE A 1 47 ? 1.73375 -10.03489 -17.81397 1.000 60.05895 ? 47 PHE A HD1 1 ATOM 876 H HD2 . PHE A 1 47 ? -0.67988 -7.51101 -19.76127 1.000 69.04437 ? 47 PHE A HD2 1 ATOM 877 H HE1 . PHE A 1 47 ? 3.48184 -9.43052 -19.18031 1.000 61.70928 ? 47 PHE A HE1 1 ATOM 878 H HE2 . PHE A 1 47 ? 1.06704 -6.90582 -21.14427 1.000 67.31862 ? 47 PHE A HE2 1 ATOM 879 H HZ . PHE A 1 47 ? 3.14751 -7.88456 -20.87534 1.000 60.85237 ? 47 PHE A HZ 1 ATOM 880 N N . GLN A 1 48 ? -2.75894 -8.98332 -14.97609 1.000 46.21218 ? 48 GLN A N 1 ATOM 881 C CA . GLN A 1 48 ? -3.72440 -9.75116 -14.19980 1.000 47.14997 ? 48 GLN A CA 1 ATOM 882 C C . GLN A 1 48 ? -5.15468 -9.43029 -14.60925 1.000 48.93085 ? 48 GLN A C 1 ATOM 883 O O . GLN A 1 48 ? -5.48269 -8.28355 -14.93657 1.000 45.88612 ? 48 GLN A O 1 ATOM 884 C CB . GLN A 1 48 ? -3.56422 -9.49962 -12.69802 1.000 50.55041 ? 48 GLN A CB 1 ATOM 885 C CG . GLN A 1 48 ? -4.47466 -10.37664 -11.83407 1.000 48.79864 ? 48 GLN A CG 1 ATOM 886 C CD . GLN A 1 48 ? -4.07533 -10.35575 -10.36976 1.000 46.96677 ? 48 GLN A CD 1 ATOM 887 O OE1 . GLN A 1 48 ? -3.85474 -9.28932 -9.79861 1.000 49.69012 ? 48 GLN A OE1 1 ATOM 888 N NE2 . GLN A 1 48 ? -3.99986 -11.53103 -9.75243 1.000 48.17098 ? 48 GLN A NE2 1 ATOM 889 H H . GLN A 1 48 ? -2.97290 -8.16278 -15.11938 1.000 55.45461 ? 48 GLN A H 1 ATOM 890 H HA . GLN A 1 48 ? -3.57481 -10.69059 -14.38956 1.000 56.57997 ? 48 GLN A HA 1 ATOM 891 H HB2 . GLN A 1 48 ? -2.64605 -9.68451 -12.44569 1.000 60.66049 ? 48 GLN A HB2 1 ATOM 892 H HB3 . GLN A 1 48 ? -3.77937 -8.57243 -12.51108 1.000 60.66049 ? 48 GLN A HB3 1 ATOM 893 H HG2 . GLN A 1 48 ? -5.38636 -10.05264 -11.90284 1.000 58.55837 ? 48 GLN A HG2 1 ATOM 894 H HG3 . GLN A 1 48 ? -4.42374 -11.29313 -12.14767 1.000 58.55837 ? 48 GLN A HG3 1 ATOM 895 H HE21 . GLN A 1 48 ? -4.17360 -12.25489 -10.18307 1.000 57.80518 ? 48 GLN A HE21 1 ATOM 896 H HE22 . GLN A 1 48 ? -3.77731 -11.56731 -8.92251 1.000 57.80518 ? 48 GLN A HE22 1 ATOM 897 N N . ILE A 1 49 ? -5.99223 -10.46640 -14.60161 1.000 48.97777 ? 49 ILE A N 1 ATOM 898 C CA . ILE A 1 49 ? -7.43994 -10.34996 -14.74704 1.000 47.57205 ? 49 ILE A CA 1 ATOM 899 C C . ILE A 1 49 ? -8.07602 -10.93113 -13.49215 1.000 49.41446 ? 49 ILE A C 1 ATOM 900 O O . ILE A 1 49 ? -7.73824 -12.05074 -13.08807 1.000 48.21615 ? 49 ILE A O 1 ATOM 901 C CB . ILE A 1 49 ? -7.96018 -11.08106 -15.99538 1.000 52.24760 ? 49 ILE A CB 1 ATOM 902 C CG1 . ILE A 1 49 ? -7.33358 -10.50106 -17.26292 1.000 46.29030 ? 49 ILE A CG1 1 ATOM 903 C CG2 . ILE A 1 49 ? -9.46841 -10.94813 -16.09411 1.000 53.24154 ? 49 ILE A CG2 1 ATOM 904 C CD1 . ILE A 1 49 ? -7.41219 -11.43416 -18.46740 1.000 54.80633 ? 49 ILE A CD1 1 ATOM 905 H H . ILE A 1 49 ? -5.73259 -11.28108 -14.50950 1.000 58.77333 ? 49 ILE A H 1 ATOM 906 H HA . ILE A 1 49 ? -7.67824 -9.41303 -14.82622 1.000 57.08647 ? 49 ILE A HA 1 ATOM 907 H HB . ILE A 1 49 ? -7.71438 -12.01565 -15.91150 1.000 62.69712 ? 49 ILE A HB 1 ATOM 908 H HG12 . ILE A 1 49 ? -7.79692 -9.68050 -17.49293 1.000 55.54837 ? 49 ILE A HG12 1 ATOM 909 H HG13 . ILE A 1 49 ? -6.39684 -10.31631 -17.09174 1.000 55.54837 ? 49 ILE A HG13 1 ATOM 910 H HG21 . ILE A 1 49 ? -9.75622 -11.25759 -16.96721 1.000 63.88985 ? 49 ILE A HG21 1 ATOM 911 H HG22 . ILE A 1 49 ? -9.87906 -11.48730 -15.40016 1.000 63.88985 ? 49 ILE A HG22 1 ATOM 912 H HG23 . ILE A 1 49 ? -9.71169 -10.01652 -15.97662 1.000 63.88985 ? 49 ILE A HG23 1 ATOM 913 H HD11 . ILE A 1 49 ? -7.08127 -10.96734 -19.25064 1.000 65.76759 ? 49 ILE A HD11 1 ATOM 914 H HD12 . ILE A 1 49 ? -6.86802 -12.21849 -18.29530 1.000 65.76759 ? 49 ILE A HD12 1 ATOM 915 H HD13 . ILE A 1 49 ? -8.33608 -11.69608 -18.60419 1.000 65.76759 ? 49 ILE A HD13 1 ATOM 916 N N . LEU A 1 50 ? -8.99604 -10.17811 -12.88701 1.000 45.58760 ? 50 LEU A N 1 ATOM 917 C CA . LEU A 1 50 ? -9.73313 -10.61666 -11.70456 1.000 46.83809 ? 50 LEU A CA 1 ATOM 918 C C . LEU A 1 50 ? -11.22849 -10.45757 -11.93868 1.000 56.73221 ? 50 LEU A C 1 ATOM 919 O O . LEU A 1 50 ? -11.66772 -9.43009 -12.46528 1.000 52.00504 ? 50 LEU A O 1 ATOM 920 C CB . LEU A 1 50 ? -9.34788 -9.80298 -10.47148 1.000 52.91021 ? 50 LEU A CB 1 ATOM 921 C CG . LEU A 1 50 ? -7.90897 -9.83037 -9.96266 1.000 59.99680 ? 50 LEU A CG 1 ATOM 922 C CD1 . LEU A 1 50 ? -7.65058 -8.57127 -9.14052 1.000 61.05392 ? 50 LEU A CD1 1 ATOM 923 C CD2 . LEU A 1 50 ? -7.64625 -11.06610 -9.13461 1.000 60.74943 ? 50 LEU A CD2 1 ATOM 924 H H . LEU A 1 50 ? -9.21513 -9.38947 -13.15092 1.000 54.70512 ? 50 LEU A H 1 ATOM 925 H HA . LEU A 1 50 ? -9.53481 -11.55255 -11.54432 1.000 56.20571 ? 50 LEU A HA 1 ATOM 926 H HB2 . LEU A 1 50 ? -9.54826 -8.87410 -10.66623 1.000 63.49225 ? 50 LEU A HB2 1 ATOM 927 H HB3 . LEU A 1 50 ? -9.90026 -10.11472 -9.73759 1.000 63.49225 ? 50 LEU A HB3 1 ATOM 928 H HG . LEU A 1 50 ? -7.29790 -9.85572 -10.71555 1.000 71.99616 ? 50 LEU A HG 1 ATOM 929 H HD11 . LEU A 1 50 ? -6.75013 -8.60767 -8.78169 1.000 73.26470 ? 50 LEU A HD11 1 ATOM 930 H HD12 . LEU A 1 50 ? -7.74716 -7.79460 -9.71354 1.000 73.26470 ? 50 LEU A HD12 1 ATOM 931 H HD13 . LEU A 1 50 ? -8.29401 -8.52973 -8.41583 1.000 73.26470 ? 50 LEU A HD13 1 ATOM 932 H HD21 . LEU A 1 50 ? -6.71246 -11.07783 -8.87231 1.000 72.89932 ? 50 LEU A HD21 1 ATOM 933 H HD22 . LEU A 1 50 ? -8.21101 -11.04396 -8.34629 1.000 72.89932 ? 50 LEU A HD22 1 ATOM 934 H HD23 . LEU A 1 50 ? -7.85049 -11.85155 -9.66589 1.000 72.89932 ? 50 LEU A HD23 1 ATOM 935 N N . GLU A 1 51 ? -12.01589 -11.44972 -11.51649 1.000 54.09750 ? 51 GLU A N 1 ATOM 936 C CA . GLU A 1 51 ? -13.45763 -11.40399 -11.73580 1.000 52.18604 ? 51 GLU A CA 1 ATOM 937 C C . GLU A 1 51 ? -14.19831 -11.97787 -10.53557 1.000 59.72124 ? 51 GLU A C 1 ATOM 938 O O . GLU A 1 51 ? -13.75636 -12.95088 -9.91603 1.000 55.14183 ? 51 GLU A O 1 ATOM 939 C CB . GLU A 1 51 ? -13.85451 -12.14760 -13.02770 1.000 65.22374 ? 51 GLU A CB 1 ATOM 940 C CG . GLU A 1 51 ? -13.50791 -13.62031 -13.04445 1.000 61.17495 ? 51 GLU A CG 1 ATOM 941 C CD . GLU A 1 51 ? -13.59375 -14.25206 -14.42751 1.000 68.57522 ? 51 GLU A CD 1 ATOM 942 O OE1 . GLU A 1 51 ? -14.06675 -13.59186 -15.38169 1.000 65.21568 ? 51 GLU A OE1 1 ATOM 943 O OE2 . GLU A 1 51 ? -13.18388 -15.42425 -14.55649 1.000 61.49499 ? 51 GLU A OE2 1 ATOM 944 H H . GLU A 1 51 ? -11.73826 -12.15189 -11.10482 1.000 64.91700 ? 51 GLU A H 1 ATOM 945 H HA . GLU A 1 51 ? -13.73565 -10.47869 -11.82192 1.000 62.62325 ? 51 GLU A HA 1 ATOM 946 H HB2 . GLU A 1 51 ? -14.81467 -12.07262 -13.14331 1.000 78.26849 ? 51 GLU A HB2 1 ATOM 947 H HB3 . GLU A 1 51 ? -13.39689 -11.73176 -13.77507 1.000 78.26849 ? 51 GLU A HB3 1 ATOM 948 H HG2 . GLU A 1 51 ? -12.59913 -13.73135 -12.72398 1.000 73.40995 ? 51 GLU A HG2 1 ATOM 949 H HG3 . GLU A 1 51 ? -14.12451 -14.09331 -12.46397 1.000 73.40995 ? 51 GLU A HG3 1 ATOM 950 N N . GLY A 1 52 ? -15.31181 -11.33893 -10.20466 1.000 60.07134 ? 52 GLY A N 1 ATOM 951 C CA . GLY A 1 52 ? -16.14070 -11.74859 -9.09067 1.000 63.23060 ? 52 GLY A CA 1 ATOM 952 C C . GLY A 1 52 ? -17.10127 -10.62633 -8.74792 1.000 65.75743 ? 52 GLY A C 1 ATOM 953 O O . GLY A 1 52 ? -17.23704 -9.65445 -9.48874 1.000 62.47535 ? 52 GLY A O 1 ATOM 954 H H . GLY A 1 52 ? -15.61339 -10.64956 -10.62109 1.000 72.08561 ? 52 GLY A H 1 ATOM 955 H HA2 . GLY A 1 52 ? -16.64739 -12.54185 -9.32498 1.000 75.87672 ? 52 GLY A HA2 1 ATOM 956 H HA3 . GLY A 1 52 ? -15.58871 -11.94347 -8.31721 1.000 75.87672 ? 52 GLY A HA3 1 ATOM 957 N N A GLU A 1 53 ? -17.75627 -10.78654 -7.59945 0.435 68.04187 ? 53 GLU A N 1 ATOM 958 N N B GLU A 1 53 ? -17.77352 -10.78670 -7.61127 0.565 68.01033 ? 53 GLU A N 1 ATOM 959 C CA A GLU A 1 53 ? -18.65843 -9.75649 -7.10238 0.435 70.70266 ? 53 GLU A CA 1 ATOM 960 C CA B GLU A 1 53 ? -18.69554 -9.74908 -7.16795 0.565 70.66575 ? 53 GLU A CA 1 ATOM 961 C C A GLU A 1 53 ? -17.91100 -8.43771 -6.93723 0.435 73.08156 ? 53 GLU A C 1 ATOM 962 C C B GLU A 1 53 ? -17.93673 -8.44671 -6.93618 0.565 73.07132 ? 53 GLU A C 1 ATOM 963 O O A GLU A 1 53 ? -16.79240 -8.40125 -6.41669 0.435 69.72648 ? 53 GLU A O 1 ATOM 964 O O B GLU A 1 53 ? -16.83891 -8.43485 -6.37135 0.565 69.69542 ? 53 GLU A O 1 ATOM 965 C CB A GLU A 1 53 ? -19.27169 -10.19466 -5.77016 0.435 75.62017 ? 53 GLU A CB 1 ATOM 966 C CB B GLU A 1 53 ? -19.43046 -10.17604 -5.89848 0.565 75.63238 ? 53 GLU A CB 1 ATOM 967 C CG A GLU A 1 53 ? -19.75830 -11.64523 -5.74978 0.435 77.45017 ? 53 GLU A CG 1 ATOM 968 C CG B GLU A 1 53 ? -20.61605 -11.11075 -6.14885 0.565 70.98319 ? 53 GLU A CG 1 ATOM 969 C CD A GLU A 1 53 ? -18.70955 -12.61420 -5.22332 0.435 75.90336 ? 53 GLU A CD 1 ATOM 970 C CD B GLU A 1 53 ? -21.67816 -10.50544 -7.05259 0.565 73.93762 ? 53 GLU A CD 1 ATOM 971 O OE1 A GLU A 1 53 ? -17.68797 -12.82428 -5.92063 0.435 64.68130 ? 53 GLU A OE1 1 ATOM 972 O OE1 B GLU A 1 53 ? -21.49636 -10.53282 -8.28830 0.565 83.62059 ? 53 GLU A OE1 1 ATOM 973 O OE2 A GLU A 1 53 ? -18.91200 -13.16801 -4.12076 0.435 77.97960 ? 53 GLU A OE2 1 ATOM 974 O OE2 B GLU A 1 53 ? -22.69793 -10.00760 -6.52986 0.565 83.84076 ? 53 GLU A OE2 1 ATOM 975 H H A GLU A 1 53 ? -17.69502 -11.47905 -7.09321 0.435 81.65025 ? 53 GLU A H 1 ATOM 976 H H B GLU A 1 53 ? -17.71475 -11.46984 -7.09217 0.565 81.61239 ? 53 GLU A H 1 ATOM 977 H HA A GLU A 1 53 ? -19.38132 -9.61938 -7.73447 0.435 84.84320 ? 53 GLU A HA 1 ATOM 978 H HA B GLU A 1 53 ? -19.36796 -9.60082 -7.85116 0.565 84.79890 ? 53 GLU A HA 1 ATOM 979 H HB2 A GLU A 1 53 ? -18.60246 -10.09913 -5.07454 0.435 90.74421 ? 53 GLU A HB2 1 ATOM 980 H HB2 B GLU A 1 53 ? -18.80606 -10.64032 -5.31927 0.565 90.75885 ? 53 GLU A HB2 1 ATOM 981 H HB3 A GLU A 1 53 ? -20.03367 -9.62608 -5.57779 0.435 90.74421 ? 53 GLU A HB3 1 ATOM 982 H HB3 B GLU A 1 53 ? -19.76879 -9.38315 -5.45379 0.565 90.75885 ? 53 GLU A HB3 1 ATOM 983 H HG2 A GLU A 1 53 ? -20.53853 -11.70832 -5.17692 0.435 92.94020 ? 53 GLU A HG2 1 ATOM 984 H HG2 B GLU A 1 53 ? -20.29275 -11.92187 -6.57130 0.565 85.17982 ? 53 GLU A HG2 1 ATOM 985 H HG3 A GLU A 1 53 ? -19.98743 -11.91394 -6.65321 0.435 92.94020 ? 53 GLU A HG3 1 ATOM 986 H HG3 B GLU A 1 53 ? -21.03361 -11.32284 -5.29940 0.565 85.17982 ? 53 GLU A HG3 1 ATOM 987 N N . ALA A 1 54 ? -18.53552 -7.34505 -7.39206 1.000 77.03941 ? 54 ALA A N 1 ATOM 988 C CA . ALA A 1 54 ? -17.86363 -6.04775 -7.36889 1.000 81.26669 ? 54 ALA A CA 1 ATOM 989 C C . ALA A 1 54 ? -17.32300 -5.70266 -5.98707 1.000 79.81999 ? 54 ALA A C 1 ATOM 990 O O . ALA A 1 54 ? -16.20745 -5.18482 -5.86012 1.000 71.81647 ? 54 ALA A O 1 ATOM 991 C CB . ALA A 1 54 ? -18.82969 -4.95903 -7.84282 1.000 87.23628 ? 54 ALA A CB 1 ATOM 992 H H A ALA A 1 54 ? -19.33339 -7.33071 -7.71268 0.435 92.44729 ? 54 ALA A H 1 ATOM 993 H H B ALA A 1 54 ? -19.33032 -7.32199 -7.71973 0.565 92.44729 ? 54 ALA A H 1 ATOM 994 H HA . ALA A 1 54 ? -17.10877 -6.08508 -7.97691 1.000 97.52003 ? 54 ALA A HA 1 ATOM 995 H HB1 . ALA A 1 54 ? -18.37391 -4.10296 -7.82530 1.000 104.68353 ? 54 ALA A HB1 1 ATOM 996 H HB2 . ALA A 1 54 ? -19.11620 -5.16279 -8.74687 1.000 104.68353 ? 54 ALA A HB2 1 ATOM 997 H HB3 . ALA A 1 54 ? -19.59686 -4.93752 -7.24963 1.000 104.68353 ? 54 ALA A HB3 1 ATOM 998 N N . GLU A 1 55 ? -18.10356 -5.97425 -4.93940 1.000 86.87411 ? 55 GLU A N 1 ATOM 999 C CA . GLU A 1 55 ? -17.65463 -5.67782 -3.58248 1.000 91.81957 ? 55 GLU A CA 1 ATOM 1000 C C . GLU A 1 55 ? -16.34240 -6.38437 -3.26681 1.000 81.37188 ? 55 GLU A C 1 ATOM 1001 O O . GLU A 1 55 ? -15.43648 -5.79256 -2.66732 1.000 79.26714 ? 55 GLU A O 1 ATOM 1002 C CB . GLU A 1 55 ? -18.72936 -6.09034 -2.57365 1.000 104.25250 ? 55 GLU A CB 1 ATOM 1003 C CG . GLU A 1 55 ? -19.97005 -5.20603 -2.56382 1.000 133.21692 ? 55 GLU A CG 1 ATOM 1004 C CD . GLU A 1 55 ? -20.85082 -5.40127 -3.78589 1.000 147.85574 ? 55 GLU A CD 1 ATOM 1005 O OE1 . GLU A 1 55 ? -20.79156 -6.48820 -4.40149 1.000 105.87899 ? 55 GLU A OE1 1 ATOM 1006 O OE2 . GLU A 1 55 ? -21.60586 -4.46604 -4.12806 1.000 165.70487 ? 55 GLU A OE2 1 ATOM 1007 H H . GLU A 1 55 ? -18.88705 -6.32557 -4.98757 1.000 104.24893 ? 55 GLU A H 1 ATOM 1008 H HA . GLU A 1 55 ? -17.51187 -4.72147 -3.50557 1.000 110.18348 ? 55 GLU A HA 1 ATOM 1009 H HB2 . GLU A 1 55 ? -19.01640 -6.99322 -2.78175 1.000 125.10300 ? 55 GLU A HB2 1 ATOM 1010 H HB3 . GLU A 1 55 ? -18.34365 -6.06156 -1.68410 1.000 125.10300 ? 55 GLU A HB3 1 ATOM 1011 H HG2 . GLU A 1 55 ? -20.49919 -5.41482 -1.77812 1.000 159.86031 ? 55 GLU A HG2 1 ATOM 1012 H HG3 . GLU A 1 55 ? -19.69387 -4.27647 -2.54039 1.000 159.86031 ? 55 GLU A HG3 1 ATOM 1013 N N . LYS A 1 56 ? -16.22338 -7.65285 -3.66486 1.000 77.77565 ? 56 LYS A N 1 ATOM 1014 C CA A LYS A 1 56 ? -15.01647 -8.41538 -3.36424 0.662 77.44952 ? 56 LYS A CA 1 ATOM 1015 C CA B LYS A 1 56 ? -15.01494 -8.41163 -3.36129 0.338 77.46476 ? 56 LYS A CA 1 ATOM 1016 C C . LYS A 1 56 ? -13.84291 -7.95287 -4.22073 1.000 75.06318 ? 56 LYS A C 1 ATOM 1017 O O . LYS A 1 56 ? -12.71628 -7.83523 -3.72822 1.000 64.98467 ? 56 LYS A O 1 ATOM 1018 C CB A LYS A 1 56 ? -15.27995 -9.90827 -3.57358 0.662 75.90534 ? 56 LYS A CB 1 ATOM 1019 C CB B LYS A 1 56 ? -15.27554 -9.90546 -3.55927 0.338 75.97018 ? 56 LYS A CB 1 ATOM 1020 C CG A LYS A 1 56 ? -16.47290 -10.46421 -2.79122 0.662 78.44439 ? 56 LYS A CG 1 ATOM 1021 C CG B LYS A 1 56 ? -15.70793 -10.64561 -2.29588 0.338 79.99754 ? 56 LYS A CG 1 ATOM 1022 C CD A LYS A 1 56 ? -16.19310 -10.52513 -1.29251 0.662 82.02246 ? 56 LYS A CD 1 ATOM 1023 C CD B LYS A 1 56 ? -16.87430 -9.95189 -1.60052 0.338 81.90241 ? 56 LYS A CD 1 ATOM 1024 C CE A LYS A 1 56 ? -17.07057 -11.56123 -0.58868 0.662 86.99309 ? 56 LYS A CE 1 ATOM 1025 C CE B LYS A 1 56 ? -17.48840 -10.82312 -0.50673 0.338 86.81232 ? 56 LYS A CE 1 ATOM 1026 N NZ A LYS A 1 56 ? -16.36006 -12.24079 0.53541 0.662 81.05707 ? 56 LYS A NZ 1 ATOM 1027 N NZ B LYS A 1 56 ? -17.82094 -12.20052 -0.97137 0.338 83.72243 ? 56 LYS A NZ 1 ATOM 1028 H H A LYS A 1 56 ? -16.82035 -8.08834 -4.10484 0.662 93.33078 ? 56 LYS A H 1 ATOM 1029 H H B LYS A 1 56 ? -16.81949 -8.08914 -4.10521 0.338 93.33078 ? 56 LYS A H 1 ATOM 1030 H HA A LYS A 1 56 ? -14.78029 -8.27715 -2.43364 0.662 92.93943 ? 56 LYS A HA 1 ATOM 1031 H HA B LYS A 1 56 ? -14.77823 -8.26674 -2.43184 0.338 92.95772 ? 56 LYS A HA 1 ATOM 1032 H HB2 A LYS A 1 56 ? -15.45179 -10.06153 -4.51585 0.662 91.08641 ? 56 LYS A HB2 1 ATOM 1033 H HB2 B LYS A 1 56 ? -15.98074 -10.01153 -4.21680 0.338 91.16422 ? 56 LYS A HB2 1 ATOM 1034 H HB3 A LYS A 1 56 ? -14.49270 -10.40194 -3.29533 0.662 91.08641 ? 56 LYS A HB3 1 ATOM 1035 H HB3 B LYS A 1 56 ? -14.45946 -10.32183 -3.87794 0.338 91.16422 ? 56 LYS A HB3 1 ATOM 1036 H HG2 A LYS A 1 56 ? -17.24286 -9.89145 -2.93269 0.662 94.13327 ? 56 LYS A HG2 1 ATOM 1037 H HG2 B LYS A 1 56 ? -15.98672 -11.54431 -2.53149 0.338 95.99705 ? 56 LYS A HG2 1 ATOM 1038 H HG3 A LYS A 1 56 ? -16.66683 -11.36305 -3.10005 0.662 94.13327 ? 56 LYS A HG3 1 ATOM 1039 H HG3 B LYS A 1 56 ? -14.96309 -10.68123 -1.67553 0.338 95.99705 ? 56 LYS A HG3 1 ATOM 1040 H HD2 A LYS A 1 56 ? -15.26473 -10.76765 -1.15034 0.662 98.42695 ? 56 LYS A HD2 1 ATOM 1041 H HD2 B LYS A 1 56 ? -16.55968 -9.13023 -1.19212 0.338 98.28289 ? 56 LYS A HD2 1 ATOM 1042 H HD3 A LYS A 1 56 ? -16.37344 -9.65743 -0.89822 0.662 98.42695 ? 56 LYS A HD3 1 ATOM 1043 H HD3 B LYS A 1 56 ? -17.56399 -9.75488 -2.25353 0.338 98.28289 ? 56 LYS A HD3 1 ATOM 1044 H HE2 A LYS A 1 56 ? -17.85454 -11.11975 -0.22622 0.662 104.39171 ? 56 LYS A HE2 1 ATOM 1045 H HE2 B LYS A 1 56 ? -16.85726 -10.90002 0.22583 0.338 104.17479 ? 56 LYS A HE2 1 ATOM 1046 H HE3 A LYS A 1 56 ? -17.33782 -12.23877 -1.22932 0.662 104.39171 ? 56 LYS A HE3 1 ATOM 1047 H HE3 B LYS A 1 56 ? -18.30797 -10.40740 -0.19627 0.338 104.17479 ? 56 LYS A HE3 1 ATOM 1048 H HZ1 A LYS A 1 56 ? -16.89787 -12.83700 0.91932 0.662 97.26848 ? 56 LYS A HZ1 1 ATOM 1049 H HZ1 B LYS A 1 56 ? -18.28231 -12.63052 -0.34340 0.338 100.46692 ? 56 LYS A HZ1 1 ATOM 1050 H HZ2 A LYS A 1 56 ? -15.63655 -12.65922 0.22955 0.662 97.26848 ? 56 LYS A HZ2 1 ATOM 1051 H HZ2 B LYS A 1 56 ? -18.31043 -12.16151 -1.71364 0.338 100.46692 ? 56 LYS A HZ2 1 ATOM 1052 H HZ3 A LYS A 1 56 ? -16.11128 -11.64168 1.14474 0.662 97.26848 ? 56 LYS A HZ3 1 ATOM 1053 H HZ3 B LYS A 1 56 ? -17.07371 -12.65304 -1.14160 0.338 100.46692 ? 56 LYS A HZ3 1 ATOM 1054 N N . ILE A 1 57 ? -14.08986 -7.68343 -5.50483 1.000 69.37159 ? 57 ILE A N 1 ATOM 1055 C CA . ILE A 1 57 ? -13.02134 -7.25571 -6.40774 1.000 70.53426 ? 57 ILE A CA 1 ATOM 1056 C C . ILE A 1 57 ? -12.41897 -5.93630 -5.93761 1.000 64.80038 ? 57 ILE A C 1 ATOM 1057 O O . ILE A 1 57 ? -11.19407 -5.76658 -5.90664 1.000 62.29451 ? 57 ILE A O 1 ATOM 1058 C CB . ILE A 1 57 ? -13.55468 -7.14315 -7.84956 1.000 67.87578 ? 57 ILE A CB 1 ATOM 1059 C CG1 . ILE A 1 57 ? -14.08138 -8.49535 -8.33689 1.000 67.46386 ? 57 ILE A CG1 1 ATOM 1060 C CG2 . ILE A 1 57 ? -12.48197 -6.61978 -8.79471 1.000 70.82577 ? 57 ILE A CG2 1 ATOM 1061 C CD1 . ILE A 1 57 ? -13.03413 -9.59836 -8.34121 1.000 66.73458 ? 57 ILE A CD1 1 ATOM 1062 H H . ILE A 1 57 ? -14.86351 -7.74023 -5.87608 1.000 83.24591 ? 57 ILE A H 1 ATOM 1063 H HA . ILE A 1 57 ? -12.32073 -7.92638 -6.39180 1.000 84.64111 ? 57 ILE A HA 1 ATOM 1064 H HB . ILE A 1 57 ? -14.28784 -6.50808 -7.84252 1.000 81.45093 ? 57 ILE A HB 1 ATOM 1065 H HG12 . ILE A 1 57 ? -14.80424 -8.77635 -7.75430 1.000 80.95663 ? 57 ILE A HG12 1 ATOM 1066 H HG13 . ILE A 1 57 ? -14.40742 -8.39375 -9.24479 1.000 80.95663 ? 57 ILE A HG13 1 ATOM 1067 H HG21 . ILE A 1 57 ? -12.84820 -6.57008 -9.69154 1.000 84.99093 ? 57 ILE A HG21 1 ATOM 1068 H HG22 . ILE A 1 57 ? -12.20537 -5.73766 -8.50101 1.000 84.99093 ? 57 ILE A HG22 1 ATOM 1069 H HG23 . ILE A 1 57 ? -11.72482 -7.22592 -8.77972 1.000 84.99093 ? 57 ILE A HG23 1 ATOM 1070 H HD11 . ILE A 1 57 ? -13.44341 -10.42120 -8.65157 1.000 80.08149 ? 57 ILE A HD11 1 ATOM 1071 H HD12 . ILE A 1 57 ? -12.31044 -9.34439 -8.93507 1.000 80.08149 ? 57 ILE A HD12 1 ATOM 1072 H HD13 . ILE A 1 57 ? -12.69622 -9.71654 -7.43969 1.000 80.08149 ? 57 ILE A HD13 1 ATOM 1073 N N . ASP A 1 58 ? -13.27207 -4.97358 -5.58814 1.000 67.25877 ? 58 ASP A N 1 ATOM 1074 C CA . ASP A 1 58 ? -12.76687 -3.66922 -5.17245 1.000 77.49969 ? 58 ASP A CA 1 ATOM 1075 C C . ASP A 1 58 ? -11.82678 -3.80153 -3.97629 1.000 75.93047 ? 58 ASP A C 1 ATOM 1076 O O . ASP A 1 58 ? -10.75359 -3.18455 -3.95536 1.000 70.47277 ? 58 ASP A O 1 ATOM 1077 C CB . ASP A 1 58 ? -13.94134 -2.73689 -4.86621 1.000 79.22267 ? 58 ASP A CB 1 ATOM 1078 C CG . ASP A 1 58 ? -14.59728 -2.18284 -6.13099 1.000 72.69647 ? 58 ASP A CG 1 ATOM 1079 O OD1 . ASP A 1 58 ? -14.33178 -2.71095 -7.23320 1.000 73.15004 ? 58 ASP A OD1 1 ATOM 1080 O OD2 . ASP A 1 58 ? -15.39318 -1.23019 -6.02097 1.000 79.84940 ? 58 ASP A OD2 1 ATOM 1081 H H . ASP A 1 58 ? -14.12876 -5.04885 -5.58334 1.000 80.71052 ? 58 ASP A H 1 ATOM 1082 H HA . ASP A 1 58 ? -12.25843 -3.27108 -5.89624 1.000 92.99963 ? 58 ASP A HA 1 ATOM 1083 H HB2 . ASP A 1 58 ? -14.61416 -3.22792 -4.36911 1.000 95.06720 ? 58 ASP A HB2 1 ATOM 1084 H HB3 . ASP A 1 58 ? -13.62167 -1.98713 -4.34030 1.000 95.06720 ? 58 ASP A HB3 1 ATOM 1085 N N A ARG A 1 59 ? -12.20087 -4.60306 -2.97538 0.566 73.15794 ? 59 ARG A N 1 ATOM 1086 N N B ARG A 1 59 ? -12.19877 -4.62380 -2.99003 0.434 73.16250 ? 59 ARG A N 1 ATOM 1087 C CA A ARG A 1 59 ? -11.33663 -4.77052 -1.80878 0.566 70.74451 ? 59 ARG A CA 1 ATOM 1088 C CA B ARG A 1 59 ? -11.36863 -4.79750 -1.80163 0.434 70.79382 ? 59 ARG A CA 1 ATOM 1089 C C A ARG A 1 59 ? -10.01502 -5.41842 -2.20062 0.566 70.07681 ? 59 ARG A C 1 ATOM 1090 C C B ARG A 1 59 ? -10.03593 -5.45365 -2.14928 0.434 70.08926 ? 59 ARG A C 1 ATOM 1091 O O A ARG A 1 59 ? -8.94048 -4.93136 -1.83383 0.566 71.05558 ? 59 ARG A O 1 ATOM 1092 O O B ARG A 1 59 ? -8.97918 -5.02543 -1.67109 0.434 70.77161 ? 59 ARG A O 1 ATOM 1093 C CB A ARG A 1 59 ? -12.04168 -5.59784 -0.73171 0.566 78.39548 ? 59 ARG A CB 1 ATOM 1094 C CB B ARG A 1 59 ? -12.10671 -5.63951 -0.75783 0.434 78.38302 ? 59 ARG A CB 1 ATOM 1095 C CG A ARG A 1 59 ? -11.16347 -5.99238 0.47510 0.566 83.14902 ? 59 ARG A CG 1 ATOM 1096 C CG B ARG A 1 59 ? -13.40072 -5.04284 -0.20570 0.434 78.13899 ? 59 ARG A CG 1 ATOM 1097 C CD A ARG A 1 59 ? -10.13975 -4.92120 0.86839 0.566 85.20951 ? 59 ARG A CD 1 ATOM 1098 C CD B ARG A 1 59 ? -13.21227 -3.71394 0.52152 0.434 81.01045 ? 59 ARG A CD 1 ATOM 1099 N NE A ARG A 1 59 ? -9.60876 -5.11932 2.21532 0.566 97.53621 ? 59 ARG A NE 1 ATOM 1100 N NE B ARG A 1 59 ? -14.23102 -2.74776 0.12147 0.434 83.91715 ? 59 ARG A NE 1 ATOM 1101 C CZ A ARG A 1 59 ? -8.87918 -4.22580 2.87074 0.566 101.16885 ? 59 ARG A CZ 1 ATOM 1102 C CZ B ARG A 1 59 ? -14.17986 -2.00450 -0.97700 0.434 74.15475 ? 59 ARG A CZ 1 ATOM 1103 N NH1 A ARG A 1 59 ? -8.55675 -3.06323 2.32648 0.566 93.26965 ? 59 ARG A NH1 1 ATOM 1104 N NH1 B ARG A 1 59 ? -13.11336 -1.99493 -1.75829 0.434 77.60197 ? 59 ARG A NH1 1 ATOM 1105 N NH2 A ARG A 1 59 ? -8.45757 -4.50780 4.10011 0.566 107.05005 ? 59 ARG A NH2 1 ATOM 1106 N NH2 B ARG A 1 59 ? -15.22435 -1.24509 -1.29444 0.434 77.46875 ? 59 ARG A NH2 1 ATOM 1107 H H A ARG A 1 59 ? -12.93448 -5.05106 -2.94887 0.566 87.78953 ? 59 ARG A H 1 ATOM 1108 H H B ARG A 1 59 ? -12.92251 -5.08835 -2.98672 0.434 87.79499 ? 59 ARG A H 1 ATOM 1109 H HA A ARG A 1 59 ? -11.15131 -3.89500 -1.43457 0.566 84.89341 ? 59 ARG A HA 1 ATOM 1110 H HA B ARG A 1 59 ? -11.19286 -3.92196 -1.42288 0.434 84.95258 ? 59 ARG A HA 1 ATOM 1111 H HB2 A ARG A 1 59 ? -12.78900 -5.08235 -0.39011 0.566 94.07458 ? 59 ARG A HB2 1 ATOM 1112 H HB2 B ARG A 1 59 ? -12.33413 -6.49146 -1.16200 0.434 94.05963 ? 59 ARG A HB2 1 ATOM 1113 H HB3 A ARG A 1 59 ? -12.36253 -6.41850 -1.13728 0.566 94.07458 ? 59 ARG A HB3 1 ATOM 1114 H HB3 B ARG A 1 59 ? -11.51134 -5.77801 -0.00467 0.434 94.05963 ? 59 ARG A HB3 1 ATOM 1115 H HG2 A ARG A 1 59 ? -11.73698 -6.14865 1.24163 0.566 99.77882 ? 59 ARG A HG2 1 ATOM 1116 H HG2 B ARG A 1 59 ? -14.01283 -4.89052 -0.94260 0.434 93.76679 ? 59 ARG A HG2 1 ATOM 1117 H HG3 A ARG A 1 59 ? -10.67526 -6.80132 0.25563 0.566 99.77882 ? 59 ARG A HG3 1 ATOM 1118 H HG3 B ARG A 1 59 ? -13.78917 -5.67009 0.42403 0.434 93.76679 ? 59 ARG A HG3 1 ATOM 1119 H HD2 A ARG A 1 59 ? -9.39672 -4.94913 0.24546 0.566 102.25141 ? 59 ARG A HD2 1 ATOM 1120 H HD2 B ARG A 1 59 ? -13.28355 -3.85667 1.47831 0.434 97.21254 ? 59 ARG A HD2 1 ATOM 1121 H HD3 A ARG A 1 59 ? -10.56527 -4.05004 0.83838 0.566 102.25141 ? 59 ARG A HD3 1 ATOM 1122 H HD3 B ARG A 1 59 ? -12.34043 -3.34817 0.30469 0.434 97.21254 ? 59 ARG A HD3 1 ATOM 1123 H HE A ARG A 1 59 ? -9.78052 -5.86430 2.60916 0.566 117.04345 ? 59 ARG A HE 1 ATOM 1124 H HE B ARG A 1 59 ? -14.91427 -2.65329 0.63514 0.434 100.70058 ? 59 ARG A HE 1 ATOM 1125 H HH11 A ARG A 1 59 ? -8.82114 -2.87299 1.53055 0.566 111.92358 ? 59 ARG A HH11 1 ATOM 1126 H HH11 B ARG A 1 59 ? -13.10261 -1.50539 -2.46528 0.434 93.12236 ? 59 ARG A HH11 1 ATOM 1127 H HH12 A ARG A 1 59 ? -8.08285 -2.49808 2.76876 0.566 111.92358 ? 59 ARG A HH12 1 ATOM 1128 H HH12 B ARG A 1 59 ? -12.43036 -2.47826 -1.55952 0.434 93.12236 ? 59 ARG A HH12 1 ATOM 1129 H HH21 A ARG A 1 59 ? -8.65845 -5.26205 4.46115 0.566 128.46006 ? 59 ARG A HH21 1 ATOM 1130 H HH21 B ARG A 1 59 ? -15.20298 -0.75919 -2.00370 0.434 92.96249 ? 59 ARG A HH21 1 ATOM 1131 H HH22 A ARG A 1 59 ? -7.98405 -3.93590 4.53406 0.566 128.46006 ? 59 ARG A HH22 1 ATOM 1132 H HH22 B ARG A 1 59 ? -15.92119 -1.23988 -0.79048 0.434 92.96249 ? 59 ARG A HH22 1 ATOM 1133 N N . ILE A 1 60 ? -10.07070 -6.51932 -2.95228 1.000 67.44589 ? 60 ILE A N 1 ATOM 1134 C CA . ILE A 1 60 ? -8.83425 -7.20254 -3.33152 1.000 67.10792 ? 60 ILE A CA 1 ATOM 1135 C C . ILE A 1 60 ? -7.93406 -6.26788 -4.13159 1.000 61.59404 ? 60 ILE A C 1 ATOM 1136 O O . ILE A 1 60 ? -6.71891 -6.21243 -3.90932 1.000 61.13932 ? 60 ILE A O 1 ATOM 1137 C CB . ILE A 1 60 ? -9.14800 -8.49829 -4.10427 1.000 64.47501 ? 60 ILE A CB 1 ATOM 1138 C CG1 . ILE A 1 60 ? -9.64132 -9.58782 -3.14150 1.000 69.60898 ? 60 ILE A CG1 1 ATOM 1139 C CG2 . ILE A 1 60 ? -7.92150 -9.01427 -4.84359 1.000 60.88831 ? 60 ILE A CG2 1 ATOM 1140 C CD1 . ILE A 1 60 ? -10.84272 -10.35362 -3.63862 1.000 69.28298 ? 60 ILE A CD1 1 ATOM 1141 H H . ILE A 1 60 ? -10.79402 -6.87954 -3.24664 1.000 80.93507 ? 60 ILE A H 1 ATOM 1142 H HA . ILE A 1 60 ? -8.36007 -7.45078 -2.52255 1.000 80.52951 ? 60 ILE A HA 1 ATOM 1143 H HB . ILE A 1 60 ? -9.84085 -8.28681 -4.74935 1.000 77.37001 ? 60 ILE A HB 1 ATOM 1144 H HG12 . ILE A 1 60 ? -8.92385 -10.22515 -3.00027 1.000 83.53078 ? 60 ILE A HG12 1 ATOM 1145 H HG13 . ILE A 1 60 ? -9.88536 -9.17118 -2.30021 1.000 83.53078 ? 60 ILE A HG13 1 ATOM 1146 H HG21 . ILE A 1 60 ? -8.15101 -9.83968 -5.29849 1.000 73.06597 ? 60 ILE A HG21 1 ATOM 1147 H HG22 . ILE A 1 60 ? -7.63871 -8.34818 -5.48955 1.000 73.06597 ? 60 ILE A HG22 1 ATOM 1148 H HG23 . ILE A 1 60 ? -7.21142 -9.17609 -4.20289 1.000 73.06597 ? 60 ILE A HG23 1 ATOM 1149 H HD11 . ILE A 1 60 ? -11.08773 -11.02032 -2.97803 1.000 83.13957 ? 60 ILE A HD11 1 ATOM 1150 H HD12 . ILE A 1 60 ? -11.57791 -9.73529 -3.77297 1.000 83.13957 ? 60 ILE A HD12 1 ATOM 1151 H HD13 . ILE A 1 60 ? -10.61680 -10.78607 -4.47698 1.000 83.13957 ? 60 ILE A HD13 1 ATOM 1152 N N . TYR A 1 61 ? -8.51029 -5.51649 -5.07068 1.000 66.87188 ? 61 TYR A N 1 ATOM 1153 C CA . TYR A 1 61 ? -7.70189 -4.59966 -5.87096 1.000 59.76701 ? 61 TYR A CA 1 ATOM 1154 C C . TYR A 1 61 ? -6.98972 -3.57977 -4.98634 1.000 63.12039 ? 61 TYR A C 1 ATOM 1155 O O . TYR A 1 61 ? -5.79747 -3.31342 -5.17394 1.000 56.10620 ? 61 TYR A O 1 ATOM 1156 C CB . TYR A 1 61 ? -8.58400 -3.90775 -6.91254 1.000 66.26672 ? 61 TYR A CB 1 ATOM 1157 C CG . TYR A 1 61 ? -7.83061 -3.08220 -7.93348 1.000 67.58118 ? 61 TYR A CG 1 ATOM 1158 C CD1 . TYR A 1 61 ? -6.92058 -3.67393 -8.79609 1.000 59.33841 ? 61 TYR A CD1 1 ATOM 1159 C CD2 . TYR A 1 61 ? -8.04747 -1.71747 -8.04922 1.000 63.90414 ? 61 TYR A CD2 1 ATOM 1160 C CE1 . TYR A 1 61 ? -6.23317 -2.92684 -9.74286 1.000 62.48586 ? 61 TYR A CE1 1 ATOM 1161 C CE2 . TYR A 1 61 ? -7.36497 -0.95781 -8.99509 1.000 71.54408 ? 61 TYR A CE2 1 ATOM 1162 C CZ . TYR A 1 61 ? -6.45851 -1.57243 -9.83744 1.000 71.13412 ? 61 TYR A CZ 1 ATOM 1163 O OH . TYR A 1 61 ? -5.77232 -0.83624 -10.77935 1.000 68.93884 ? 61 TYR A OH 1 ATOM 1164 H H . TYR A 1 61 ? -9.34914 -5.51863 -5.26019 1.000 80.24626 ? 61 TYR A H 1 ATOM 1165 H HA . TYR A 1 61 ? -7.02124 -5.10217 -6.34539 1.000 71.72041 ? 61 TYR A HA 1 ATOM 1166 H HB2 . TYR A 1 61 ? -9.08068 -4.58674 -7.39543 1.000 79.52006 ? 61 TYR A HB2 1 ATOM 1167 H HB3 . TYR A 1 61 ? -9.19662 -3.31357 -6.45149 1.000 79.52006 ? 61 TYR A HB3 1 ATOM 1168 H HD1 . TYR A 1 61 ? -6.76765 -4.58951 -8.73928 1.000 71.20609 ? 61 TYR A HD1 1 ATOM 1169 H HD2 . TYR A 1 61 ? -8.65949 -1.30257 -7.48514 1.000 76.68497 ? 61 TYR A HD2 1 ATOM 1170 H HE1 . TYR A 1 61 ? -5.62317 -3.33967 -10.31063 1.000 74.98304 ? 61 TYR A HE1 1 ATOM 1171 H HE2 . TYR A 1 61 ? -7.51809 -0.04278 -9.05961 1.000 85.85290 ? 61 TYR A HE2 1 ATOM 1172 H HH . TYR A 1 61 ? -5.99933 -0.02877 -10.73404 1.000 82.72661 ? 61 TYR A HH 1 ATOM 1173 N N . GLU A 1 62 ? -7.69217 -3.02033 -3.99680 1.000 64.98525 ? 62 GLU A N 1 ATOM 1174 C CA . GLU A 1 62 ? -7.06470 -2.03317 -3.12019 1.000 63.21031 ? 62 GLU A CA 1 ATOM 1175 C C . GLU A 1 62 ? -5.86729 -2.63254 -2.39165 1.000 64.70818 ? 62 GLU A C 1 ATOM 1176 O O . GLU A 1 62 ? -4.83534 -1.97051 -2.22897 1.000 64.72373 ? 62 GLU A O 1 ATOM 1177 C CB . GLU A 1 62 ? -8.08599 -1.48555 -2.12178 1.000 72.78504 ? 62 GLU A CB 1 ATOM 1178 H H . GLU A 1 62 ? -8.51538 -3.19190 -3.81656 1.000 77.98230 ? 62 GLU A H 1 ATOM 1179 H HA . GLU A 1 62 ? -6.75063 -1.29020 -3.65895 1.000 75.85237 ? 62 GLU A HA 1 ATOM 1180 N N A ARG A 1 63 ? -5.97897 -3.89012 -1.96524 0.495 65.39946 ? 63 ARG A N 1 ATOM 1181 N N B ARG A 1 63 ? -5.99360 -3.88202 -1.92936 0.505 65.42393 ? 63 ARG A N 1 ATOM 1182 C CA A ARG A 1 63 ? -4.86777 -4.55069 -1.28670 0.495 66.89530 ? 63 ARG A CA 1 ATOM 1183 C CA B ARG A 1 63 ? -4.86742 -4.55669 -1.29016 0.505 66.89240 ? 63 ARG A CA 1 ATOM 1184 C C A ARG A 1 63 ? -3.71194 -4.80971 -2.24674 0.495 62.19854 ? 63 ARG A C 1 ATOM 1185 C C B ARG A 1 63 ? -3.71276 -4.72678 -2.27133 0.505 62.20460 ? 63 ARG A C 1 ATOM 1186 O O A ARG A 1 63 ? -2.54149 -4.68750 -1.86660 0.495 60.03213 ? 63 ARG A O 1 ATOM 1187 O O B ARG A 1 63 ? -2.54940 -4.47975 -1.93356 0.505 60.08178 ? 63 ARG A O 1 ATOM 1188 C CB A ARG A 1 63 ? -5.36760 -5.85252 -0.65584 0.495 68.24802 ? 63 ARG A CB 1 ATOM 1189 C CB B ARG A 1 63 ? -5.28823 -5.92929 -0.75159 0.505 68.22561 ? 63 ARG A CB 1 ATOM 1190 C CG A ARG A 1 63 ? -4.29737 -6.87186 -0.30292 0.495 68.88831 ? 63 ARG A CG 1 ATOM 1191 C CG B ARG A 1 63 ? -6.45457 -5.95718 0.23416 0.505 74.22816 ? 63 ARG A CG 1 ATOM 1192 C CD A ARG A 1 63 ? -3.33304 -6.35033 0.74237 0.495 69.78695 ? 63 ARG A CD 1 ATOM 1193 C CD B ARG A 1 63 ? -6.28147 -7.11115 1.23711 0.505 78.06736 ? 63 ARG A CD 1 ATOM 1194 N NE A ARG A 1 63 ? -2.00390 -6.16392 0.17364 0.495 70.68763 ? 63 ARG A NE 1 ATOM 1195 N NE B ARG A 1 63 ? -5.86836 -8.34651 0.57688 0.505 75.37275 ? 63 ARG A NE 1 ATOM 1196 C CZ A ARG A 1 63 ? -1.06267 -5.39331 0.69715 0.495 71.65443 ? 63 ARG A CZ 1 ATOM 1197 C CZ B ARG A 1 63 ? -6.65462 -9.09575 -0.18593 0.505 67.53130 ? 63 ARG A CZ 1 ATOM 1198 N NH1 A ARG A 1 63 ? -1.26991 -4.70656 1.80977 0.495 78.93686 ? 63 ARG A NH1 1 ATOM 1199 N NH1 B ARG A 1 63 ? -7.94907 -8.84971 -0.29789 0.505 76.33289 ? 63 ARG A NH1 1 ATOM 1200 N NH2 A ARG A 1 63 ? 0.11796 -5.31381 0.09252 0.495 73.34571 ? 63 ARG A NH2 1 ATOM 1201 N NH2 B ARG A 1 63 ? -6.12775 -10.11876 -0.85178 0.505 70.21907 ? 63 ARG A NH2 1 ATOM 1202 H H A ARG A 1 63 ? -6.68101 -4.37857 -2.05555 0.495 78.47935 ? 63 ARG A H 1 ATOM 1203 H H B ARG A 1 63 ? -6.71224 -4.35227 -1.97426 0.505 78.50871 ? 63 ARG A H 1 ATOM 1204 H HA A ARG A 1 63 ? -4.53177 -3.98027 -0.57774 0.495 80.27437 ? 63 ARG A HA 1 ATOM 1205 H HA B ARG A 1 63 ? -4.57662 -4.01325 -0.54116 0.505 80.27088 ? 63 ARG A HA 1 ATOM 1206 H HB2 A ARG A 1 63 ? -5.83580 -5.63209 0.16458 0.495 81.89762 ? 63 ARG A HB2 1 ATOM 1207 H HB2 B ARG A 1 63 ? -5.54328 -6.48200 -1.50682 0.505 81.87073 ? 63 ARG A HB2 1 ATOM 1208 H HB3 A ARG A 1 63 ? -5.97524 -6.27875 -1.28034 0.495 81.89762 ? 63 ARG A HB3 1 ATOM 1209 H HB3 B ARG A 1 63 ? -4.52511 -6.31965 -0.29752 0.505 81.87073 ? 63 ARG A HB3 1 ATOM 1210 H HG2 A ARG A 1 63 ? -4.72133 -7.67019 0.04897 0.495 82.66597 ? 63 ARG A HG2 1 ATOM 1211 H HG2 B ARG A 1 63 ? -6.48516 -5.12166 0.72596 0.505 89.07380 ? 63 ARG A HG2 1 ATOM 1212 H HG3 A ARG A 1 63 ? -3.78961 -7.08982 -1.10015 0.495 82.66597 ? 63 ARG A HG3 1 ATOM 1213 H HG3 B ARG A 1 63 ? -7.28562 -6.08867 -0.24850 0.505 89.07380 ? 63 ARG A HG3 1 ATOM 1214 H HD2 A ARG A 1 63 ? -3.64806 -5.49558 1.07565 0.495 83.74434 ? 63 ARG A HD2 1 ATOM 1215 H HD2 B ARG A 1 63 ? -5.60158 -6.87160 1.88617 0.505 93.68084 ? 63 ARG A HD2 1 ATOM 1216 H HD3 A ARG A 1 63 ? -3.26966 -6.98755 1.47096 0.495 83.74434 ? 63 ARG A HD3 1 ATOM 1217 H HD3 B ARG A 1 63 ? -7.12577 -7.27428 1.68593 0.505 93.68084 ? 63 ARG A HD3 1 ATOM 1218 H HE A ARG A 1 63 ? -1.81780 -6.58409 -0.55328 0.495 84.82516 ? 63 ARG A HE 1 ATOM 1219 H HE B ARG A 1 63 ? -5.05681 -8.60740 0.69059 0.505 90.44730 ? 63 ARG A HE 1 ATOM 1220 H HH11 A ARG A 1 63 ? -2.02971 -4.75491 2.20971 0.495 94.72424 ? 63 ARG A HH11 1 ATOM 1221 H HH11 B ARG A 1 63 ? -8.30011 -8.19106 0.12937 0.505 91.59947 ? 63 ARG A HH11 1 ATOM 1222 H HH12 A ARG A 1 63 ? -0.64474 -4.21206 2.13261 0.495 94.72424 ? 63 ARG A HH12 1 ATOM 1223 H HH12 B ARG A 1 63 ? -8.43986 -9.34834 -0.79798 0.505 91.59947 ? 63 ARG A HH12 1 ATOM 1224 H HH21 A ARG A 1 63 ? 0.26255 -5.75929 -0.62875 0.495 88.01485 ? 63 ARG A HH21 1 ATOM 1225 H HH21 B ARG A 1 63 ? -5.28721 -10.28806 -0.78513 0.505 84.26289 ? 63 ARG A HH21 1 ATOM 1226 H HH22 A ARG A 1 63 ? 0.73746 -4.81687 0.42249 0.495 88.01485 ? 63 ARG A HH22 1 ATOM 1227 H HH22 B ARG A 1 63 ? -6.62746 -10.61122 -1.34914 0.505 84.26289 ? 63 ARG A HH22 1 ATOM 1228 N N . ILE A 1 64 ? -4.01857 -5.17079 -3.49392 1.000 55.85043 ? 64 ILE A N 1 ATOM 1229 C CA . ILE A 1 64 ? -2.96871 -5.37107 -4.48705 1.000 53.28129 ? 64 ILE A CA 1 ATOM 1230 C C . ILE A 1 64 ? -2.24828 -4.05904 -4.77690 1.000 59.24303 ? 64 ILE A C 1 ATOM 1231 O O . ILE A 1 64 ? -1.03881 -4.05355 -5.03837 1.000 54.24361 ? 64 ILE A O 1 ATOM 1232 C CB . ILE A 1 64 ? -3.55967 -5.98502 -5.77263 1.000 55.50054 ? 64 ILE A CB 1 ATOM 1233 C CG1 . ILE A 1 64 ? -3.92259 -7.46088 -5.56302 1.000 61.99423 ? 64 ILE A CG1 1 ATOM 1234 C CG2 . ILE A 1 64 ? -2.58048 -5.85079 -6.92912 1.000 57.99041 ? 64 ILE A CG2 1 ATOM 1235 C CD1 . ILE A 1 64 ? -4.95129 -7.99455 -6.57659 1.000 57.21274 ? 64 ILE A CD1 1 ATOM 1236 H H A ILE A 1 64 ? -4.81665 -5.30412 -3.78528 0.296 67.02051 ? 64 ILE A H 1 ATOM 1237 H H B ILE A 1 64 ? -4.81230 -5.35928 -3.76607 0.405 67.02051 ? 64 ILE A H 1 ATOM 1238 H H C ILE A 1 64 ? -4.78032 -5.49567 -3.72222 0.259 67.02051 ? 64 ILE A H 1 ATOM 1239 H HA . ILE A 1 64 ? -2.32007 -5.99670 -4.12822 1.000 63.93754 ? 64 ILE A HA 1 ATOM 1240 H HB . ILE A 1 64 ? -4.37015 -5.49620 -5.98497 1.000 66.60065 ? 64 ILE A HB 1 ATOM 1241 H HG12 . ILE A 1 64 ? -3.11768 -7.99545 -5.64825 1.000 74.39308 ? 64 ILE A HG12 1 ATOM 1242 H HG13 . ILE A 1 64 ? -4.29875 -7.56682 -4.67523 1.000 74.39308 ? 64 ILE A HG13 1 ATOM 1243 H HG21 . ILE A 1 64 ? -2.83263 -6.47200 -7.63013 1.000 69.58850 ? 64 ILE A HG21 1 ATOM 1244 H HG22 . ILE A 1 64 ? -2.61206 -4.94162 -7.26574 1.000 69.58850 ? 64 ILE A HG22 1 ATOM 1245 H HG23 . ILE A 1 64 ? -1.68695 -6.05514 -6.61171 1.000 69.58850 ? 64 ILE A HG23 1 ATOM 1246 H HD11 . ILE A 1 64 ? -5.17582 -8.90974 -6.34653 1.000 68.65529 ? 64 ILE A HD11 1 ATOM 1247 H HD12 . ILE A 1 64 ? -5.74637 -7.44003 -6.54130 1.000 68.65529 ? 64 ILE A HD12 1 ATOM 1248 H HD13 . ILE A 1 64 ? -4.56470 -7.96230 -7.46564 1.000 68.65529 ? 64 ILE A HD13 1 ATOM 1249 N N . LEU A 1 65 ? -2.97004 -2.93093 -4.74479 1.000 55.05088 ? 65 LEU A N 1 ATOM 1250 C CA . LEU A 1 65 ? -2.33159 -1.64006 -4.99260 1.000 59.41187 ? 65 LEU A CA 1 ATOM 1251 C C . LEU A 1 65 ? -1.29834 -1.30551 -3.93223 1.000 66.13608 ? 65 LEU A C 1 ATOM 1252 O O . LEU A 1 65 ? -0.37691 -0.52390 -4.19131 1.000 62.82833 ? 65 LEU A O 1 ATOM 1253 C CB . LEU A 1 65 ? -3.36373 -0.51062 -5.04497 1.000 65.78618 ? 65 LEU A CB 1 ATOM 1254 C CG . LEU A 1 65 ? -4.41902 -0.59595 -6.14434 1.000 71.72393 ? 65 LEU A CG 1 ATOM 1255 C CD1 . LEU A 1 65 ? -5.48576 0.46044 -5.93917 1.000 72.92093 ? 65 LEU A CD1 1 ATOM 1256 C CD2 . LEU A 1 65 ? -3.76752 -0.44680 -7.50182 1.000 73.21592 ? 65 LEU A CD2 1 ATOM 1257 H H . LEU A 1 65 ? -3.81401 -2.88963 -4.58474 1.000 66.06106 ? 65 LEU A H 1 ATOM 1258 H HA . LEU A 1 65 ? -1.89620 -1.69856 -5.85742 1.000 71.29424 ? 65 LEU A HA 1 ATOM 1259 H HB2 . LEU A 1 65 ? -3.83629 -0.49712 -4.19797 1.000 78.94342 ? 65 LEU A HB2 1 ATOM 1260 H HB3 . LEU A 1 65 ? -2.88749 0.32475 -5.17251 1.000 78.94342 ? 65 LEU A HB3 1 ATOM 1261 H HG . LEU A 1 65 ? -4.85166 -1.46343 -6.10961 1.000 86.06872 ? 65 LEU A HG 1 ATOM 1262 H HD11 . LEU A 1 65 ? -6.14770 0.38186 -6.64384 1.000 87.50512 ? 65 LEU A HD11 1 ATOM 1263 H HD12 . LEU A 1 65 ? -5.90452 0.32274 -5.07512 1.000 87.50512 ? 65 LEU A HD12 1 ATOM 1264 H HD13 . LEU A 1 65 ? -5.07204 1.33724 -5.97026 1.000 87.50512 ? 65 LEU A HD13 1 ATOM 1265 H HD21 . LEU A 1 65 ? -4.44989 -0.51027 -8.18829 1.000 87.85910 ? 65 LEU A HD21 1 ATOM 1266 H HD22 . LEU A 1 65 ? -3.33028 0.41778 -7.54899 1.000 87.85910 ? 65 LEU A HD22 1 ATOM 1267 H HD23 . LEU A 1 65 ? -3.11445 -1.15453 -7.61815 1.000 87.85910 ? 65 LEU A HD23 1 ATOM 1268 N N . ALA A 1 66 ? -1.44847 -1.85868 -2.73097 1.000 59.61151 ? 66 ALA A N 1 ATOM 1269 C CA . ALA A 1 66 ? -0.53220 -1.58129 -1.63940 1.000 58.36761 ? 66 ALA A CA 1 ATOM 1270 C C . ALA A 1 66 ? 0.68383 -2.50026 -1.61960 1.000 59.71507 ? 66 ALA A C 1 ATOM 1271 O O . ALA A 1 66 ? 1.59478 -2.26786 -0.81426 1.000 61.36238 ? 66 ALA A O 1 ATOM 1272 C CB . ALA A 1 66 ? -1.27384 -1.69408 -0.30201 1.000 66.77061 ? 66 ALA A CB 1 ATOM 1273 H H . ALA A 1 66 ? -2.08144 -2.40335 -2.52535 1.000 71.53381 ? 66 ALA A H 1 ATOM 1274 H HA . ALA A 1 66 ? -0.20603 -0.67257 -1.73285 1.000 70.04113 ? 66 ALA A HA 1 ATOM 1275 H HB1 . ALA A 1 66 ? -0.66145 -1.47638 0.41804 1.000 80.12473 ? 66 ALA A HB1 1 ATOM 1276 H HB2 . ALA A 1 66 ? -2.01945 -1.07362 -0.30107 1.000 80.12473 ? 66 ALA A HB2 1 ATOM 1277 H HB3 . ALA A 1 66 ? -1.59885 -2.60193 -0.19672 1.000 80.12473 ? 66 ALA A HB3 1 ATOM 1278 N N . ASP A 1 67 ? 0.72586 -3.51961 -2.48208 1.000 54.82438 ? 67 ASP A N 1 ATOM 1279 C CA . ASP A 1 67 ? 1.81622 -4.49037 -2.47566 1.000 57.61097 ? 67 ASP A CA 1 ATOM 1280 C C . ASP A 1 67 ? 3.10045 -3.82961 -2.95852 1.000 61.71776 ? 67 ASP A C 1 ATOM 1281 O O . ASP A 1 67 ? 3.15698 -3.30707 -4.07372 1.000 57.95798 ? 67 ASP A O 1 ATOM 1282 C CB . ASP A 1 67 ? 1.46876 -5.68917 -3.35521 1.000 52.75042 ? 67 ASP A CB 1 ATOM 1283 C CG . ASP A 1 67 ? 2.29340 -6.93016 -3.01762 1.000 55.99212 ? 67 ASP A CG 1 ATOM 1284 O OD1 . ASP A 1 67 ? 3.53478 -6.86244 -3.10596 1.000 55.95568 ? 67 ASP A OD1 1 ATOM 1285 O OD2 . ASP A 1 67 ? 1.70262 -7.98217 -2.68868 1.000 56.18812 ? 67 ASP A OD2 1 ATOM 1286 H H . ASP A 1 67 ? 0.13004 -3.66993 -3.08375 1.000 65.78925 ? 67 ASP A H 1 ATOM 1287 H HA . ASP A 1 67 ? 1.95268 -4.80907 -1.56973 1.000 69.13316 ? 67 ASP A HA 1 ATOM 1288 H HB2 . ASP A 1 67 ? 0.53201 -5.90949 -3.23329 1.000 63.30051 ? 67 ASP A HB2 1 ATOM 1289 H HB3 . ASP A 1 67 ? 1.63774 -5.46015 -4.28252 1.000 63.30051 ? 67 ASP A HB3 1 ATOM 1290 N N A GLU A 1 68 ? 4.13731 -3.85733 -2.12354 0.650 63.41652 ? 68 GLU A N 1 ATOM 1291 N N B GLU A 1 68 ? 4.13687 -3.86506 -2.11895 0.350 63.54852 ? 68 GLU A N 1 ATOM 1292 C CA A GLU A 1 68 ? 5.37951 -3.18062 -2.47105 0.650 68.53508 ? 68 GLU A CA 1 ATOM 1293 C CA B GLU A 1 68 ? 5.40044 -3.21555 -2.44145 0.350 68.59184 ? 68 GLU A CA 1 ATOM 1294 C C A GLU A 1 68 ? 6.14096 -3.86375 -3.60228 0.650 64.62910 ? 68 GLU A C 1 ATOM 1295 C C B GLU A 1 68 ? 6.11735 -3.84890 -3.62590 0.350 64.71984 ? 68 GLU A C 1 ATOM 1296 O O A GLU A 1 68 ? 7.13403 -3.30181 -4.07605 0.650 67.23007 ? 68 GLU A O 1 ATOM 1297 O O B GLU A 1 68 ? 7.05534 -3.24106 -4.15261 0.350 66.98872 ? 68 GLU A O 1 ATOM 1298 C CB A GLU A 1 68 ? 6.27203 -3.07155 -1.22794 0.650 73.65556 ? 68 GLU A CB 1 ATOM 1299 C CB B GLU A 1 68 ? 6.32612 -3.24250 -1.22032 0.350 73.97454 ? 68 GLU A CB 1 ATOM 1300 C CG A GLU A 1 68 ? 6.84976 -4.39952 -0.74931 0.650 80.72242 ? 68 GLU A CG 1 ATOM 1301 C CG B GLU A 1 68 ? 6.68139 -4.64711 -0.73760 0.350 80.54944 ? 68 GLU A CG 1 ATOM 1302 C CD A GLU A 1 68 ? 7.09134 -4.43700 0.75201 0.650 88.15862 ? 68 GLU A CD 1 ATOM 1303 C CD B GLU A 1 68 ? 8.15765 -4.97114 -0.89154 0.350 82.40461 ? 68 GLU A CD 1 ATOM 1304 O OE1 A GLU A 1 68 ? 6.47498 -3.63223 1.48408 0.650 86.89372 ? 68 GLU A OE1 1 ATOM 1305 O OE1 B GLU A 1 68 ? 8.75336 -4.58535 -1.92020 0.350 80.61070 ? 68 GLU A OE1 1 ATOM 1306 O OE2 A GLU A 1 68 ? 7.89857 -5.27889 1.20053 0.650 96.07366 ? 68 GLU A OE2 1 ATOM 1307 O OE2 B GLU A 1 68 ? 8.72229 -5.61515 0.01800 0.350 85.29240 ? 68 GLU A OE2 1 ATOM 1308 H H A GLU A 1 68 ? 4.14487 -4.25573 -1.36143 0.650 76.09983 ? 68 GLU A H 1 ATOM 1309 H H B GLU A 1 68 ? 4.13071 -4.26045 -1.35525 0.350 76.25823 ? 68 GLU A H 1 ATOM 1310 H HA A GLU A 1 68 ? 5.16904 -2.28265 -2.77146 0.650 82.24210 ? 68 GLU A HA 1 ATOM 1311 H HA B GLU A 1 68 ? 5.21481 -2.29101 -2.66877 0.350 82.31021 ? 68 GLU A HA 1 ATOM 1312 H HB2 A GLU A 1 68 ? 7.01647 -2.48417 -1.43213 0.650 88.38667 ? 68 GLU A HB2 1 ATOM 1313 H HB2 B GLU A 1 68 ? 7.15390 -2.79116 -1.44829 0.350 88.76945 ? 68 GLU A HB2 1 ATOM 1314 H HB3 A GLU A 1 68 ? 5.74675 -2.70113 -0.50146 0.650 88.38667 ? 68 GLU A HB3 1 ATOM 1315 H HB3 B GLU A 1 68 ? 5.88762 -2.78147 -0.48816 0.350 88.76945 ? 68 GLU A HB3 1 ATOM 1316 H HG2 A GLU A 1 68 ? 6.22849 -5.11108 -0.96978 0.650 96.86691 ? 68 GLU A HG2 1 ATOM 1317 H HG2 B GLU A 1 68 ? 6.45475 -4.72419 0.20239 0.350 96.65933 ? 68 GLU A HG2 1 ATOM 1318 H HG3 A GLU A 1 68 ? 7.69912 -4.55154 -1.19245 0.650 96.86691 ? 68 GLU A HG3 1 ATOM 1319 H HG3 B GLU A 1 68 ? 6.17753 -5.29501 -1.25456 0.350 96.65933 ? 68 GLU A HG3 1 ATOM 1320 N N . ARG A 1 69 ? 5.69915 -5.03288 -4.07088 1.000 60.12820 ? 69 ARG A N 1 ATOM 1321 C CA . ARG A 1 69 ? 6.45607 -5.75337 -5.08929 1.000 57.57865 ? 69 ARG A CA 1 ATOM 1322 C C . ARG A 1 69 ? 6.17279 -5.29233 -6.51084 1.000 60.71724 ? 69 ARG A C 1 ATOM 1323 O O . ARG A 1 69 ? 6.83564 -5.76897 -7.43721 1.000 55.61967 ? 69 ARG A O 1 ATOM 1324 C CB . ARG A 1 69 ? 6.19209 -7.25386 -4.98341 1.000 59.39285 ? 69 ARG A CB 1 ATOM 1325 C CG . ARG A 1 69 ? 6.70134 -7.82517 -3.66827 1.000 73.09158 ? 69 ARG A CG 1 ATOM 1326 C CD . ARG A 1 69 ? 6.25998 -9.24658 -3.46035 1.000 65.91525 ? 69 ARG A CD 1 ATOM 1327 N NE . ARG A 1 69 ? 4.89618 -9.28886 -2.95118 1.000 63.30614 ? 69 ARG A NE 1 ATOM 1328 C CZ . ARG A 1 69 ? 4.30711 -10.37261 -2.47067 1.000 63.95602 ? 69 ARG A CZ 1 ATOM 1329 N NH1 . ARG A 1 69 ? 4.96497 -11.51311 -2.33224 1.000 62.98271 ? 69 ARG A NH1 1 ATOM 1330 N NH2 . ARG A 1 69 ? 3.02833 -10.30743 -2.11122 1.000 59.08432 ? 69 ARG A NH2 1 ATOM 1331 H H . ARG A 1 69 ? 4.97503 -5.42142 -3.81735 1.000 72.15385 ? 69 ARG A H 1 ATOM 1332 H HA . ARG A 1 69 ? 7.39829 -5.59826 -4.91882 1.000 69.09437 ? 69 ARG A HA 1 ATOM 1333 H HB2 . ARG A 1 69 ? 5.23694 -7.41464 -5.03574 1.000 71.27142 ? 69 ARG A HB2 1 ATOM 1334 H HB3 . ARG A 1 69 ? 6.64556 -7.71000 -5.70950 1.000 71.27142 ? 69 ARG A HB3 1 ATOM 1335 H HG2 . ARG A 1 69 ? 7.67116 -7.80649 -3.66664 1.000 87.70989 ? 69 ARG A HG2 1 ATOM 1336 H HG3 . ARG A 1 69 ? 6.35802 -7.29166 -2.93451 1.000 87.70989 ? 69 ARG A HG3 1 ATOM 1337 H HD2 . ARG A 1 69 ? 6.28948 -9.72264 -4.30498 1.000 79.09830 ? 69 ARG A HD2 1 ATOM 1338 H HD3 . ARG A 1 69 ? 6.84383 -9.67702 -2.81635 1.000 79.09830 ? 69 ARG A HD3 1 ATOM 1339 H HE . ARG A 1 69 ? 4.44181 -8.55879 -2.96354 1.000 75.96737 ? 69 ARG A HE 1 ATOM 1340 H HH11 . ARG A 1 69 ? 5.79378 -11.56140 -2.55658 1.000 75.57926 ? 69 ARG A HH11 1 ATOM 1341 H HH12 . ARG A 1 69 ? 4.56349 -12.20568 -2.01797 1.000 75.57926 ? 69 ARG A HH12 1 ATOM 1342 H HH21 . ARG A 1 69 ? 2.59597 -9.56847 -2.19241 1.000 70.90118 ? 69 ARG A HH21 1 ATOM 1343 H HH22 . ARG A 1 69 ? 2.63378 -11.00426 -1.79760 1.000 70.90118 ? 69 ARG A HH22 1 ATOM 1344 N N . HIS A 1 70 ? 5.22358 -4.39200 -6.72400 1.000 57.34232 ? 70 HIS A N 1 ATOM 1345 C CA . HIS A 1 70 ? 5.02670 -3.85124 -8.06183 1.000 53.35613 ? 70 HIS A CA 1 ATOM 1346 C C . HIS A 1 70 ? 4.63108 -2.38985 -7.94496 1.000 57.63141 ? 70 HIS A C 1 ATOM 1347 O O . HIS A 1 70 ? 4.34850 -1.87890 -6.85686 1.000 52.29555 ? 70 HIS A O 1 ATOM 1348 C CB . HIS A 1 70 ? 4.02716 -4.69291 -8.87690 1.000 46.69298 ? 70 HIS A CB 1 ATOM 1349 C CG . HIS A 1 70 ? 2.62657 -4.72832 -8.34548 1.000 47.87913 ? 70 HIS A CG 1 ATOM 1350 N ND1 . HIS A 1 70 ? 1.57668 -5.22453 -9.09350 1.000 47.18890 ? 70 HIS A ND1 1 ATOM 1351 C CD2 . HIS A 1 70 ? 2.09697 -4.35180 -7.15636 1.000 50.30737 ? 70 HIS A CD2 1 ATOM 1352 C CE1 . HIS A 1 70 ? 0.46157 -5.14814 -8.38835 1.000 53.09733 ? 70 HIS A CE1 1 ATOM 1353 N NE2 . HIS A 1 70 ? 0.74893 -4.61747 -7.21167 1.000 51.46069 ? 70 HIS A NE2 1 ATOM 1354 H H . HIS A 1 70 ? 4.69138 -4.08452 -6.12248 1.000 68.81079 ? 70 HIS A H 1 ATOM 1355 H HA . HIS A 1 70 ? 5.85969 -3.87134 -8.55843 1.000 64.02736 ? 70 HIS A HA 1 ATOM 1356 H HB2 . HIS A 1 70 ? 3.98532 -4.33051 -9.77569 1.000 56.03158 ? 70 HIS A HB2 1 ATOM 1357 H HB3 . HIS A 1 70 ? 4.34885 -5.60766 -8.90267 1.000 56.03158 ? 70 HIS A HB3 1 ATOM 1358 H HD2 . HIS A 1 70 ? 2.55840 -3.98308 -6.43801 1.000 60.36884 ? 70 HIS A HD2 1 ATOM 1359 H HE1 . HIS A 1 70 ? -0.38128 -5.42097 -8.67132 1.000 63.71680 ? 70 HIS A HE1 1 ATOM 1360 H HE2 . HIS A 1 70 ? 0.18359 -4.46330 -6.58220 1.000 61.75283 ? 70 HIS A HE2 1 ATOM 1361 N N . THR A 1 71 ? 4.68968 -1.70142 -9.08047 1.000 50.70050 ? 71 THR A N 1 ATOM 1362 C CA . THR A 1 71 ? 4.49274 -0.26178 -9.13889 1.000 52.07265 ? 71 THR A CA 1 ATOM 1363 C C . THR A 1 71 ? 4.00426 0.08122 -10.54000 1.000 50.94002 ? 71 THR A C 1 ATOM 1364 O O . THR A 1 71 ? 3.82844 -0.80044 -11.38684 1.000 49.84974 ? 71 THR A O 1 ATOM 1365 C CB . THR A 1 71 ? 5.78151 0.48218 -8.77066 1.000 61.61623 ? 71 THR A CB 1 ATOM 1366 O OG1 . THR A 1 71 ? 5.50168 1.87519 -8.59027 1.000 64.52977 ? 71 THR A OG1 1 ATOM 1367 C CG2 . THR A 1 71 ? 6.84041 0.31652 -9.85080 1.000 59.06468 ? 71 THR A CG2 1 ATOM 1368 H H . THR A 1 71 ? 4.84609 -2.05621 -9.84811 1.000 60.84060 ? 71 THR A H 1 ATOM 1369 H HA . THR A 1 71 ? 3.80987 0.00612 -8.50422 1.000 62.48717 ? 71 THR A HA 1 ATOM 1370 H HB . THR A 1 71 ? 6.13398 0.11181 -7.94635 1.000 73.93948 ? 71 THR A HB 1 ATOM 1371 H HG1 . THR A 1 71 ? 6.20699 2.28678 -8.39347 1.000 77.43572 ? 71 THR A HG1 1 ATOM 1372 H HG21 . THR A 1 71 ? 7.70182 0.61498 -9.51946 1.000 70.87762 ? 71 THR A HG21 1 ATOM 1373 H HG22 . THR A 1 71 ? 6.90824 -0.61612 -10.10863 1.000 70.87762 ? 71 THR A HG22 1 ATOM 1374 H HG23 . THR A 1 71 ? 6.60377 0.84235 -10.63080 1.000 70.87762 ? 71 THR A HG23 1 ATOM 1375 N N . ASP A 1 72 ? 3.77312 1.36941 -10.77963 1.000 54.36505 ? 72 ASP A N 1 ATOM 1376 C CA . ASP A 1 72 ? 3.22010 1.83862 -12.04713 1.000 58.22621 ? 72 ASP A CA 1 ATOM 1377 C C . ASP A 1 72 ? 2.03951 0.97089 -12.48517 1.000 53.84864 ? 72 ASP A C 1 ATOM 1378 O O . ASP A 1 72 ? 2.01237 0.41431 -13.58339 1.000 49.82474 ? 72 ASP A O 1 ATOM 1379 C CB . ASP A 1 72 ? 4.29491 1.86965 -13.13807 1.000 61.79617 ? 72 ASP A CB 1 ATOM 1380 C CG . ASP A 1 72 ? 5.45870 2.77231 -12.79006 1.000 75.07978 ? 72 ASP A CG 1 ATOM 1381 O OD1 . ASP A 1 72 ? 5.33173 3.57596 -11.84322 1.000 93.61574 ? 72 ASP A OD1 1 ATOM 1382 O OD2 . ASP A 1 72 ? 6.49547 2.69413 -13.48236 1.000 86.92751 ? 72 ASP A OD2 1 ATOM 1383 H H . ASP A 1 72 ? 3.93055 1.99954 -10.21593 1.000 65.23806 ? 72 ASP A H 1 ATOM 1384 H HA . ASP A 1 72 ? 2.89478 2.74244 -11.91232 1.000 69.87145 ? 72 ASP A HA 1 ATOM 1385 H HB2 . ASP A 1 72 ? 4.63987 0.97231 -13.26721 1.000 74.15540 ? 72 ASP A HB2 1 ATOM 1386 H HB3 . ASP A 1 72 ? 3.89942 2.19481 -13.96194 1.000 74.15540 ? 72 ASP A HB3 1 ATOM 1387 N N A ILE A 1 73 ? 1.06972 0.83638 -11.57815 0.428 52.74436 ? 73 ILE A N 1 ATOM 1388 N N B ILE A 1 73 ? 1.04434 0.86747 -11.60811 0.572 52.73469 ? 73 ILE A N 1 ATOM 1389 C CA A ILE A 1 73 ? -0.13518 0.07941 -11.87573 0.428 49.14234 ? 73 ILE A CA 1 ATOM 1390 C CA B ILE A 1 73 ? -0.12005 0.02342 -11.87497 0.572 49.06157 ? 73 ILE A CA 1 ATOM 1391 C C A ILE A 1 73 ? -1.00894 0.88845 -12.81870 0.428 51.58865 ? 73 ILE A C 1 ATOM 1392 C C B ILE A 1 73 ? -1.12479 0.80427 -12.71455 0.572 51.52517 ? 73 ILE A C 1 ATOM 1393 O O A ILE A 1 73 ? -1.20103 2.09788 -12.63293 0.428 50.55539 ? 73 ILE A O 1 ATOM 1394 O O B ILE A 1 73 ? -1.53135 1.90919 -12.34164 0.572 50.29759 ? 73 ILE A O 1 ATOM 1395 C CB A ILE A 1 73 ? -0.89450 -0.25568 -10.57774 0.428 53.08428 ? 73 ILE A CB 1 ATOM 1396 C CB B ILE A 1 73 ? -0.75390 -0.45420 -10.55623 0.572 53.27940 ? 73 ILE A CB 1 ATOM 1397 C CG1 A ILE A 1 73 ? -0.18476 -1.37762 -9.82110 0.428 52.60773 ? 73 ILE A CG1 1 ATOM 1398 C CG1 B ILE A 1 73 ? 0.28889 -1.16826 -9.68850 0.572 53.27340 ? 73 ILE A CG1 1 ATOM 1399 C CG2 A ILE A 1 73 ? -2.33344 -0.65113 -10.88993 0.428 50.47030 ? 73 ILE A CG2 1 ATOM 1400 C CG2 B ILE A 1 73 ? -1.93617 -1.37108 -10.83941 0.572 51.27852 ? 73 ILE A CG2 1 ATOM 1401 C CD1 A ILE A 1 73 ? 1.13084 -0.95847 -9.20518 0.428 55.21988 ? 73 ILE A CD1 1 ATOM 1402 C CD1 B ILE A 1 73 ? -0.15781 -1.41777 -8.24989 0.572 54.78797 ? 73 ILE A CD1 1 ATOM 1403 H H A ILE A 1 73 ? 1.08951 1.17417 -10.78751 0.428 63.29323 ? 73 ILE A H 1 ATOM 1404 H H B ILE A 1 73 ? 1.01849 1.27521 -10.85136 0.572 63.28163 ? 73 ILE A H 1 ATOM 1405 H HA A ILE A 1 73 ? 0.10955 -0.75407 -12.30737 0.428 58.97081 ? 73 ILE A HA 1 ATOM 1406 H HA B ILE A 1 73 ? 0.16066 -0.75392 -12.38275 0.572 58.87388 ? 73 ILE A HA 1 ATOM 1407 H HB A ILE A 1 73 ? -0.90588 0.53583 -10.01713 0.428 63.70113 ? 73 ILE A HB 1 ATOM 1408 H HB B ILE A 1 73 ? -1.07459 0.32188 -10.07069 0.572 63.93528 ? 73 ILE A HB 1 ATOM 1409 H HG12 A ILE A 1 73 ? -0.76240 -1.68510 -9.10508 0.428 63.12928 ? 73 ILE A HG12 1 ATOM 1410 H HG12 B ILE A 1 73 ? 0.48762 -2.02944 -10.08822 0.572 63.92808 ? 73 ILE A HG12 1 ATOM 1411 H HG13 A ILE A 1 73 ? -0.00491 -2.10458 -10.43762 0.428 63.12928 ? 73 ILE A HG13 1 ATOM 1412 H HG13 B ILE A 1 73 ? 1.09121 -0.62402 -9.65705 0.572 63.92808 ? 73 ILE A HG13 1 ATOM 1413 H HG21 A ILE A 1 73 ? -2.70382 -1.12279 -10.12753 0.428 60.56436 ? 73 ILE A HG21 1 ATOM 1414 H HG21 B ILE A 1 73 ? -2.24157 -1.75954 -10.00471 0.572 61.53423 ? 73 ILE A HG21 1 ATOM 1415 H HG22 A ILE A 1 73 ? -2.85023 0.15067 -11.06581 0.428 60.56436 ? 73 ILE A HG22 1 ATOM 1416 H HG22 B ILE A 1 73 ? -2.64910 -0.85163 -11.24291 0.572 61.53423 ? 73 ILE A HG22 1 ATOM 1417 H HG23 A ILE A 1 73 ? -2.34043 -1.22702 -11.67044 0.428 60.56436 ? 73 ILE A HG23 1 ATOM 1418 H HG23 B ILE A 1 73 ? -1.65343 -2.07252 -11.44681 0.572 61.53423 ? 73 ILE A HG23 1 ATOM 1419 H HD11 A ILE A 1 73 ? 1.25047 -1.42891 -8.36537 0.428 66.26385 ? 73 ILE A HD11 1 ATOM 1420 H HD11 B ILE A 1 73 ? 0.59166 -1.76674 -7.74252 0.572 65.74556 ? 73 ILE A HD11 1 ATOM 1421 H HD12 A ILE A 1 73 ? 1.85082 -1.18259 -9.81534 0.428 66.26385 ? 73 ILE A HD12 1 ATOM 1422 H HD12 B ILE A 1 73 ? -0.45817 -0.58062 -7.86278 0.572 65.74556 ? 73 ILE A HD12 1 ATOM 1423 H HD13 A ILE A 1 73 ? 1.11562 -0.00127 -9.04887 0.428 66.26385 ? 73 ILE A HD13 1 ATOM 1424 H HD13 B ILE A 1 73 ? -0.88407 -2.06076 -8.25174 0.572 65.74556 ? 73 ILE A HD13 1 ATOM 1425 N N . LEU A 1 74 ? -1.53891 0.23063 -13.84639 1.000 52.39980 ? 74 LEU A N 1 ATOM 1426 C CA . LEU A 1 74 ? -2.49701 0.86998 -14.74817 1.000 48.85890 ? 74 LEU A CA 1 ATOM 1427 C C . LEU A 1 74 ? -3.63763 -0.09178 -15.04331 1.000 47.12590 ? 74 LEU A C 1 ATOM 1428 O O . LEU A 1 74 ? -3.41913 -1.17643 -15.59039 1.000 45.40919 ? 74 LEU A O 1 ATOM 1429 C CB . LEU A 1 74 ? -1.83518 1.31922 -16.05418 1.000 49.85034 ? 74 LEU A CB 1 ATOM 1430 C CG . LEU A 1 74 ? -2.80347 1.97723 -17.03766 1.000 52.27076 ? 74 LEU A CG 1 ATOM 1431 C CD1 . LEU A 1 74 ? -3.34334 3.28581 -16.46143 1.000 59.10166 ? 74 LEU A CD1 1 ATOM 1432 C CD2 . LEU A 1 74 ? -2.11232 2.22142 -18.38414 1.000 57.59953 ? 74 LEU A CD2 1 ATOM 1433 H H A LEU A 1 74 ? -1.36002 -0.58720 -14.04324 0.428 62.87976 ? 74 LEU A H 1 ATOM 1434 H H B LEU A 1 74 ? -1.27401 -0.54155 -14.11689 0.572 62.87976 ? 74 LEU A H 1 ATOM 1435 H HA . LEU A 1 74 ? -2.86272 1.64979 -14.30202 1.000 58.63068 ? 74 LEU A HA 1 ATOM 1436 H HB2 . LEU A 1 74 ? -1.13998 1.96282 -15.84589 1.000 59.82041 ? 74 LEU A HB2 1 ATOM 1437 H HB3 . LEU A 1 74 ? -1.44933 0.54372 -16.49079 1.000 59.82041 ? 74 LEU A HB3 1 ATOM 1438 H HG . LEU A 1 74 ? -3.55612 1.38442 -17.18926 1.000 62.72491 ? 74 LEU A HG 1 ATOM 1439 H HD11 . LEU A 1 74 ? -3.84399 3.75117 -17.14968 1.000 70.92199 ? 74 LEU A HD11 1 ATOM 1440 H HD12 . LEU A 1 74 ? -3.92262 3.08470 -15.70984 1.000 70.92199 ? 74 LEU A HD12 1 ATOM 1441 H HD13 . LEU A 1 74 ? -2.59806 3.83273 -16.16758 1.000 70.92199 ? 74 LEU A HD13 1 ATOM 1442 H HD21 . LEU A 1 74 ? -2.74725 2.62503 -18.99641 1.000 69.11944 ? 74 LEU A HD21 1 ATOM 1443 H HD22 . LEU A 1 74 ? -1.35877 2.81705 -18.24889 1.000 69.11944 ? 74 LEU A HD22 1 ATOM 1444 H HD23 . LEU A 1 74 ? -1.80385 1.37309 -18.73921 1.000 69.11944 ? 74 LEU A HD23 1 ATOM 1445 N N . CYS A 1 75 ? -4.85327 0.31248 -14.69265 1.000 49.77449 ? 75 CYS A N 1 ATOM 1446 C CA . CYS A 1 75 ? -6.03898 -0.46914 -15.01455 1.000 48.80325 ? 75 CYS A CA 1 ATOM 1447 C C . CYS A 1 75 ? -6.39969 -0.23010 -16.47801 1.000 49.18226 ? 75 CYS A C 1 ATOM 1448 O O . CYS A 1 75 ? -6.67096 0.90657 -16.87546 1.000 50.06623 ? 75 CYS A O 1 ATOM 1449 C CB . CYS A 1 75 ? -7.19822 -0.08421 -14.09859 1.000 54.69592 ? 75 CYS A CB 1 ATOM 1450 S SG . CYS A 1 75 ? -8.75536 -0.96824 -14.47057 1.000 58.59511 ? 75 CYS A SG 1 ATOM 1451 H H . CYS A 1 75 ? -5.01813 1.04026 -14.26516 1.000 59.72938 ? 75 CYS A H 1 ATOM 1452 H HA . CYS A 1 75 ? -5.85876 -1.41322 -14.88366 1.000 58.56390 ? 75 CYS A HA 1 ATOM 1453 H HB2 . CYS A 1 75 ? -6.95298 -0.28863 -13.18264 1.000 65.63511 ? 75 CYS A HB2 1 ATOM 1454 H HB3 . CYS A 1 75 ? -7.36742 0.86629 -14.19249 1.000 65.63511 ? 75 CYS A HB3 1 ATOM 1455 H HG . CYS A 1 75 ? -9.60375 -0.60477 -13.70368 1.000 70.31413 ? 75 CYS A HG 1 ATOM 1456 N N . LEU A 1 76 ? -6.39584 -1.29945 -17.27981 1.000 50.87026 ? 76 LEU A N 1 ATOM 1457 C CA . LEU A 1 76 ? -6.68011 -1.18450 -18.70690 1.000 45.85497 ? 76 LEU A CA 1 ATOM 1458 C C . LEU A 1 76 ? -8.15716 -1.34808 -19.02540 1.000 52.30715 ? 76 LEU A C 1 ATOM 1459 O O . LEU A 1 76 ? -8.63029 -0.81253 -20.03523 1.000 53.90838 ? 76 LEU A O 1 ATOM 1460 C CB . LEU A 1 76 ? -5.89970 -2.24525 -19.49366 1.000 52.37757 ? 76 LEU A CB 1 ATOM 1461 C CG . LEU A 1 76 ? -4.36997 -2.21665 -19.45980 1.000 60.49058 ? 76 LEU A CG 1 ATOM 1462 C CD1 . LEU A 1 76 ? -3.80060 -3.46913 -20.11745 1.000 62.40245 ? 76 LEU A CD1 1 ATOM 1463 C CD2 . LEU A 1 76 ? -3.82548 -0.97735 -20.14334 1.000 61.20022 ? 76 LEU A CD2 1 ATOM 1464 H H . LEU A 1 76 ? -6.23103 -2.10198 -17.01833 1.000 61.04431 ? 76 LEU A H 1 ATOM 1465 H HA . LEU A 1 76 ? -6.39230 -0.30666 -19.00262 1.000 55.02596 ? 76 LEU A HA 1 ATOM 1466 H HB2 . LEU A 1 76 ? -6.16543 -3.11374 -19.15305 1.000 62.85309 ? 76 LEU A HB2 1 ATOM 1467 H HB3 . LEU A 1 76 ? -6.15505 -2.16214 -20.42575 1.000 62.85309 ? 76 LEU A HB3 1 ATOM 1468 H HG . LEU A 1 76 ? -4.08567 -2.19309 -18.53270 1.000 72.58870 ? 76 LEU A HG 1 ATOM 1469 H HD11 . LEU A 1 76 ? -2.84254 -3.36181 -20.22466 1.000 74.88294 ? 76 LEU A HD11 1 ATOM 1470 H HD12 . LEU A 1 76 ? -3.98643 -4.23502 -19.55195 1.000 74.88294 ? 76 LEU A HD12 1 ATOM 1471 H HD13 . LEU A 1 76 ? -4.21912 -3.58871 -20.98431 1.000 74.88294 ? 76 LEU A HD13 1 ATOM 1472 H HD21 . LEU A 1 76 ? -2.85651 -0.99375 -20.10182 1.000 73.44026 ? 76 LEU A HD21 1 ATOM 1473 H HD22 . LEU A 1 76 ? -4.11689 -0.97319 -21.06853 1.000 73.44026 ? 76 LEU A HD22 1 ATOM 1474 H HD23 . LEU A 1 76 ? -4.16287 -0.19086 -19.68674 1.000 73.44026 ? 76 LEU A HD23 1 ATOM 1475 N N . LYS A 1 77 ? -8.89437 -2.08400 -18.19417 1.000 45.57167 ? 77 LYS A N 1 ATOM 1476 C CA . LYS A 1 77 ? -10.28515 -2.38339 -18.50204 1.000 46.56448 ? 77 LYS A CA 1 ATOM 1477 C C . LYS A 1 77 ? -11.02010 -2.69339 -17.20879 1.000 55.36505 ? 77 LYS A C 1 ATOM 1478 O O . LYS A 1 77 ? -10.53093 -3.46744 -16.38106 1.000 51.68685 ? 77 LYS A O 1 ATOM 1479 C CB . LYS A 1 77 ? -10.37098 -3.55570 -19.48618 1.000 53.38101 ? 77 LYS A CB 1 ATOM 1480 C CG . LYS A 1 77 ? -11.55606 -3.50031 -20.43727 1.000 64.29877 ? 77 LYS A CG 1 ATOM 1481 C CD . LYS A 1 77 ? -11.71668 -4.80321 -21.21738 1.000 65.67407 ? 77 LYS A CD 1 ATOM 1482 C CE . LYS A 1 77 ? -13.15594 -5.01512 -21.65938 1.000 106.06783 ? 77 LYS A CE 1 ATOM 1483 N NZ . LYS A 1 77 ? -13.27575 -5.84701 -22.89032 1.000 107.57229 ? 77 LYS A NZ 1 ATOM 1484 H H . LYS A 1 77 ? -8.61187 -2.41695 -17.45326 1.000 54.68600 ? 77 LYS A H 1 ATOM 1485 H HA . LYS A 1 77 ? -10.71469 -1.61233 -18.90435 1.000 55.87738 ? 77 LYS A HA 1 ATOM 1486 H HB2 . LYS A 1 77 ? -9.56426 -3.56580 -20.02470 1.000 64.05722 ? 77 LYS A HB2 1 ATOM 1487 H HB3 . LYS A 1 77 ? -10.44158 -4.37948 -18.97893 1.000 64.05722 ? 77 LYS A HB3 1 ATOM 1488 H HG2 . LYS A 1 77 ? -12.36807 -3.34852 -19.92884 1.000 77.15853 ? 77 LYS A HG2 1 ATOM 1489 H HG3 . LYS A 1 77 ? -11.42319 -2.77990 -21.07307 1.000 77.15853 ? 77 LYS A HG3 1 ATOM 1490 H HD2 . LYS A 1 77 ? -11.15597 -4.77516 -22.00840 1.000 78.80889 ? 77 LYS A HD2 1 ATOM 1491 H HD3 . LYS A 1 77 ? -11.45807 -5.54905 -20.65369 1.000 78.80889 ? 77 LYS A HD3 1 ATOM 1492 H HE2 . LYS A 1 77 ? -13.64056 -5.46336 -20.94865 1.000 127.28140 ? 77 LYS A HE2 1 ATOM 1493 H HE3 . LYS A 1 77 ? -13.55904 -4.15211 -21.84274 1.000 127.28140 ? 77 LYS A HE3 1 ATOM 1494 H HZ1 . LYS A 1 77 ? -14.13306 -5.94945 -23.10623 1.000 129.08675 ? 77 LYS A HZ1 1 ATOM 1495 H HZ2 . LYS A 1 77 ? -12.85270 -5.45249 -23.56670 1.000 129.08675 ? 77 LYS A HZ2 1 ATOM 1496 H HZ3 . LYS A 1 77 ? -12.91489 -6.64876 -22.75219 1.000 129.08675 ? 77 LYS A HZ3 1 ATOM 1497 N N . SER A 1 78 ? -12.18533 -2.07422 -17.03847 1.000 53.56616 ? 78 SER A N 1 ATOM 1498 C CA . SER A 1 78 ? -13.04493 -2.30540 -15.88321 1.000 64.01050 ? 78 SER A CA 1 ATOM 1499 C C . SER A 1 78 ? -14.43340 -2.62714 -16.41526 1.000 66.79841 ? 78 SER A C 1 ATOM 1500 O O . SER A 1 78 ? -15.13806 -1.73407 -16.88935 1.000 63.20973 ? 78 SER A O 1 ATOM 1501 C CB . SER A 1 78 ? -13.07516 -1.08648 -14.96059 1.000 63.47502 ? 78 SER A CB 1 ATOM 1502 O OG . SER A 1 78 ? -13.86930 -1.33057 -13.81104 1.000 77.83266 ? 78 SER A OG 1 ATOM 1503 H H . SER A 1 78 ? -12.50664 -1.50125 -17.59351 1.000 64.27940 ? 78 SER A H 1 ATOM 1504 H HA . SER A 1 78 ? -12.71894 -3.05955 -15.36756 1.000 76.81260 ? 78 SER A HA 1 ATOM 1505 H HB2 . SER A 1 78 ? -12.16943 -0.88316 -14.67915 1.000 76.17003 ? 78 SER A HB2 1 ATOM 1506 H HB3 . SER A 1 78 ? -13.44843 -0.33430 -15.44617 1.000 76.17003 ? 78 SER A HB3 1 ATOM 1507 H HG . SER A 1 78 ? -13.88026 -0.64947 -13.31952 1.000 93.39919 ? 78 SER A HG 1 ATOM 1508 N N . GLU A 1 79 ? -14.82061 -3.89593 -16.34916 1.000 53.51109 ? 79 GLU A N 1 ATOM 1509 C CA . GLU A 1 79 ? -16.11612 -4.34393 -16.83875 1.000 57.86505 ? 79 GLU A CA 1 ATOM 1510 C C . GLU A 1 79 ? -17.06589 -4.53491 -15.66602 1.000 65.17423 ? 79 GLU A C 1 ATOM 1511 O O . GLU A 1 79 ? -16.73951 -5.23193 -14.69986 1.000 57.54814 ? 79 GLU A O 1 ATOM 1512 C CB . GLU A 1 79 ? -15.98609 -5.65348 -17.61680 1.000 66.04135 ? 79 GLU A CB 1 ATOM 1513 C CG . GLU A 1 79 ? -14.90026 -5.63486 -18.67088 1.000 58.86966 ? 79 GLU A CG 1 ATOM 1514 C CD . GLU A 1 79 ? -14.62010 -7.00994 -19.25170 1.000 66.18581 ? 79 GLU A CD 1 ATOM 1515 O OE1 . GLU A 1 79 ? -15.46198 -7.51972 -20.02020 1.000 69.93057 ? 79 GLU A OE1 1 ATOM 1516 O OE2 . GLU A 1 79 ? -13.54379 -7.56790 -18.95498 1.000 61.48571 ? 79 GLU A OE2 1 ATOM 1517 H H . GLU A 1 79 ? -14.33978 -4.52744 -16.01810 1.000 64.21330 ? 79 GLU A H 1 ATOM 1518 H HA . GLU A 1 79 ? -16.48319 -3.66924 -17.43116 1.000 69.43806 ? 79 GLU A HA 1 ATOM 1519 H HB2 . GLU A 1 79 ? -15.78019 -6.36711 -16.99290 1.000 79.24962 ? 79 GLU A HB2 1 ATOM 1520 H HB3 . GLU A 1 79 ? -16.82800 -5.83544 -18.06288 1.000 79.24962 ? 79 GLU A HB3 1 ATOM 1521 H HG2 . GLU A 1 79 ? -15.17468 -5.05305 -19.39688 1.000 70.64360 ? 79 GLU A HG2 1 ATOM 1522 H HG3 . GLU A 1 79 ? -14.07951 -5.30457 -18.27316 1.000 70.64360 ? 79 GLU A HG3 1 ATOM 1523 N N . VAL A 1 80 ? -18.23437 -3.91702 -15.75562 1.000 65.14998 ? 80 VAL A N 1 ATOM 1524 C CA . VAL A 1 80 ? -19.28862 -4.08778 -14.76959 1.000 69.95727 ? 80 VAL A CA 1 ATOM 1525 C C . VAL A 1 80 ? -20.49073 -4.68253 -15.48824 1.000 77.21918 ? 80 VAL A C 1 ATOM 1526 O O . VAL A 1 80 ? -20.61422 -4.60604 -16.71318 1.000 84.68454 ? 80 VAL A O 1 ATOM 1527 C CB . VAL A 1 80 ? -19.63612 -2.76167 -14.06520 1.000 79.81980 ? 80 VAL A CB 1 ATOM 1528 C CG1 . VAL A 1 80 ? -18.35907 -2.06742 -13.59712 1.000 72.20504 ? 80 VAL A CG1 1 ATOM 1529 C CG2 . VAL A 1 80 ? -20.40050 -1.83600 -14.99343 1.000 74.58102 ? 80 VAL A CG2 1 ATOM 1530 H H . VAL A 1 80 ? -18.44495 -3.38082 -16.39417 1.000 78.17998 ? 80 VAL A H 1 ATOM 1531 H HA . VAL A 1 80 ? -19.01322 -4.71121 -14.07938 1.000 83.94873 ? 80 VAL A HA 1 ATOM 1532 H HB . VAL A 1 80 ? -20.19650 -2.96031 -13.29877 1.000 95.78375 ? 80 VAL A HB 1 ATOM 1533 H HG11 . VAL A 1 80 ? -18.59506 -1.23739 -13.15410 1.000 86.64605 ? 80 VAL A HG11 1 ATOM 1534 H HG12 . VAL A 1 80 ? -17.89085 -2.65056 -12.97937 1.000 86.64605 ? 80 VAL A HG12 1 ATOM 1535 H HG13 . VAL A 1 80 ? -17.79902 -1.88358 -14.36747 1.000 86.64605 ? 80 VAL A HG13 1 ATOM 1536 H HG21 . VAL A 1 80 ? -20.59445 -1.00893 -14.52520 1.000 89.49723 ? 80 VAL A HG21 1 ATOM 1537 H HG22 . VAL A 1 80 ? -19.85665 -1.65358 -15.77564 1.000 89.49723 ? 80 VAL A HG22 1 ATOM 1538 H HG23 . VAL A 1 80 ? -21.22762 -2.26757 -15.25897 1.000 89.49723 ? 80 VAL A HG23 1 ATOM 1539 N N . GLU A 1 81 ? -21.37353 -5.30568 -14.71531 1.000 84.94084 ? 81 GLU A N 1 ATOM 1540 C CA . GLU A 1 81 ? -22.52107 -5.99789 -15.29220 1.000 90.58211 ? 81 GLU A CA 1 ATOM 1541 C C . GLU A 1 81 ? -22.06691 -7.19879 -16.12380 1.000 93.59514 ? 81 GLU A C 1 ATOM 1542 O O . GLU A 1 81 ? -22.64360 -7.50138 -17.16833 1.000 99.14454 ? 81 GLU A O 1 ATOM 1543 C CB . GLU A 1 81 ? -23.36364 -5.03583 -16.13560 1.000 102.33807 ? 81 GLU A CB 1 ATOM 1544 C CG . GLU A 1 81 ? -24.82374 -5.42119 -16.28281 1.000 112.11280 ? 81 GLU A CG 1 ATOM 1545 C CD . GLU A 1 81 ? -25.65372 -4.31296 -16.90718 1.000 132.15155 ? 81 GLU A CD 1 ATOM 1546 O OE1 . GLU A 1 81 ? -25.26987 -3.81815 -17.98934 1.000 142.39259 ? 81 GLU A OE1 1 ATOM 1547 O OE2 . GLU A 1 81 ? -26.69257 -3.94270 -16.31948 1.000 120.04677 ? 81 GLU A OE2 1 ATOM 1548 H H . GLU A 1 81 ? -21.32997 -5.34171 -13.85717 1.000 101.92901 ? 81 GLU A H 1 ATOM 1549 H HA . GLU A 1 81 ? -23.08155 -6.33791 -14.57725 1.000 108.69853 ? 81 GLU A HA 1 ATOM 1550 H HB2 . GLU A 1 81 ? -23.33473 -4.15906 -15.72166 1.000 122.80568 ? 81 GLU A HB2 1 ATOM 1551 H HB3 . GLU A 1 81 ? -22.98260 -4.99473 -17.02668 1.000 122.80568 ? 81 GLU A HB3 1 ATOM 1552 H HG2 . GLU A 1 81 ? -24.88979 -6.20433 -16.85134 1.000 134.53537 ? 81 GLU A HG2 1 ATOM 1553 H HG3 . GLU A 1 81 ? -25.19085 -5.61565 -15.40627 1.000 134.53537 ? 81 GLU A HG3 1 ATOM 1554 N N . VAL A 1 82 ? -21.01418 -7.87917 -15.66740 1.000 76.63369 ? 82 VAL A N 1 ATOM 1555 C CA . VAL A 1 82 ? -20.56190 -9.10699 -16.31322 1.000 87.77762 ? 82 VAL A CA 1 ATOM 1556 C C . VAL A 1 82 ? -21.46743 -10.24907 -15.87117 1.000 93.88610 ? 82 VAL A C 1 ATOM 1557 O O . VAL A 1 82 ? -21.85010 -10.34091 -14.69740 1.000 89.33960 ? 82 VAL A O 1 ATOM 1558 C CB . VAL A 1 82 ? -19.08756 -9.39118 -15.97441 1.000 82.78580 ? 82 VAL A CB 1 ATOM 1559 C CG1 . VAL A 1 82 ? -18.65913 -10.74903 -16.51968 1.000 84.84862 ? 82 VAL A CG1 1 ATOM 1560 C CG2 . VAL A 1 82 ? -18.18946 -8.29402 -16.52844 1.000 76.54929 ? 82 VAL A CG2 1 ATOM 1561 H H . VAL A 1 82 ? -20.54579 -7.64825 -14.98410 1.000 91.96043 ? 82 VAL A H 1 ATOM 1562 H HA . VAL A 1 82 ? -20.62847 -9.00924 -17.27598 1.000 105.33314 ? 82 VAL A HA 1 ATOM 1563 H HB . VAL A 1 82 ? -18.99197 -9.40759 -15.00927 1.000 99.34296 ? 82 VAL A HB 1 ATOM 1564 H HG11 . VAL A 1 82 ? -17.69205 -10.81383 -16.48152 1.000 101.81834 ? 82 VAL A HG11 1 ATOM 1565 H HG12 . VAL A 1 82 ? -19.05907 -11.44732 -15.97806 1.000 101.81834 ? 82 VAL A HG12 1 ATOM 1566 H HG13 . VAL A 1 82 ? -18.96007 -10.82970 -17.43828 1.000 101.81834 ? 82 VAL A HG13 1 ATOM 1567 H HG21 . VAL A 1 82 ? -17.26743 -8.49923 -16.30788 1.000 91.85915 ? 82 VAL A HG21 1 ATOM 1568 H HG22 . VAL A 1 82 ? -18.29802 -8.25331 -17.49148 1.000 91.85915 ? 82 VAL A HG22 1 ATOM 1569 H HG23 . VAL A 1 82 ? -18.44399 -7.44670 -16.13076 1.000 91.85915 ? 82 VAL A HG23 1 ATOM 1570 N N . GLN A 1 83 ? -21.81234 -11.12978 -16.81309 1.000 94.45986 ? 83 GLN A N 1 ATOM 1571 C CA . GLN A 1 83 ? -22.78864 -12.18552 -16.57005 1.000 99.19923 ? 83 GLN A CA 1 ATOM 1572 C C . GLN A 1 83 ? -22.21487 -13.58333 -16.76849 1.000 101.20537 ? 83 GLN A C 1 ATOM 1573 O O . GLN A 1 83 ? -22.96784 -14.56429 -16.71223 1.000 99.33660 ? 83 GLN A O 1 ATOM 1574 C CB . GLN A 1 83 ? -24.01451 -11.99143 -17.47759 1.000 98.63676 ? 83 GLN A CB 1 ATOM 1575 C CG . GLN A 1 83 ? -23.82550 -12.37879 -18.95285 1.000 120.03991 ? 83 GLN A CG 1 ATOM 1576 C CD . GLN A 1 83 ? -22.74244 -11.58056 -19.66458 1.000 127.83540 ? 83 GLN A CD 1 ATOM 1577 O OE1 . GLN A 1 83 ? -21.69178 -11.28596 -19.09417 1.000 107.85062 ? 83 GLN A OE1 1 ATOM 1578 N NE2 . GLN A 1 83 ? -22.99572 -11.23183 -20.92228 1.000 130.79692 ? 83 GLN A NE2 1 ATOM 1579 H H . GLN A 1 83 ? -21.48879 -11.13374 -17.60990 1.000 113.35184 ? 83 GLN A H 1 ATOM 1580 H HA . GLN A 1 83 ? -23.08025 -12.12185 -15.64712 1.000 119.03907 ? 83 GLN A HA 1 ATOM 1581 H HB2 . GLN A 1 83 ? -24.73911 -12.53397 -17.12901 1.000 118.36412 ? 83 GLN A HB2 1 ATOM 1582 H HB3 . GLN A 1 83 ? -24.26228 -11.05384 -17.45655 1.000 118.36412 ? 83 GLN A HB3 1 ATOM 1583 H HG2 . GLN A 1 83 ? -23.58083 -13.31623 -19.00033 1.000 144.04789 ? 83 GLN A HG2 1 ATOM 1584 H HG3 . GLN A 1 83 ? -24.66016 -12.22949 -19.42396 1.000 144.04789 ? 83 GLN A HG3 1 ATOM 1585 H HE21 . GLN A 1 83 ? -23.73959 -11.45813 -21.28977 1.000 156.95631 ? 83 GLN A HE21 1 ATOM 1586 H HE22 . GLN A 1 83 ? -22.41569 -10.77994 -21.36834 1.000 156.95631 ? 83 GLN A HE22 1 ATOM 1587 N N . GLU A 1 84 ? -20.90767 -13.70747 -16.98881 1.000 101.69907 ? 84 GLU A N 1 ATOM 1588 C CA . GLU A 1 84 ? -20.30809 -15.00386 -17.28511 1.000 93.51003 ? 84 GLU A CA 1 ATOM 1589 C C . GLU A 1 84 ? -18.81320 -14.92283 -17.01666 1.000 92.60413 ? 84 GLU A C 1 ATOM 1590 O O . GLU A 1 84 ? -18.14012 -14.01674 -17.51692 1.000 86.65598 ? 84 GLU A O 1 ATOM 1591 C CB . GLU A 1 84 ? -20.60061 -15.40019 -18.74115 1.000 113.51475 ? 84 GLU A CB 1 ATOM 1592 C CG . GLU A 1 84 ? -19.88814 -16.64606 -19.25363 1.000 129.10503 ? 84 GLU A CG 1 ATOM 1593 C CD . GLU A 1 84 ? -19.77795 -16.67054 -20.77280 1.000 149.05344 ? 84 GLU A CD 1 ATOM 1594 O OE1 . GLU A 1 84 ? -19.51103 -17.75526 -21.33132 1.000 152.48525 ? 84 GLU A OE1 1 ATOM 1595 O OE2 . GLU A 1 84 ? -19.96304 -15.60932 -21.40902 1.000 134.33858 ? 84 GLU A OE2 1 ATOM 1596 H H . GLU A 1 84 ? -20.34739 -13.05523 -16.97212 1.000 122.03888 ? 84 GLU A H 1 ATOM 1597 H HA . GLU A 1 84 ? -20.67041 -15.69015 -16.70319 1.000 112.21203 ? 84 GLU A HA 1 ATOM 1598 H HB2 . GLU A 1 84 ? -21.55352 -15.56067 -18.82543 1.000 136.21770 ? 84 GLU A HB2 1 ATOM 1599 H HB3 . GLU A 1 84 ? -20.33628 -14.66352 -19.31417 1.000 136.21770 ? 84 GLU A HB3 1 ATOM 1600 H HG2 . GLU A 1 84 ? -18.99081 -16.67202 -18.88617 1.000 154.92604 ? 84 GLU A HG2 1 ATOM 1601 H HG3 . GLU A 1 84 ? -20.38363 -17.43201 -18.97495 1.000 154.92604 ? 84 GLU A HG3 1 ATOM 1602 N N . ARG A 1 85 ? -18.30337 -15.86404 -16.22323 1.000 82.12494 ? 85 ARG A N 1 ATOM 1603 C CA . ARG A 1 85 ? -16.88871 -15.86836 -15.87903 1.000 73.37957 ? 85 ARG A CA 1 ATOM 1604 C C . ARG A 1 85 ? -16.04676 -16.33354 -17.05746 1.000 69.10212 ? 85 ARG A C 1 ATOM 1605 O O . ARG A 1 85 ? -16.44391 -17.22290 -17.81582 1.000 71.49274 ? 85 ARG A O 1 ATOM 1606 C CB . ARG A 1 85 ? -16.62408 -16.78391 -14.68302 1.000 72.37523 ? 85 ARG A CB 1 ATOM 1607 C CG . ARG A 1 85 ? -16.81817 -16.13070 -13.33202 1.000 76.22768 ? 85 ARG A CG 1 ATOM 1608 C CD . ARG A 1 85 ? -16.61776 -17.12953 -12.20371 1.000 71.76028 ? 85 ARG A CD 1 ATOM 1609 N NE . ARG A 1 85 ? -17.38610 -16.75343 -11.02519 1.000 73.35328 ? 85 ARG A NE 1 ATOM 1610 C CZ . ARG A 1 85 ? -16.92863 -15.99210 -10.04114 1.000 70.75490 ? 85 ARG A CZ 1 ATOM 1611 N NH1 . ARG A 1 85 ? -15.69077 -15.52574 -10.04523 1.000 65.79895 ? 85 ARG A NH1 1 ATOM 1612 N NH2 . ARG A 1 85 ? -17.73634 -15.68737 -9.02935 1.000 71.55565 ? 85 ARG A NH2 1 ATOM 1613 H H . ARG A 1 85 ? -18.75524 -16.50709 -15.87409 1.000 98.54993 ? 85 ARG A H 1 ATOM 1614 H HA . ARG A 1 85 ? -16.62651 -14.96500 -15.64219 1.000 88.05548 ? 85 ARG A HA 1 ATOM 1615 H HB2 . ARG A 1 85 ? -17.23120 -17.53879 -14.73249 1.000 86.85027 ? 85 ARG A HB2 1 ATOM 1616 H HB3 . ARG A 1 85 ? -15.70582 -17.09312 -14.72883 1.000 86.85027 ? 85 ARG A HB3 1 ATOM 1617 H HG2 . ARG A 1 85 ? -16.17303 -15.41434 -13.22469 1.000 91.47321 ? 85 ARG A HG2 1 ATOM 1618 H HG3 . ARG A 1 85 ? -17.71947 -15.77733 -13.27135 1.000 91.47321 ? 85 ARG A HG3 1 ATOM 1619 H HD2 . ARG A 1 85 ? -16.91197 -18.00705 -12.49406 1.000 86.11233 ? 85 ARG A HD2 1 ATOM 1620 H HD3 . ARG A 1 85 ? -15.67898 -17.15778 -11.96124 1.000 86.11233 ? 85 ARG A HD3 1 ATOM 1621 H HE . ARG A 1 85 ? -18.19261 -17.04551 -10.96333 1.000 88.02394 ? 85 ARG A HE 1 ATOM 1622 H HH11 . ARG A 1 85 ? -15.16217 -15.71486 -10.69670 1.000 78.95874 ? 85 ARG A HH11 1 ATOM 1623 H HH12 . ARG A 1 85 ? -15.41460 -15.03341 -9.39643 1.000 78.95874 ? 85 ARG A HH12 1 ATOM 1624 H HH21 . ARG A 1 85 ? -18.54371 -15.98344 -9.01946 1.000 85.86679 ? 85 ARG A HH21 1 ATOM 1625 H HH22 . ARG A 1 85 ? -17.45124 -15.19427 -8.38502 1.000 85.86679 ? 85 ARG A HH22 1 ATOM 1626 N N A MET A 1 86 ? -14.88010 -15.70755 -17.20562 0.610 67.76579 ? 86 MET A N 1 ATOM 1627 N N B MET A 1 86 ? -14.86393 -15.73783 -17.20602 0.390 67.78257 ? 86 MET A N 1 ATOM 1628 C CA A MET A 1 86 ? -13.91497 -16.10057 -18.22217 0.610 66.86752 ? 86 MET A CA 1 ATOM 1629 C CA B MET A 1 86 ? -13.94616 -16.14386 -18.26228 0.390 66.87905 ? 86 MET A CA 1 ATOM 1630 C C A MET A 1 86 ? -13.12466 -17.32725 -17.78902 0.610 67.52688 ? 86 MET A C 1 ATOM 1631 C C B MET A 1 86 ? -12.97587 -17.23251 -17.82266 0.390 67.53148 ? 86 MET A C 1 ATOM 1632 O O A MET A 1 86 ? -12.89989 -18.24218 -18.58971 0.610 68.47870 ? 86 MET A O 1 ATOM 1633 O O B MET A 1 86 ? -12.46631 -17.96561 -18.67777 0.390 70.92351 ? 86 MET A O 1 ATOM 1634 C CB A MET A 1 86 ? -12.96318 -14.93558 -18.48711 0.610 65.94554 ? 86 MET A CB 1 ATOM 1635 C CB B MET A 1 86 ? -13.15061 -14.93487 -18.76965 0.390 65.69914 ? 86 MET A CB 1 ATOM 1636 C CG A MET A 1 86 ? -12.72853 -14.60383 -19.93282 0.610 70.37101 ? 86 MET A CG 1 ATOM 1637 C CG B MET A 1 86 ? -13.92927 -14.04734 -19.73003 0.390 67.97585 ? 86 MET A CG 1 ATOM 1638 S SD A MET A 1 86 ? -11.77267 -13.07805 -20.04776 0.610 66.70588 ? 86 MET A SD 1 ATOM 1639 S SD B MET A 1 86 ? -12.89024 -13.13424 -20.89289 0.390 70.01224 ? 86 MET A SD 1 ATOM 1640 C CE A MET A 1 86 ? -12.96285 -12.00401 -20.84219 0.610 72.86750 ? 86 MET A CE 1 ATOM 1641 C CE B MET A 1 86 ? -12.00594 -14.46884 -21.69514 0.390 74.12281 ? 86 MET A CE 1 ATOM 1642 H H A MET A 1 86 ? -14.62194 -15.04407 -16.72318 0.610 81.31895 ? 86 MET A H 1 ATOM 1643 H H B MET A 1 86 ? -14.57333 -15.09909 -16.70886 0.390 81.33908 ? 86 MET A H 1 ATOM 1644 H HA A MET A 1 86 ? -14.38723 -16.30720 -19.04385 0.610 80.24102 ? 86 MET A HA 1 ATOM 1645 H HA B MET A 1 86 ? -14.46997 -16.48148 -19.00562 0.390 80.25486 ? 86 MET A HA 1 ATOM 1646 H HB2 A MET A 1 86 ? -13.32827 -14.14216 -18.06510 0.610 79.13464 ? 86 MET A HB2 1 ATOM 1647 H HB2 B MET A 1 86 ? -12.89038 -14.39160 -18.00936 0.390 78.83896 ? 86 MET A HB2 1 ATOM 1648 H HB3 A MET A 1 86 ? -12.10151 -15.15182 -18.09768 0.610 79.13464 ? 86 MET A HB3 1 ATOM 1649 H HB3 B MET A 1 86 ? -12.36159 -15.25392 -19.23500 0.390 78.83896 ? 86 MET A HB3 1 ATOM 1650 H HG2 A MET A 1 86 ? -12.23067 -15.31947 -20.35814 0.610 84.44521 ? 86 MET A HG2 1 ATOM 1651 H HG2 B MET A 1 86 ? -14.53278 -14.60303 -20.24761 0.390 81.57102 ? 86 MET A HG2 1 ATOM 1652 H HG3 A MET A 1 86 ? -13.57807 -14.47727 -20.38357 0.610 84.44521 ? 86 MET A HG3 1 ATOM 1653 H HG3 B MET A 1 86 ? -14.43465 -13.39929 -19.21474 0.390 81.57102 ? 86 MET A HG3 1 ATOM 1654 H HE1 A MET A 1 86 ? -12.58229 -11.11537 -20.92214 0.610 87.44100 ? 86 MET A HE1 1 ATOM 1655 H HE1 B MET A 1 86 ? -11.70272 -14.16812 -22.56608 0.390 88.94737 ? 86 MET A HE1 1 ATOM 1656 H HE2 A MET A 1 86 ? -13.16809 -12.35636 -21.72232 0.610 87.44100 ? 86 MET A HE2 1 ATOM 1657 H HE2 B MET A 1 86 ? -11.24483 -14.71742 -21.14758 0.390 88.94737 ? 86 MET A HE2 1 ATOM 1658 H HE3 A MET A 1 86 ? -13.76838 -11.97158 -20.30277 0.610 87.44100 ? 86 MET A HE3 1 ATOM 1659 H HE3 B MET A 1 86 ? -12.60243 -15.22705 -21.79621 0.390 88.94737 ? 86 MET A HE3 1 ATOM 1660 N N . PHE A 1 87 ? -12.71201 -17.36249 -16.52247 1.000 68.16174 ? 87 PHE A N 1 ATOM 1661 C CA . PHE A 1 87 ? -11.82092 -18.39670 -15.99372 1.000 68.60103 ? 87 PHE A CA 1 ATOM 1662 C C . PHE A 1 87 ? -12.45346 -19.05943 -14.77358 1.000 69.88608 ? 87 PHE A C 1 ATOM 1663 O O . PHE A 1 87 ? -11.92389 -18.98590 -13.66065 1.000 59.72418 ? 87 PHE A O 1 ATOM 1664 C CB . PHE A 1 87 ? -10.46494 -17.78786 -15.64059 1.000 69.15893 ? 87 PHE A CB 1 ATOM 1665 C CG . PHE A 1 87 ? -9.90260 -16.88744 -16.71107 1.000 63.11835 ? 87 PHE A CG 1 ATOM 1666 C CD1 . PHE A 1 87 ? -9.38603 -17.41960 -17.88081 1.000 69.96006 ? 87 PHE A CD1 1 ATOM 1667 C CD2 . PHE A 1 87 ? -9.89297 -15.51201 -16.54266 1.000 61.91016 ? 87 PHE A CD2 1 ATOM 1668 C CE1 . PHE A 1 87 ? -8.86525 -16.59481 -18.86316 1.000 68.95294 ? 87 PHE A CE1 1 ATOM 1669 C CE2 . PHE A 1 87 ? -9.37478 -14.68125 -17.52048 1.000 63.57653 ? 87 PHE A CE2 1 ATOM 1670 C CZ . PHE A 1 87 ? -8.86349 -15.22576 -18.68429 1.000 65.10478 ? 87 PHE A CZ 1 ATOM 1671 H H A PHE A 1 87 ? -12.94141 -16.78076 -15.93208 0.610 81.79409 ? 87 PHE A H 1 ATOM 1672 H H B PHE A 1 87 ? -13.04408 -16.85302 -15.91439 0.390 81.79409 ? 87 PHE A H 1 ATOM 1673 H HA . PHE A 1 87 ? -11.69126 -19.08080 -16.66907 1.000 82.32123 ? 87 PHE A HA 1 ATOM 1674 H HB2 . PHE A 1 87 ? -10.56130 -17.26098 -14.83188 1.000 82.99072 ? 87 PHE A HB2 1 ATOM 1675 H HB3 . PHE A 1 87 ? -9.82956 -18.50615 -15.49483 1.000 82.99072 ? 87 PHE A HB3 1 ATOM 1676 H HD1 . PHE A 1 87 ? -9.38905 -18.34090 -18.00768 1.000 83.95208 ? 87 PHE A HD1 1 ATOM 1677 H HD2 . PHE A 1 87 ? -10.23917 -15.14257 -15.76255 1.000 74.29220 ? 87 PHE A HD2 1 ATOM 1678 H HE1 . PHE A 1 87 ? -8.51682 -16.96264 -19.64303 1.000 82.74353 ? 87 PHE A HE1 1 ATOM 1679 H HE2 . PHE A 1 87 ? -9.37037 -13.75971 -17.39538 1.000 76.29184 ? 87 PHE A HE2 1 ATOM 1680 H HZ . PHE A 1 87 ? -8.51881 -14.67034 -19.34582 1.000 78.12574 ? 87 PHE A HZ 1 ATOM 1681 N N . PRO A 1 88 ? -13.59154 -19.73199 -14.95207 1.000 65.42096 ? 88 PRO A N 1 ATOM 1682 C CA . PRO A 1 88 ? -14.31831 -20.26218 -13.78555 1.000 73.48851 ? 88 PRO A CA 1 ATOM 1683 C C . PRO A 1 88 ? -13.55959 -21.30724 -12.97767 1.000 75.70583 ? 88 PRO A C 1 ATOM 1684 O O . PRO A 1 88 ? -13.86897 -21.48301 -11.79223 1.000 74.73600 ? 88 PRO A O 1 ATOM 1685 C CB . PRO A 1 88 ? -15.58644 -20.86236 -14.41372 1.000 74.28840 ? 88 PRO A CB 1 ATOM 1686 C CG . PRO A 1 88 ? -15.18793 -21.17842 -15.81415 1.000 79.56080 ? 88 PRO A CG 1 ATOM 1687 C CD . PRO A 1 88 ? -14.29661 -20.03253 -16.21132 1.000 74.25141 ? 88 PRO A CD 1 ATOM 1688 H HA . PRO A 1 88 ? -14.55270 -19.52859 -13.19580 1.000 88.18621 ? 88 PRO A HA 1 ATOM 1689 H HB2 . PRO A 1 88 ? -15.84785 -21.66442 -13.93491 1.000 89.14608 ? 88 PRO A HB2 1 ATOM 1690 H HB3 . PRO A 1 88 ? -16.30745 -20.21380 -14.39307 1.000 89.14608 ? 88 PRO A HB3 1 ATOM 1691 H HG2 . PRO A 1 88 ? -14.70801 -22.02089 -15.84274 1.000 95.47296 ? 88 PRO A HG2 1 ATOM 1692 H HG3 . PRO A 1 88 ? -15.97271 -21.22421 -16.38242 1.000 95.47296 ? 88 PRO A HG3 1 ATOM 1693 H HD2 . PRO A 1 88 ? -13.67343 -20.29936 -16.90512 1.000 89.10169 ? 88 PRO A HD2 1 ATOM 1694 H HD3 . PRO A 1 88 ? -14.81873 -19.27126 -16.50924 1.000 89.10169 ? 88 PRO A HD3 1 ATOM 1695 N N . ASP A 1 89 ? -12.58935 -22.00760 -13.56257 1.000 71.99868 ? 89 ASP A N 1 ATOM 1696 C CA . ASP A 1 89 ? -11.88880 -23.07499 -12.85648 1.000 88.83153 ? 89 ASP A CA 1 ATOM 1697 C C . ASP A 1 89 ? -10.62885 -22.60319 -12.13565 1.000 77.07031 ? 89 ASP A C 1 ATOM 1698 O O . ASP A 1 89 ? -9.92838 -23.42871 -11.54072 1.000 72.12786 ? 89 ASP A O 1 ATOM 1699 C CB . ASP A 1 89 ? -11.50536 -24.19806 -13.83252 1.000 99.11057 ? 89 ASP A CB 1 ATOM 1700 C CG . ASP A 1 89 ? -12.71164 -24.90146 -14.42684 1.000 107.45740 ? 89 ASP A CG 1 ATOM 1701 O OD1 . ASP A 1 89 ? -13.74439 -25.01671 -13.73219 1.000 105.59401 ? 89 ASP A OD1 1 ATOM 1702 O OD2 . ASP A 1 89 ? -12.62020 -25.35173 -15.58906 1.000 100.51443 ? 89 ASP A OD2 1 ATOM 1703 H H . ASP A 1 89 ? -12.31932 -21.88193 -14.36935 1.000 86.39842 ? 89 ASP A H 1 ATOM 1704 H HA . ASP A 1 89 ? -12.49661 -23.43674 -12.19270 1.000 106.59784 ? 89 ASP A HA 1 ATOM 1705 H HB2 . ASP A 1 89 ? -10.98996 -23.81979 -14.56203 1.000 118.93268 ? 89 ASP A HB2 1 ATOM 1706 H HB3 . ASP A 1 89 ? -10.97583 -24.85944 -13.36022 1.000 118.93268 ? 89 ASP A HB3 1 ATOM 1707 N N . TRP A 1 90 ? -10.32113 -21.30909 -12.16930 1.000 62.31896 ? 90 TRP A N 1 ATOM 1708 C CA . TRP A 1 90 ? -9.02238 -20.80594 -11.72627 1.000 60.69358 ? 90 TRP A CA 1 ATOM 1709 C C . TRP A 1 90 ? -9.21256 -19.72992 -10.66472 1.000 61.99513 ? 90 TRP A C 1 ATOM 1710 O O . TRP A 1 90 ? -9.53081 -18.58553 -10.98928 1.000 53.89882 ? 90 TRP A O 1 ATOM 1711 C CB . TRP A 1 90 ? -8.22868 -20.23144 -12.90051 1.000 61.74841 ? 90 TRP A CB 1 ATOM 1712 C CG . TRP A 1 90 ? -7.78882 -21.22039 -13.92334 1.000 66.63297 ? 90 TRP A CG 1 ATOM 1713 C CD1 . TRP A 1 90 ? -7.78876 -22.57335 -13.81716 1.000 71.71190 ? 90 TRP A CD1 1 ATOM 1714 C CD2 . TRP A 1 90 ? -7.25389 -20.91600 -15.21283 1.000 72.12105 ? 90 TRP A CD2 1 ATOM 1715 N NE1 . TRP A 1 90 ? -7.29706 -23.13874 -14.97076 1.000 75.47778 ? 90 TRP A NE1 1 ATOM 1716 C CE2 . TRP A 1 90 ? -6.95807 -22.13730 -15.84213 1.000 82.32868 ? 90 TRP A CE2 1 ATOM 1717 C CE3 . TRP A 1 90 ? -6.99780 -19.72231 -15.89709 1.000 68.90582 ? 90 TRP A CE3 1 ATOM 1718 C CZ2 . TRP A 1 90 ? -6.42269 -22.20298 -17.12735 1.000 85.41397 ? 90 TRP A CZ2 1 ATOM 1719 C CZ3 . TRP A 1 90 ? -6.46504 -19.78865 -17.16551 1.000 68.21900 ? 90 TRP A CZ3 1 ATOM 1720 C CH2 . TRP A 1 90 ? -6.18426 -21.02036 -17.76971 1.000 80.87553 ? 90 TRP A CH2 1 ATOM 1721 H H . TRP A 1 90 ? -10.85495 -20.69522 -12.44822 1.000 74.78275 ? 90 TRP A H 1 ATOM 1722 H HA . TRP A 1 90 ? -8.54504 -21.54823 -11.32370 1.000 72.83230 ? 90 TRP A HA 1 ATOM 1723 H HB2 . TRP A 1 90 ? -8.78357 -19.57665 -13.35245 1.000 74.09809 ? 90 TRP A HB2 1 ATOM 1724 H HB3 . TRP A 1 90 ? -7.43105 -19.80504 -12.54999 1.000 74.09809 ? 90 TRP A HB3 1 ATOM 1725 H HD1 . TRP A 1 90 ? -8.07899 -23.04912 -13.07264 1.000 86.05428 ? 90 TRP A HD1 1 ATOM 1726 H HE1 . TRP A 1 90 ? -7.21584 -23.98173 -15.12033 1.000 90.57333 ? 90 TRP A HE1 1 ATOM 1727 H HE3 . TRP A 1 90 ? -7.18367 -18.90062 -15.50317 1.000 82.68699 ? 90 TRP A HE3 1 ATOM 1728 H HZ2 . TRP A 1 90 ? -6.23513 -23.01916 -17.53179 1.000 102.49677 ? 90 TRP A HZ2 1 ATOM 1729 H HZ3 . TRP A 1 90 ? -6.28872 -19.00175 -17.62876 1.000 81.86280 ? 90 TRP A HZ3 1 ATOM 1730 H HH2 . TRP A 1 90 ? -5.82713 -21.03398 -18.62830 1.000 97.05064 ? 90 TRP A HH2 1 ATOM 1731 N N . SER A 1 91 ? -8.98996 -20.07989 -9.39774 1.000 53.92009 ? 91 SER A N 1 ATOM 1732 C CA A SER A 1 91 ? -9.00399 -19.06202 -8.35174 0.716 51.99040 ? 91 SER A CA 1 ATOM 1733 C CA B SER A 1 91 ? -9.00460 -19.06296 -8.35026 0.284 52.21217 ? 91 SER A CA 1 ATOM 1734 C C . SER A 1 91 ? -7.93863 -18.00355 -8.60899 1.000 56.41107 ? 91 SER A C 1 ATOM 1735 O O . SER A 1 91 ? -8.17479 -16.80851 -8.40240 1.000 52.95726 ? 91 SER A O 1 ATOM 1736 C CB A SER A 1 91 ? -8.80418 -19.71766 -6.98549 0.716 54.87353 ? 91 SER A CB 1 ATOM 1737 C CB B SER A 1 91 ? -8.80273 -19.71727 -6.98374 0.284 55.03693 ? 91 SER A CB 1 ATOM 1738 O OG A SER A 1 91 ? -9.97767 -20.39818 -6.59198 0.716 60.85923 ? 91 SER A OG 1 ATOM 1739 O OG B SER A 1 91 ? -7.69889 -20.60359 -7.00231 0.284 61.04471 ? 91 SER A OG 1 ATOM 1740 H H A SER A 1 91 ? -8.83228 -20.87998 -9.12463 0.716 64.70411 ? 91 SER A H 1 ATOM 1741 H H B SER A 1 91 ? -8.83180 -20.88002 -9.12504 0.284 64.70411 ? 91 SER A H 1 ATOM 1742 H HA A SER A 1 91 ? -9.86799 -18.62115 -8.34546 0.716 62.38848 ? 91 SER A HA 1 ATOM 1743 H HA B SER A 1 91 ? -9.86963 -18.62413 -8.34249 0.284 62.65460 ? 91 SER A HA 1 ATOM 1744 H HB2 A SER A 1 91 ? -8.07242 -20.35194 -7.04123 0.716 65.84824 ? 91 SER A HB2 1 ATOM 1745 H HB2 B SER A 1 91 ? -8.63968 -19.02501 -6.32412 0.284 66.04431 ? 91 SER A HB2 1 ATOM 1746 H HB3 A SER A 1 91 ? -8.59965 -19.03190 -6.33066 0.716 65.84824 ? 91 SER A HB3 1 ATOM 1747 H HB3 B SER A 1 91 ? -9.60233 -20.21493 -6.75166 0.284 66.04431 ? 91 SER A HB3 1 ATOM 1748 H HG A SER A 1 91 ? -10.62796 -19.86658 -6.58068 0.716 73.03108 ? 91 SER A HG 1 ATOM 1749 H HG B SER A 1 91 ? -7.64747 -21.01378 -6.27108 0.284 73.25365 ? 91 SER A HG 1 ATOM 1750 N N . MET A 1 92 ? -6.75774 -18.42687 -9.05555 1.000 53.96578 ? 92 MET A N 1 ATOM 1751 C CA . MET A 1 92 ? -5.72175 -17.53695 -9.56879 1.000 55.59738 ? 92 MET A CA 1 ATOM 1752 C C . MET A 1 92 ? -4.67578 -18.39251 -10.26711 1.000 62.82448 ? 92 MET A C 1 ATOM 1753 O O . MET A 1 92 ? -3.76955 -18.92834 -9.61822 1.000 61.40527 ? 92 MET A O 1 ATOM 1754 C CB . MET A 1 92 ? -5.05416 -16.69808 -8.48390 1.000 48.55993 ? 92 MET A CB 1 ATOM 1755 C CG . MET A 1 92 ? -4.19895 -15.53278 -9.02326 1.000 53.97724 ? 92 MET A CG 1 ATOM 1756 S SD . MET A 1 92 ? -4.73077 -14.77463 -10.57048 1.000 52.97468 ? 92 MET A SD 1 ATOM 1757 C CE . MET A 1 92 ? -6.35416 -14.20674 -10.06343 1.000 51.37538 ? 92 MET A CE 1 ATOM 1758 H H . MET A 1 92 ? -6.52455 -19.25449 -9.07208 1.000 64.75893 ? 92 MET A H 1 ATOM 1759 H HA . MET A 1 92 ? -6.13524 -16.89807 -10.17026 1.000 66.71685 ? 92 MET A HA 1 ATOM 1760 H HB2 . MET A 1 92 ? -5.74364 -16.31921 -7.91647 1.000 58.27192 ? 92 MET A HB2 1 ATOM 1761 H HB3 . MET A 1 92 ? -4.47296 -17.27250 -7.96127 1.000 58.27192 ? 92 MET A HB3 1 ATOM 1762 H HG2 . MET A 1 92 ? -4.19214 -14.83116 -8.35350 1.000 64.77268 ? 92 MET A HG2 1 ATOM 1763 H HG3 . MET A 1 92 ? -3.29836 -15.86341 -9.16653 1.000 64.77268 ? 92 MET A HG3 1 ATOM 1764 H HE1 . MET A 1 92 ? -6.77458 -13.74740 -10.80717 1.000 61.65045 ? 92 MET A HE1 1 ATOM 1765 H HE2 . MET A 1 92 ? -6.88933 -14.97250 -9.80245 1.000 61.65045 ? 92 MET A HE2 1 ATOM 1766 H HE3 . MET A 1 92 ? -6.25634 -13.60027 -9.31275 1.000 61.65045 ? 92 MET A HE3 1 ATOM 1767 N N . GLN A 1 93 ? -4.80282 -18.54164 -11.57648 1.000 51.80240 ? 93 GLN A N 1 ATOM 1768 C CA . GLN A 1 93 ? -3.83865 -19.31271 -12.34391 1.000 57.17359 ? 93 GLN A CA 1 ATOM 1769 C C . GLN A 1 93 ? -2.64566 -18.42067 -12.65343 1.000 59.70721 ? 93 GLN A C 1 ATOM 1770 O O . GLN A 1 93 ? -2.80926 -17.28997 -13.11917 1.000 57.32574 ? 93 GLN A O 1 ATOM 1771 C CB . GLN A 1 93 ? -4.47475 -19.83600 -13.62806 1.000 58.30256 ? 93 GLN A CB 1 ATOM 1772 C CG . GLN A 1 93 ? -3.55746 -20.69544 -14.47671 1.000 63.77775 ? 93 GLN A CG 1 ATOM 1773 C CD . GLN A 1 93 ? -3.54219 -22.14090 -14.02753 1.000 70.31765 ? 93 GLN A CD 1 ATOM 1774 O OE1 . GLN A 1 93 ? -3.82238 -22.44557 -12.86648 1.000 82.16176 ? 93 GLN A OE1 1 ATOM 1775 N NE2 . GLN A 1 93 ? -3.21765 -23.04125 -14.94564 1.000 85.17847 ? 93 GLN A NE2 1 ATOM 1776 H H . GLN A 1 93 ? -5.44035 -18.20539 -12.04562 1.000 62.16288 ? 93 GLN A H 1 ATOM 1777 H HA . GLN A 1 93 ? -3.53646 -20.08318 -11.83799 1.000 68.60831 ? 93 GLN A HA 1 ATOM 1778 H HB2 . GLN A 1 93 ? -5.24708 -20.37403 -13.39367 1.000 69.96307 ? 93 GLN A HB2 1 ATOM 1779 H HB3 . GLN A 1 93 ? -4.74964 -19.07850 -14.16800 1.000 69.96307 ? 93 GLN A HB3 1 ATOM 1780 H HG2 . GLN A 1 93 ? -3.86026 -20.66923 -15.39786 1.000 76.53330 ? 93 GLN A HG2 1 ATOM 1781 H HG3 . GLN A 1 93 ? -2.65277 -20.35104 -14.41494 1.000 76.53330 ? 93 GLN A HG3 1 ATOM 1782 H HE21 . GLN A 1 93 ? -3.03017 -22.79034 -15.74658 1.000 102.21416 ? 93 GLN A HE21 1 ATOM 1783 H HE22 . GLN A 1 93 ? -3.19467 -23.87600 -14.74006 1.000 102.21416 ? 93 GLN A HE22 1 ATOM 1784 N N . THR A 1 94 ? -1.44954 -18.92536 -12.38924 1.000 55.45299 ? 94 THR A N 1 ATOM 1785 C CA . THR A 1 94 ? -0.22227 -18.15637 -12.55233 1.000 56.76436 ? 94 THR A CA 1 ATOM 1786 C C . THR A 1 94 ? 0.53910 -18.72435 -13.73828 1.000 55.75512 ? 94 THR A C 1 ATOM 1787 O O . THR A 1 94 ? 0.79629 -19.92588 -13.79022 1.000 55.45423 ? 94 THR A O 1 ATOM 1788 C CB . THR A 1 94 ? 0.60639 -18.20216 -11.27238 1.000 61.30108 ? 94 THR A CB 1 ATOM 1789 O OG1 . THR A 1 94 ? -0.15120 -17.59690 -10.21800 1.000 59.76521 ? 94 THR A OG1 1 ATOM 1790 C CG2 . THR A 1 94 ? 1.91153 -17.44741 -11.43735 1.000 61.86514 ? 94 THR A CG2 1 ATOM 1791 H H . THR A 1 94 ? -1.31953 -19.72773 -12.10833 1.000 66.54359 ? 94 THR A H 1 ATOM 1792 H HA . THR A 1 94 ? -0.42149 -17.22650 -12.74354 1.000 68.11723 ? 94 THR A HA 1 ATOM 1793 H HB . THR A 1 94 ? 0.82033 -19.12302 -11.05525 1.000 73.56130 ? 94 THR A HB 1 ATOM 1794 H HG1 . THR A 1 94 ? 0.36470 -17.21443 -9.67655 1.000 71.71825 ? 94 THR A HG1 1 ATOM 1795 H HG21 . THR A 1 94 ? 2.35610 -17.36200 -10.57947 1.000 74.23817 ? 94 THR A HG21 1 ATOM 1796 H HG22 . THR A 1 94 ? 2.49524 -17.92367 -12.04838 1.000 74.23817 ? 94 THR A HG22 1 ATOM 1797 H HG23 . THR A 1 94 ? 1.73971 -16.56125 -11.79247 1.000 74.23817 ? 94 THR A HG23 1 ATOM 1798 N N . ILE A 1 95 ? 0.86200 -17.86864 -14.70318 1.000 53.47946 ? 95 ILE A N 1 ATOM 1799 C CA . ILE A 1 95 ? 1.55429 -18.27748 -15.91607 1.000 54.87092 ? 95 ILE A CA 1 ATOM 1800 C C . ILE A 1 95 ? 2.80746 -17.42155 -16.02132 1.000 55.32622 ? 95 ILE A C 1 ATOM 1801 O O . ILE A 1 95 ? 2.72294 -16.21904 -16.30081 1.000 55.99338 ? 95 ILE A O 1 ATOM 1802 C CB . ILE A 1 95 ? 0.67572 -18.12757 -17.16347 1.000 61.23583 ? 95 ILE A CB 1 ATOM 1803 C CG1 . ILE A 1 95 ? -0.53785 -19.05628 -17.09070 1.000 67.89286 ? 95 ILE A CG1 1 ATOM 1804 C CG2 . ILE A 1 95 ? 1.46712 -18.47408 -18.40990 1.000 63.98076 ? 95 ILE A CG2 1 ATOM 1805 C CD1 . ILE A 1 95 ? -1.73535 -18.56129 -17.88619 1.000 68.89302 ? 95 ILE A CD1 1 ATOM 1806 H H . ILE A 1 95 ? 0.68542 -17.02744 -14.67494 1.000 64.17536 ? 95 ILE A H 1 ATOM 1807 H HA . ILE A 1 95 ? 1.81723 -19.20825 -15.84228 1.000 65.84510 ? 95 ILE A HA 1 ATOM 1808 H HB . ILE A 1 95 ? 0.37830 -17.20499 -17.19942 1.000 73.48300 ? 95 ILE A HB 1 ATOM 1809 H HG12 . ILE A 1 95 ? -0.28744 -19.92504 -17.44206 1.000 81.47143 ? 95 ILE A HG12 1 ATOM 1810 H HG13 . ILE A 1 95 ? -0.81184 -19.13965 -16.16394 1.000 81.47143 ? 95 ILE A HG13 1 ATOM 1811 H HG21 . ILE A 1 95 ? 0.88975 -18.38818 -19.18461 1.000 76.77692 ? 95 ILE A HG21 1 ATOM 1812 H HG22 . ILE A 1 95 ? 2.21743 -17.86421 -18.48730 1.000 76.77692 ? 95 ILE A HG22 1 ATOM 1813 H HG23 . ILE A 1 95 ? 1.78855 -19.38632 -18.33645 1.000 76.77692 ? 95 ILE A HG23 1 ATOM 1814 H HD11 . ILE A 1 95 ? -2.46048 -19.19909 -17.79509 1.000 82.67162 ? 95 ILE A HD11 1 ATOM 1815 H HD12 . ILE A 1 95 ? -2.00917 -17.69749 -17.54010 1.000 82.67162 ? 95 ILE A HD12 1 ATOM 1816 H HD13 . ILE A 1 95 ? -1.48257 -18.47885 -18.81903 1.000 82.67162 ? 95 ILE A HD13 1 ATOM 1817 N N . ASN A 1 96 ? 3.96834 -18.03258 -15.79100 1.000 54.61664 ? 96 ASN A N 1 ATOM 1818 C CA . ASN A 1 96 ? 5.25267 -17.35552 -15.95502 1.000 63.53521 ? 96 ASN A CA 1 ATOM 1819 C C . ASN A 1 96 ? 5.70716 -17.54763 -17.39780 1.000 52.11981 ? 96 ASN A C 1 ATOM 1820 O O . ASN A 1 96 ? 6.21772 -18.60500 -17.77287 1.000 58.27814 ? 96 ASN A O 1 ATOM 1821 C CB . ASN A 1 96 ? 6.28357 -17.89222 -14.97018 1.000 67.72136 ? 96 ASN A CB 1 ATOM 1822 C CG . ASN A 1 96 ? 7.54820 -17.05915 -14.94896 1.000 75.88692 ? 96 ASN A CG 1 ATOM 1823 O OD1 . ASN A 1 96 ? 7.95954 -16.50900 -15.97230 1.000 70.14033 ? 96 ASN A OD1 1 ATOM 1824 N ND2 . ASN A 1 96 ? 8.16597 -16.95060 -13.78080 1.000 69.01290 ? 96 ASN A ND2 1 ATOM 1825 H H . ASN A 1 96 ? 4.03870 -18.85066 -15.53527 1.000 65.53997 ? 96 ASN A H 1 ATOM 1826 H HA . ASN A 1 96 ? 5.13808 -16.40715 -15.78664 1.000 76.24225 ? 96 ASN A HA 1 ATOM 1827 H HB2 . ASN A 1 96 ? 5.90348 -17.88634 -14.07777 1.000 81.26563 ? 96 ASN A HB2 1 ATOM 1828 H HB3 . ASN A 1 96 ? 6.52299 -18.79761 -15.22285 1.000 81.26563 ? 96 ASN A HB3 1 ATOM 1829 H HD21 . ASN A 1 96 ? 8.88819 -16.48798 -13.71766 1.000 82.81548 ? 96 ASN A HD21 1 ATOM 1830 H HD22 . ASN A 1 96 ? 7.84444 -17.34280 -13.08625 1.000 82.81548 ? 96 ASN A HD22 1 ATOM 1831 N N . LEU A 1 97 ? 5.52766 -16.51620 -18.21717 1.000 58.68053 ? 97 LEU A N 1 ATOM 1832 C CA . LEU A 1 97 ? 5.86512 -16.64559 -19.62505 1.000 71.54334 ? 97 LEU A CA 1 ATOM 1833 C C . LEU A 1 97 ? 7.36814 -16.60638 -19.86328 1.000 65.40434 ? 97 LEU A C 1 ATOM 1834 O O . LEU A 1 97 ? 7.82853 -17.09382 -20.90077 1.000 65.35699 ? 97 LEU A O 1 ATOM 1835 C CB . LEU A 1 97 ? 5.16810 -15.54788 -20.42607 1.000 71.12129 ? 97 LEU A CB 1 ATOM 1836 C CG . LEU A 1 97 ? 3.83825 -15.98651 -21.04974 1.000 77.35407 ? 97 LEU A CG 1 ATOM 1837 C CD1 . LEU A 1 97 ? 2.94171 -14.75700 -21.22587 1.000 76.47445 ? 97 LEU A CD1 1 ATOM 1838 C CD2 . LEU A 1 97 ? 4.01683 -16.72829 -22.34911 1.000 92.61120 ? 97 LEU A CD2 1 ATOM 1839 H H . LEU A 1 97 ? 5.21839 -15.74799 -17.98522 1.000 70.41663 ? 97 LEU A H 1 ATOM 1840 H HA . LEU A 1 97 ? 5.54111 -17.49711 -19.95798 1.000 85.85201 ? 97 LEU A HA 1 ATOM 1841 H HB2 . LEU A 1 97 ? 4.98643 -14.79988 -19.83582 1.000 85.34554 ? 97 LEU A HB2 1 ATOM 1842 H HB3 . LEU A 1 97 ? 5.75504 -15.26767 -21.14572 1.000 85.34554 ? 97 LEU A HB3 1 ATOM 1843 H HG . LEU A 1 97 ? 3.40674 -16.61799 -20.45313 1.000 92.82489 ? 97 LEU A HG 1 ATOM 1844 H HD11 . LEU A 1 97 ? 2.10773 -15.03081 -21.63868 1.000 91.76934 ? 97 LEU A HD11 1 ATOM 1845 H HD12 . LEU A 1 97 ? 2.76725 -14.36607 -20.35545 1.000 91.76934 ? 97 LEU A HD12 1 ATOM 1846 H HD13 . LEU A 1 97 ? 3.39567 -14.11370 -21.79243 1.000 91.76934 ? 97 LEU A HD13 1 ATOM 1847 H HD21 . LEU A 1 97 ? 3.14519 -16.98505 -22.68854 1.000 111.13345 ? 97 LEU A HD21 1 ATOM 1848 H HD22 . LEU A 1 97 ? 4.46175 -16.14732 -22.98584 1.000 111.13345 ? 97 LEU A HD22 1 ATOM 1849 H HD23 . LEU A 1 97 ? 4.55583 -17.51888 -22.18992 1.000 111.13345 ? 97 LEU A HD23 1 ATOM 1850 N N . ASP A 1 98 ? 8.14704 -16.04653 -18.92950 1.000 62.28991 ? 98 ASP A N 1 ATOM 1851 C CA . ASP A 1 98 ? 9.60031 -16.12353 -19.05783 1.000 69.23203 ? 98 ASP A CA 1 ATOM 1852 C C . ASP A 1 98 ? 10.06635 -17.56999 -19.14253 1.000 69.40761 ? 98 ASP A C 1 ATOM 1853 O O . ASP A 1 98 ? 11.02895 -17.87570 -19.85613 1.000 76.21859 ? 98 ASP A O 1 ATOM 1854 C CB . ASP A 1 98 ? 10.29401 -15.42988 -17.87976 1.000 65.97243 ? 98 ASP A CB 1 ATOM 1855 C CG . ASP A 1 98 ? 10.03140 -13.92889 -17.83219 1.000 69.47375 ? 98 ASP A CG 1 ATOM 1856 O OD1 . ASP A 1 98 ? 10.06978 -13.27181 -18.89580 1.000 67.65820 ? 98 ASP A OD1 1 ATOM 1857 O OD2 . ASP A 1 98 ? 9.81822 -13.40248 -16.72009 1.000 76.45995 ? 98 ASP A OD2 1 ATOM 1858 H H . ASP A 1 98 ? 7.86450 -15.62883 -18.23286 1.000 74.74790 ? 98 ASP A H 1 ATOM 1859 H HA . ASP A 1 98 ? 9.85751 -15.65704 -19.86846 1.000 83.07843 ? 98 ASP A HA 1 ATOM 1860 H HB2 . ASP A 1 98 ? 9.96956 -15.81629 -17.05131 1.000 79.16692 ? 98 ASP A HB2 1 ATOM 1861 H HB3 . ASP A 1 98 ? 11.25182 -15.56330 -17.95533 1.000 79.16692 ? 98 ASP A HB3 1 ATOM 1862 N N . GLU A 1 99 ? 9.38657 -18.47180 -18.43623 1.000 80.23089 ? 99 GLU A N 1 ATOM 1863 C CA . GLU A 1 99 ? 9.79316 -19.86648 -18.33516 1.000 89.99083 ? 99 GLU A CA 1 ATOM 1864 C C . GLU A 1 99 ? 9.17014 -20.75571 -19.40189 1.000 78.74532 ? 99 GLU A C 1 ATOM 1865 O O . GLU A 1 99 ? 9.54863 -21.92781 -19.50617 1.000 81.01858 ? 99 GLU A O 1 ATOM 1866 C CB . GLU A 1 99 ? 9.42100 -20.40714 -16.95096 1.000 94.25309 ? 99 GLU A CB 1 ATOM 1867 C CG . GLU A 1 99 ? 10.21176 -19.78149 -15.81733 1.000 96.42075 ? 99 GLU A CG 1 ATOM 1868 C CD . GLU A 1 99 ? 9.89595 -20.40577 -14.47367 1.000 112.00655 ? 99 GLU A CD 1 ATOM 1869 O OE1 . GLU A 1 99 ? 10.68456 -20.20549 -13.52496 1.000 106.13316 ? 99 GLU A OE1 1 ATOM 1870 O OE2 . GLU A 1 99 ? 8.85430 -21.08836 -14.36535 1.000 111.72070 ? 99 GLU A OE2 1 ATOM 1871 H H . GLU A 1 99 ? 8.66918 -18.29350 -17.99673 1.000 96.27707 ? 99 GLU A H 1 ATOM 1872 H HA . GLU A 1 99 ? 10.75611 -19.91870 -18.43959 1.000 107.98900 ? 99 GLU A HA 1 ATOM 1873 H HB2 . GLU A 1 99 ? 8.48110 -20.22996 -16.78943 1.000 113.10371 ? 99 GLU A HB2 1 ATOM 1874 H HB3 . GLU A 1 99 ? 9.58599 -21.36287 -16.93487 1.000 113.10371 ? 99 GLU A HB3 1 ATOM 1875 H HG2 . GLU A 1 99 ? 11.15909 -19.90014 -15.98875 1.000 115.70491 ? 99 GLU A HG2 1 ATOM 1876 H HG3 . GLU A 1 99 ? 9.99953 -18.83633 -15.76702 1.000 115.70491 ? 99 GLU A HG3 1 ATOM 1877 N N . ASN A 1 100 ? 8.23774 -20.23704 -20.19355 1.000 83.68659 ? 100 ASN A N 1 ATOM 1878 C CA . ASN A 1 100 ? 7.54455 -21.03340 -21.19695 1.000 80.72082 ? 100 ASN A CA 1 ATOM 1879 C C . ASN A 1 100 ? 8.35271 -21.06347 -22.48868 1.000 78.40518 ? 100 ASN A C 1 ATOM 1880 O O . ASN A 1 100 ? 8.87900 -20.03714 -22.92968 1.000 89.16638 ? 100 ASN A O 1 ATOM 1881 C CB . ASN A 1 100 ? 6.14907 -20.45434 -21.44742 1.000 81.46153 ? 100 ASN A CB 1 ATOM 1882 C CG . ASN A 1 100 ? 5.36374 -21.24012 -22.47524 1.000 82.23562 ? 100 ASN A CG 1 ATOM 1883 O OD1 . ASN A 1 100 ? 5.61183 -21.13557 -23.67654 1.000 87.44364 ? 100 ASN A OD1 1 ATOM 1884 N ND2 . ASN A 1 100 ? 4.40187 -22.02644 -22.00893 1.000 79.61066 ? 100 ASN A ND2 1 ATOM 1885 H H . ASN A 1 100 ? 7.98602 -19.41510 -20.16794 1.000 100.42390 ? 100 ASN A H 1 ATOM 1886 H HA . ASN A 1 100 ? 7.44323 -21.94775 -20.88939 1.000 96.86498 ? 100 ASN A HA 1 ATOM 1887 H HB2 . ASN A 1 100 ? 5.64903 -20.46438 -20.61630 1.000 97.75384 ? 100 ASN A HB2 1 ATOM 1888 H HB3 . ASN A 1 100 ? 6.23806 -19.54391 -21.77008 1.000 97.75384 ? 100 ASN A HB3 1 ATOM 1889 H HD21 . ASN A 1 100 ? 3.92696 -22.49369 -22.55276 1.000 95.53280 ? 100 ASN A HD21 1 ATOM 1890 H HD22 . ASN A 1 100 ? 4.25341 -22.06879 -21.16290 1.000 95.53280 ? 100 ASN A HD22 1 ATOM 1891 N N . THR A 1 101 ? 8.44734 -22.25081 -23.09158 1.000 84.89763 ? 101 THR A N 1 ATOM 1892 C CA . THR A 1 101 ? 9.17507 -22.44579 -24.34114 1.000 89.61842 ? 101 THR A CA 1 ATOM 1893 C C . THR A 1 101 ? 8.35825 -23.26836 -25.33129 1.000 84.26949 ? 101 THR A C 1 ATOM 1894 O O . THR A 1 101 ? 8.91632 -24.02459 -26.13172 1.000 91.45488 ? 101 THR A O 1 ATOM 1895 C CB . THR A 1 101 ? 10.52833 -23.12110 -24.09792 1.000 80.92366 ? 101 THR A CB 1 ATOM 1896 O OG1 . THR A 1 101 ? 10.39591 -24.11813 -23.07727 1.000 92.37133 ? 101 THR A OG1 1 ATOM 1897 C CG2 . THR A 1 101 ? 11.57696 -22.09314 -23.68265 1.000 93.98503 ? 101 THR A CG2 1 ATOM 1898 H H . THR A 1 101 ? 8.09006 -22.97159 -22.78758 1.000 101.87715 ? 101 THR A H 1 ATOM 1899 H HA . THR A 1 101 ? 9.33869 -21.57296 -24.73140 1.000 107.54211 ? 101 THR A HA 1 ATOM 1900 H HB . THR A 1 101 ? 10.82967 -23.54360 -24.91742 1.000 97.10839 ? 101 THR A HB 1 ATOM 1901 H HG1 . THR A 1 101 ? 11.13434 -24.49726 -22.94848 1.000 110.84560 ? 101 THR A HG1 1 ATOM 1902 H HG21 . THR A 1 101 ? 12.43080 -22.53010 -23.53796 1.000 112.78204 ? 101 THR A HG21 1 ATOM 1903 H HG22 . THR A 1 101 ? 11.67939 -21.42433 -24.37771 1.000 112.78204 ? 101 THR A HG22 1 ATOM 1904 H HG23 . THR A 1 101 ? 11.30462 -21.65456 -22.86144 1.000 112.78204 ? 101 THR A HG23 1 ATOM 1905 N N A ASP A 1 102 ? 7.03708 -23.14140 -25.29661 0.810 83.89734 ? 102 ASP A N 1 ATOM 1906 N N B ASP A 1 102 ? 7.03636 -23.15114 -25.26747 0.190 83.95745 ? 102 ASP A N 1 ATOM 1907 C CA A ASP A 1 102 ? 6.21421 -23.79946 -26.30149 0.810 86.92677 ? 102 ASP A CA 1 ATOM 1908 C CA B ASP A 1 102 ? 6.15659 -23.85929 -26.18624 0.190 86.52082 ? 102 ASP A CA 1 ATOM 1909 C C A ASP A 1 102 ? 6.35870 -23.08199 -27.64081 0.810 87.50332 ? 102 ASP A C 1 ATOM 1910 C C B ASP A 1 102 ? 6.30063 -23.27862 -27.58794 0.190 87.30694 ? 102 ASP A C 1 ATOM 1911 O O A ASP A 1 102 ? 6.35087 -21.84824 -27.70851 0.810 78.99612 ? 102 ASP A O 1 ATOM 1912 O O B ASP A 1 102 ? 6.34239 -22.05913 -27.75909 0.190 80.53804 ? 102 ASP A O 1 ATOM 1913 C CB A ASP A 1 102 ? 4.75302 -23.82529 -25.86057 0.810 84.95263 ? 102 ASP A CB 1 ATOM 1914 C CB B ASP A 1 102 ? 4.70235 -23.76718 -25.72436 0.190 84.54454 ? 102 ASP A CB 1 ATOM 1915 C CG A ASP A 1 102 ? 3.84824 -24.47864 -26.88818 0.810 87.62671 ? 102 ASP A CG 1 ATOM 1916 C CG B ASP A 1 102 ? 4.42121 -24.61896 -24.50109 0.190 80.84962 ? 102 ASP A CG 1 ATOM 1917 O OD1 A ASP A 1 102 ? 3.42622 -23.78533 -27.83917 0.810 90.91000 ? 102 ASP A OD1 1 ATOM 1918 O OD1 B ASP A 1 102 ? 5.24963 -25.49329 -24.17474 0.190 80.78463 ? 102 ASP A OD1 1 ATOM 1919 O OD2 A ASP A 1 102 ? 3.56464 -25.68271 -26.75028 0.810 99.98894 ? 102 ASP A OD2 1 ATOM 1920 O OD2 B ASP A 1 102 ? 3.36586 -24.41306 -23.86577 0.190 81.89114 ? 102 ASP A OD2 1 ATOM 1921 H H A ASP A 1 102 ? 6.59997 -22.68741 -24.71144 0.810 100.67681 ? 102 ASP A H 1 ATOM 1922 H H B ASP A 1 102 ? 6.62112 -22.66223 -24.69465 0.190 100.74894 ? 102 ASP A H 1 ATOM 1923 H HA A ASP A 1 102 ? 6.50139 -24.71917 -26.41355 0.810 104.31212 ? 102 ASP A HA 1 ATOM 1924 H HA B ASP A 1 102 ? 6.39503 -24.79928 -26.20793 0.190 103.82498 ? 102 ASP A HA 1 ATOM 1925 H HB2 A ASP A 1 102 ? 4.68022 -24.32654 -25.03331 0.810 101.94316 ? 102 ASP A HB2 1 ATOM 1926 H HB2 B ASP A 1 102 ? 4.49916 -22.84531 -25.50130 0.190 101.45345 ? 102 ASP A HB2 1 ATOM 1927 H HB3 A ASP A 1 102 ? 4.44654 -22.91502 -25.72500 0.810 101.94316 ? 102 ASP A HB3 1 ATOM 1928 H HB3 B ASP A 1 102 ? 4.12313 -24.07055 -26.44087 0.190 101.45345 ? 102 ASP A HB3 1 ATOM 1929 N N A PHE A 1 103 ? 6.49049 -23.87104 -28.71327 0.481 87.23559 ? 103 PHE A N 1 ATOM 1930 N N C PHE A 1 103 ? 6.90483 -23.03072 -28.49121 0.519 89.11619 ? 103 PHE A N 1 ATOM 1931 C CA A PHE A 1 103 ? 6.80996 -23.30825 -30.02307 0.481 89.98908 ? 103 PHE A CA 1 ATOM 1932 C CA C PHE A 1 103 ? 6.82600 -23.25947 -29.93155 0.519 89.94793 ? 103 PHE A CA 1 ATOM 1933 C C A PHE A 1 103 ? 5.77806 -22.27794 -30.46121 0.481 86.61664 ? 103 PHE A C 1 ATOM 1934 C C C PHE A 1 103 ? 5.77107 -22.33035 -30.53281 0.519 86.61860 ? 103 PHE A C 1 ATOM 1935 O O A PHE A 1 103 ? 6.12272 -21.26724 -31.08578 0.481 80.96804 ? 103 PHE A O 1 ATOM 1936 O O C PHE A 1 103 ? 6.09967 -21.44533 -31.32479 0.519 80.93355 ? 103 PHE A O 1 ATOM 1937 C CB A PHE A 1 103 ? 6.90535 -24.42428 -31.06466 0.481 96.15611 ? 103 PHE A CB 1 ATOM 1938 C CB C PHE A 1 103 ? 6.51724 -24.73352 -30.21517 0.519 95.88679 ? 103 PHE A CB 1 ATOM 1939 C CG A PHE A 1 103 ? 5.57806 -24.80587 -31.67040 0.481 100.18501 ? 103 PHE A CG 1 ATOM 1940 C CG C PHE A 1 103 ? 6.28804 -25.05019 -31.67077 0.519 102.10941 ? 103 PHE A CG 1 ATOM 1941 C CD1 A PHE A 1 103 ? 4.74334 -25.71274 -31.03427 0.481 101.94811 ? 103 PHE A CD1 1 ATOM 1942 C CD1 C PHE A 1 103 ? 7.34195 -25.06258 -32.57203 0.519 100.78302 ? 103 PHE A CD1 1 ATOM 1943 C CD2 A PHE A 1 103 ? 5.16194 -24.25013 -32.87075 0.481 97.16078 ? 103 PHE A CD2 1 ATOM 1944 C CD2 C PHE A 1 103 ? 5.02055 -25.37498 -32.12887 0.519 105.41829 ? 103 PHE A CD2 1 ATOM 1945 C CE1 A PHE A 1 103 ? 3.52319 -26.06351 -31.58969 0.481 100.52989 ? 103 PHE A CE1 1 ATOM 1946 C CE1 C PHE A 1 103 ? 7.13026 -25.36566 -33.90746 0.519 93.20640 ? 103 PHE A CE1 1 ATOM 1947 C CE2 A PHE A 1 103 ? 3.94289 -24.59498 -33.42834 0.481 98.95867 ? 103 PHE A CE2 1 ATOM 1948 C CE2 C PHE A 1 103 ? 4.80493 -25.68304 -33.46256 0.519 102.08789 ? 103 PHE A CE2 1 ATOM 1949 C CZ A PHE A 1 103 ? 3.12319 -25.50252 -32.78710 0.481 101.16073 ? 103 PHE A CZ 1 ATOM 1950 C CZ C PHE A 1 103 ? 5.86106 -25.67876 -34.35091 0.519 92.48849 ? 103 PHE A CZ 1 ATOM 1951 H H A PHE A 1 103 ? 6.40046 -24.72630 -28.70709 0.810 104.68271 ? 103 PHE A H 1 ATOM 1952 H H B PHE A 1 103 ? 6.23011 -26.23172 -28.68668 0.190 0.00008 ? 103 PHE A H 1 ATOM 1953 H HA A PHE A 1 103 ? 7.67108 -22.86608 -29.96098 0.481 107.98690 ? 103 PHE A HA 1 ATOM 1954 H HA C PHE A 1 103 ? 7.67364 -23.06756 -30.36232 0.519 107.93751 ? 103 PHE A HA 1 ATOM 1955 H HB2 A PHE A 1 103 ? 7.48553 -24.13034 -31.78431 0.481 115.38734 ? 103 PHE A HB2 1 ATOM 1956 H HB2 C PHE A 1 103 ? 7.26584 -25.27073 -29.91202 0.519 115.06415 ? 103 PHE A HB2 1 ATOM 1957 H HB3 A PHE A 1 103 ? 7.27580 -25.21469 -30.64167 0.481 115.38734 ? 103 PHE A HB3 1 ATOM 1958 H HB3 C PHE A 1 103 ? 5.71395 -24.98054 -29.73080 0.519 115.06415 ? 103 PHE A HB3 1 ATOM 1959 H HD1 A PHE A 1 103 ? 5.00557 -26.08977 -30.22559 0.481 122.33773 ? 103 PHE A HD1 1 ATOM 1960 H HD1 C PHE A 1 103 ? 8.20135 -24.86506 -32.27652 0.519 120.93962 ? 103 PHE A HD1 1 ATOM 1961 H HD2 A PHE A 1 103 ? 5.70916 -23.63759 -33.30693 0.481 116.59293 ? 103 PHE A HD2 1 ATOM 1962 H HD2 C PHE A 1 103 ? 4.30607 -25.38625 -31.53365 0.519 126.50195 ? 103 PHE A HD2 1 ATOM 1963 H HE1 A PHE A 1 103 ? 2.97384 -26.67629 -31.15655 0.481 120.63587 ? 103 PHE A HE1 1 ATOM 1964 H HE1 C PHE A 1 103 ? 7.84303 -25.35815 -34.50479 0.519 111.84767 ? 103 PHE A HE1 1 ATOM 1965 H HE2 A PHE A 1 103 ? 3.67604 -24.21565 -34.23444 0.481 118.75040 ? 103 PHE A HE2 1 ATOM 1966 H HE2 C PHE A 1 103 ? 3.94871 -25.89264 -33.75895 0.519 122.50547 ? 103 PHE A HE2 1 ATOM 1967 H HZ A PHE A 1 103 ? 2.30388 -25.73553 -33.16038 0.481 121.39288 ? 103 PHE A HZ 1 ATOM 1968 H HZ C PHE A 1 103 ? 5.71804 -25.88629 -35.24610 0.519 110.98619 ? 103 PHE A HZ 1 ATOM 1969 N N . LEU A 1 104 ? 4.50788 -22.51460 -30.14511 1.000 85.08558 ? 104 LEU A N 1 ATOM 1970 C CA . LEU A 1 104 ? 3.45484 -21.60661 -30.58219 1.000 84.42422 ? 104 LEU A CA 1 ATOM 1971 C C . LEU A 1 104 ? 3.34360 -20.40021 -29.66032 1.000 77.04765 ? 104 LEU A C 1 ATOM 1972 O O . LEU A 1 104 ? 2.94744 -19.31958 -30.11133 1.000 78.86692 ? 104 LEU A O 1 ATOM 1973 C CB . LEU A 1 104 ? 2.11311 -22.33840 -30.65460 1.000 91.58908 ? 104 LEU A CB 1 ATOM 1974 C CG . LEU A 1 104 ? 0.89493 -21.46835 -30.97835 1.000 87.51861 ? 104 LEU A CG 1 ATOM 1975 C CD1 . LEU A 1 104 ? -0.08743 -22.24552 -31.84514 1.000 96.33628 ? 104 LEU A CD1 1 ATOM 1976 C CD2 . LEU A 1 104 ? 0.20120 -20.98016 -29.71678 1.000 100.23425 ? 104 LEU A CD2 1 ATOM 1977 H H . LEU A 1 104 ? 4.24491 -23.15416 -29.63383 1.000 102.10270 ? 104 LEU A H 1 ATOM 1978 H HA . LEU A 1 104 ? 3.65184 -21.28926 -31.47739 1.000 101.30907 ? 104 LEU A HA 1 ATOM 1979 H HB2 . LEU A 1 104 ? 2.17457 -23.01630 -31.34567 1.000 109.90690 ? 104 LEU A HB2 1 ATOM 1980 H HB3 . LEU A 1 104 ? 1.94860 -22.75547 -29.79444 1.000 109.90690 ? 104 LEU A HB3 1 ATOM 1981 H HG . LEU A 1 104 ? 1.20010 -20.68642 -31.46451 1.000 105.02234 ? 104 LEU A HG 1 ATOM 1982 H HD11 . LEU A 1 104 ? -0.85903 -21.68650 -32.02686 1.000 115.60354 ? 104 LEU A HD11 1 ATOM 1983 H HD12 . LEU A 1 104 ? 0.34866 -22.48796 -32.67698 1.000 115.60354 ? 104 LEU A HD12 1 ATOM 1984 H HD13 . LEU A 1 104 ? -0.36290 -23.04547 -31.37069 1.000 115.60354 ? 104 LEU A HD13 1 ATOM 1985 H HD21 . LEU A 1 104 ? -0.22821 -20.13018 -29.90128 1.000 120.28110 ? 104 LEU A HD21 1 ATOM 1986 H HD22 . LEU A 1 104 ? -0.46242 -21.63455 -29.44792 1.000 120.28110 ? 104 LEU A HD22 1 ATOM 1987 H HD23 . LEU A 1 104 ? 0.86191 -20.87152 -29.01495 1.000 120.28110 ? 104 LEU A HD23 1 ATOM 1988 N N . ILE A 1 105 ? 3.68750 -20.56301 -28.37943 1.000 79.58111 ? 105 ILE A N 1 ATOM 1989 C CA . ILE A 1 105 ? 3.71201 -19.42683 -27.46283 1.000 71.70155 ? 105 ILE A CA 1 ATOM 1990 C C . ILE A 1 105 ? 4.80131 -18.43962 -27.85811 1.000 62.39253 ? 105 ILE A C 1 ATOM 1991 O O . ILE A 1 105 ? 4.66430 -17.23684 -27.63188 1.000 60.17876 ? 105 ILE A O 1 ATOM 1992 C CB . ILE A 1 105 ? 3.92407 -19.89904 -26.01286 1.000 74.42124 ? 105 ILE A CB 1 ATOM 1993 C CG1 . ILE A 1 105 ? 2.75858 -20.73676 -25.48771 1.000 84.57962 ? 105 ILE A CG1 1 ATOM 1994 C CG2 . ILE A 1 105 ? 4.05516 -18.70645 -25.06812 1.000 71.13659 ? 105 ILE A CG2 1 ATOM 1995 C CD1 . ILE A 1 105 ? 1.42324 -20.24603 -25.88738 1.000 84.68017 ? 105 ILE A CD1 1 ATOM 1996 H H . ILE A 1 105 ? 3.90821 -21.31332 -28.02177 1.000 95.49734 ? 105 ILE A H 1 ATOM 1997 H HA . ILE A 1 105 ? 2.85055 -18.98469 -27.52024 1.000 86.04186 ? 105 ILE A HA 1 ATOM 1998 H HB . ILE A 1 105 ? 4.73226 -20.43492 -26.03620 1.000 89.30549 ? 105 ILE A HB 1 ATOM 1999 H HG12 . ILE A 1 105 ? 2.85139 -21.64142 -25.82516 1.000 101.49554 ? 105 ILE A HG12 1 ATOM 2000 H HG13 . ILE A 1 105 ? 2.79179 -20.73924 -24.51828 1.000 101.49554 ? 105 ILE A HG13 1 ATOM 2001 H HG21 . ILE A 1 105 ? 4.18695 -19.03265 -24.16417 1.000 85.36390 ? 105 ILE A HG21 1 ATOM 2002 H HG22 . ILE A 1 105 ? 4.81606 -18.17000 -25.34042 1.000 85.36390 ? 105 ILE A HG22 1 ATOM 2003 H HG23 . ILE A 1 105 ? 3.24379 -18.17682 -25.11365 1.000 85.36390 ? 105 ILE A HG23 1 ATOM 2004 H HD11 . ILE A 1 105 ? 0.74589 -20.82000 -25.49666 1.000 101.61620 ? 105 ILE A HD11 1 ATOM 2005 H HD12 . ILE A 1 105 ? 1.31178 -19.33732 -25.56688 1.000 101.61620 ? 105 ILE A HD12 1 ATOM 2006 H HD13 . ILE A 1 105 ? 1.35593 -20.26615 -26.85483 1.000 101.61620 ? 105 ILE A HD13 1 ATOM 2007 N N . ARG A 1 106 ? 5.90576 -18.92370 -28.42198 1.000 63.10637 ? 106 ARG A N 1 ATOM 2008 C CA . ARG A 1 106 ? 7.06536 -18.06488 -28.67219 1.000 65.07841 ? 106 ARG A CA 1 ATOM 2009 C C . ARG A 1 106 ? 6.71190 -16.80077 -29.44403 1.000 59.65947 ? 106 ARG A C 1 ATOM 2010 O O . ARG A 1 106 ? 7.01831 -15.70108 -28.95589 1.000 57.46221 ? 106 ARG A O 1 ATOM 2011 C CB . ARG A 1 106 ? 8.13171 -18.92310 -29.37581 1.000 70.70442 ? 106 ARG A CB 1 ATOM 2012 C CG . ARG A 1 106 ? 9.00891 -18.20683 -30.40047 1.000 94.02030 ? 106 ARG A CG 1 ATOM 2013 C CD . ARG A 1 106 ? 10.14899 -17.44742 -29.73586 1.000 96.59228 ? 106 ARG A CD 1 ATOM 2014 N NE . ARG A 1 106 ? 11.27351 -18.32555 -29.43346 1.000 103.01014 ? 106 ARG A NE 1 ATOM 2015 C CZ . ARG A 1 106 ? 12.06404 -18.87377 -30.34629 1.000 99.33030 ? 106 ARG A CZ 1 ATOM 2016 N NH1 . ARG A 1 106 ? 11.88607 -18.65173 -31.63771 1.000 96.56165 ? 106 ARG A NH1 1 ATOM 2017 N NH2 . ARG A 1 106 ? 13.05463 -19.66968 -29.95299 1.000 104.54119 ? 106 ARG A NH2 1 ATOM 2018 H H . ARG A 1 106 ? 6.01076 -19.74092 -28.66841 1.000 75.72764 ? 106 ARG A H 1 ATOM 2019 H HA . ARG A 1 106 ? 7.43608 -17.75846 -27.82982 1.000 78.09410 ? 106 ARG A HA 1 ATOM 2020 H HB2 . ARG A 1 106 ? 8.72314 -19.28550 -28.69775 1.000 84.84531 ? 106 ARG A HB2 1 ATOM 2021 H HB3 . ARG A 1 106 ? 7.67982 -19.64405 -29.84157 1.000 84.84531 ? 106 ARG A HB3 1 ATOM 2022 H HG2 . ARG A 1 106 ? 9.39191 -18.86017 -31.00657 1.000 112.82436 ? 106 ARG A HG2 1 ATOM 2023 H HG3 . ARG A 1 106 ? 8.46886 -17.57132 -30.89583 1.000 112.82436 ? 106 ARG A HG3 1 ATOM 2024 H HD2 . ARG A 1 106 ? 10.45981 -16.74862 -30.33248 1.000 115.91073 ? 106 ARG A HD2 1 ATOM 2025 H HD3 . ARG A 1 106 ? 9.83400 -17.05844 -28.90497 1.000 115.91073 ? 106 ARG A HD3 1 ATOM 2026 H HE . ARG A 1 106 ? 11.43496 -18.49969 -28.60690 1.000 123.61216 ? 106 ARG A HE 1 ATOM 2027 H HH11 . ARG A 1 106 ? 11.24605 -18.14178 -31.90214 1.000 115.87398 ? 106 ARG A HH11 1 ATOM 2028 H HH12 . ARG A 1 106 ? 12.41035 -19.01729 -32.21312 1.000 115.87398 ? 106 ARG A HH12 1 ATOM 2029 H HH21 . ARG A 1 106 ? 13.17617 -19.82327 -29.11559 1.000 125.44943 ? 106 ARG A HH21 1 ATOM 2030 H HH22 . ARG A 1 106 ? 13.57352 -20.03067 -30.53612 1.000 125.44943 ? 106 ARG A HH22 1 ATOM 2031 N N . PRO A 1 107 ? 6.07122 -16.86156 -30.61417 1.000 59.18676 ? 107 PRO A N 1 ATOM 2032 C CA . PRO A 1 107 ? 5.76581 -15.60710 -31.32643 1.000 60.29666 ? 107 PRO A CA 1 ATOM 2033 C C . PRO A 1 107 ? 4.78566 -14.71249 -30.58237 1.000 58.57322 ? 107 PRO A C 1 ATOM 2034 O O . PRO A 1 107 ? 4.90738 -13.47974 -30.64632 1.000 54.64251 ? 107 PRO A O 1 ATOM 2035 C CB . PRO A 1 107 ? 5.19622 -16.09717 -32.66976 1.000 57.54978 ? 107 PRO A CB 1 ATOM 2036 C CG . PRO A 1 107 ? 4.69257 -17.48744 -32.38229 1.000 67.24100 ? 107 PRO A CG 1 ATOM 2037 C CD . PRO A 1 107 ? 5.65846 -18.05164 -31.37985 1.000 69.15922 ? 107 PRO A CD 1 ATOM 2038 H HA . PRO A 1 107 ? 6.58170 -15.10893 -31.49085 1.000 72.35600 ? 107 PRO A HA 1 ATOM 2039 H HB2 . PRO A 1 107 ? 4.47365 -15.51658 -32.95561 1.000 69.05974 ? 107 PRO A HB2 1 ATOM 2040 H HB3 . PRO A 1 107 ? 5.89578 -16.11157 -33.34155 1.000 69.05974 ? 107 PRO A HB3 1 ATOM 2041 H HG2 . PRO A 1 107 ? 3.79623 -17.44474 -32.01397 1.000 80.68920 ? 107 PRO A HG2 1 ATOM 2042 H HG3 . PRO A 1 107 ? 4.69171 -18.01378 -33.19707 1.000 80.68920 ? 107 PRO A HG3 1 ATOM 2043 H HD2 . PRO A 1 107 ? 5.22226 -18.69972 -30.80484 1.000 82.99107 ? 107 PRO A HD2 1 ATOM 2044 H HD3 . PRO A 1 107 ? 6.41881 -18.45982 -31.82274 1.000 82.99107 ? 107 PRO A HD3 1 ATOM 2045 N N . ILE A 1 108 ? 3.82169 -15.28808 -29.86295 1.000 53.93033 ? 108 ILE A N 1 ATOM 2046 C CA . ILE A 1 108 ? 2.90293 -14.45409 -29.09463 1.000 54.23059 ? 108 ILE A CA 1 ATOM 2047 C C . ILE A 1 108 ? 3.65598 -13.72339 -27.98448 1.000 52.60290 ? 108 ILE A C 1 ATOM 2048 O O . ILE A 1 108 ? 3.40744 -12.53834 -27.72264 1.000 52.08813 ? 108 ILE A O 1 ATOM 2049 C CB . ILE A 1 108 ? 1.74489 -15.30691 -28.54186 1.000 63.47502 ? 108 ILE A CB 1 ATOM 2050 C CG1 . ILE A 1 108 ? 1.11492 -16.13943 -29.66365 1.000 63.60038 ? 108 ILE A CG1 1 ATOM 2051 C CG2 . ILE A 1 108 ? 0.68250 -14.40549 -27.89786 1.000 61.28149 ? 108 ILE A CG2 1 ATOM 2052 C CD1 . ILE A 1 108 ? 0.14441 -17.20485 -29.18676 1.000 68.79673 ? 108 ILE A CD1 1 ATOM 2053 H H . ILE A 1 108 ? 3.68296 -16.13485 -29.80508 1.000 64.71640 ? 108 ILE A H 1 ATOM 2054 H HA . ILE A 1 108 ? 2.52029 -13.78496 -29.68350 1.000 65.07671 ? 108 ILE A HA 1 ATOM 2055 H HB . ILE A 1 108 ? 2.10116 -15.90712 -27.86828 1.000 76.17002 ? 108 ILE A HB 1 ATOM 2056 H HG12 . ILE A 1 108 ? 0.62874 -15.54375 -30.25500 1.000 76.32045 ? 108 ILE A HG12 1 ATOM 2057 H HG13 . ILE A 1 108 ? 1.82371 -16.58631 -30.15234 1.000 76.32045 ? 108 ILE A HG13 1 ATOM 2058 H HG21 . ILE A 1 108 ? -0.04462 -14.95816 -27.57112 1.000 73.53779 ? 108 ILE A HG21 1 ATOM 2059 H HG22 . ILE A 1 108 ? 1.08518 -13.91932 -27.16139 1.000 73.53779 ? 108 ILE A HG22 1 ATOM 2060 H HG23 . ILE A 1 108 ? 0.35120 -13.78262 -28.56357 1.000 73.53779 ? 108 ILE A HG23 1 ATOM 2061 H HD11 . ILE A 1 108 ? -0.14503 -17.73186 -29.94794 1.000 82.55608 ? 108 ILE A HD11 1 ATOM 2062 H HD12 . ILE A 1 108 ? 0.59232 -17.77399 -28.54150 1.000 82.55608 ? 108 ILE A HD12 1 ATOM 2063 H HD13 . ILE A 1 108 ? -0.61974 -16.77363 -28.77322 1.000 82.55608 ? 108 ILE A HD13 1 ATOM 2064 N N . LYS A 1 109 ? 4.59949 -14.40613 -27.32986 1.000 58.10872 ? 109 LYS A N 1 ATOM 2065 C CA . LYS A 1 109 ? 5.41878 -13.76215 -26.30602 1.000 54.72650 ? 109 LYS A CA 1 ATOM 2066 C C . LYS A 1 109 ? 6.13414 -12.53692 -26.85027 1.000 53.08429 ? 109 LYS A C 1 ATOM 2067 O O . LYS A 1 109 ? 6.17722 -11.48704 -26.20127 1.000 52.04470 ? 109 LYS A O 1 ATOM 2068 C CB . LYS A 1 109 ? 6.45440 -14.73899 -25.75440 1.000 58.99270 ? 109 LYS A CB 1 ATOM 2069 C CG . LYS A 1 109 ? 6.35334 -14.98130 -24.28927 1.000 73.97629 ? 109 LYS A CG 1 ATOM 2070 C CD . LYS A 1 109 ? 7.17685 -16.20393 -23.88531 1.000 72.23297 ? 109 LYS A CD 1 ATOM 2071 C CE . LYS A 1 109 ? 8.66766 -15.89862 -23.79861 1.000 68.05978 ? 109 LYS A CE 1 ATOM 2072 N NZ . LYS A 1 109 ? 9.44531 -17.08736 -23.31643 1.000 73.35956 ? 109 LYS A NZ 1 ATOM 2073 H H . LYS A 1 109 ? 4.78261 -15.23631 -27.45969 1.000 69.73047 ? 109 LYS A H 1 ATOM 2074 H HA . LYS A 1 109 ? 4.82646 -13.48987 -25.58774 1.000 65.67179 ? 109 LYS A HA 1 ATOM 2075 H HB2 . LYS A 1 109 ? 6.34287 -15.59271 -26.20118 1.000 70.79125 ? 109 LYS A HB2 1 ATOM 2076 H HB3 . LYS A 1 109 ? 7.33952 -14.38442 -25.93260 1.000 70.79125 ? 109 LYS A HB3 1 ATOM 2077 H HG2 . LYS A 1 109 ? 6.69162 -14.20950 -23.80885 1.000 88.77155 ? 109 LYS A HG2 1 ATOM 2078 H HG3 . LYS A 1 109 ? 5.42695 -15.14105 -24.05015 1.000 88.77155 ? 109 LYS A HG3 1 ATOM 2079 H HD2 . LYS A 1 109 ? 6.88169 -16.51209 -23.01421 1.000 86.67957 ? 109 LYS A HD2 1 ATOM 2080 H HD3 . LYS A 1 109 ? 7.05095 -16.90385 -24.54499 1.000 86.67957 ? 109 LYS A HD3 1 ATOM 2081 H HE2 . LYS A 1 109 ? 8.99715 -15.65476 -24.67774 1.000 81.67173 ? 109 LYS A HE2 1 ATOM 2082 H HE3 . LYS A 1 109 ? 8.81019 -15.16815 -23.17652 1.000 81.67173 ? 109 LYS A HE3 1 ATOM 2083 H HZ1 . LYS A 1 109 ? 10.30986 -16.88344 -23.26100 1.000 88.03147 ? 109 LYS A HZ1 1 ATOM 2084 H HZ2 . LYS A 1 109 ? 9.15493 -17.33537 -22.51252 1.000 88.03147 ? 109 LYS A HZ2 1 ATOM 2085 H HZ3 . LYS A 1 109 ? 9.34454 -17.76692 -23.88224 1.000 88.03147 ? 109 LYS A HZ3 1 ATOM 2086 N N . VAL A 1 110 ? 6.73782 -12.66841 -28.03297 1.000 55.25056 ? 110 VAL A N 1 ATOM 2087 C CA . VAL A 1 110 ? 7.50381 -11.56639 -28.61057 1.000 52.41894 ? 110 VAL A CA 1 ATOM 2088 C C . VAL A 1 110 ? 6.60557 -10.37499 -28.89762 1.000 48.49645 ? 110 VAL A C 1 ATOM 2089 O O . VAL A 1 110 ? 6.96031 -9.22430 -28.60551 1.000 52.22725 ? 110 VAL A O 1 ATOM 2090 C CB . VAL A 1 110 ? 8.22840 -12.03580 -29.88305 1.000 55.64894 ? 110 VAL A CB 1 ATOM 2091 C CG1 . VAL A 1 110 ? 9.12048 -10.92940 -30.41810 1.000 58.42914 ? 110 VAL A CG1 1 ATOM 2092 C CG2 . VAL A 1 110 ? 9.05008 -13.26577 -29.58784 1.000 61.67496 ? 110 VAL A CG2 1 ATOM 2093 H H . VAL A 1 110 ? 6.71917 -13.37932 -28.51656 1.000 66.30068 ? 110 VAL A H 1 ATOM 2094 H HA . VAL A 1 110 ? 8.16903 -11.28745 -27.96206 1.000 62.90273 ? 110 VAL A HA 1 ATOM 2095 H HB . VAL A 1 110 ? 7.56998 -12.25649 -30.56030 1.000 66.77873 ? 110 VAL A HB 1 ATOM 2096 H HG11 . VAL A 1 110 ? 9.57224 -11.24602 -31.21595 1.000 70.11497 ? 110 VAL A HG11 1 ATOM 2097 H HG12 . VAL A 1 110 ? 8.57285 -10.15792 -30.63219 1.000 70.11497 ? 110 VAL A HG12 1 ATOM 2098 H HG13 . VAL A 1 110 ? 9.77287 -10.69401 -29.73997 1.000 70.11497 ? 110 VAL A HG13 1 ATOM 2099 H HG21 . VAL A 1 110 ? 9.50921 -13.54052 -30.39692 1.000 74.00995 ? 110 VAL A HG21 1 ATOM 2100 H HG22 . VAL A 1 110 ? 9.69650 -13.05515 -28.89597 1.000 74.00995 ? 110 VAL A HG22 1 ATOM 2101 H HG23 . VAL A 1 110 ? 8.46063 -13.97419 -29.28520 1.000 74.00995 ? 110 VAL A HG23 1 ATOM 2102 N N A LEU A 1 111 ? 5.43425 -10.62816 -29.48469 0.727 53.99856 ? 111 LEU A N 1 ATOM 2103 N N B LEU A 1 111 ? 5.42970 -10.61479 -29.47033 0.273 53.90034 ? 111 LEU A N 1 ATOM 2104 C CA A LEU A 1 111 ? 4.50717 -9.54446 -29.78889 0.727 51.55174 ? 111 LEU A CA 1 ATOM 2105 C CA B LEU A 1 111 ? 4.55448 -9.49013 -29.77543 0.273 51.65831 ? 111 LEU A CA 1 ATOM 2106 C C A LEU A 1 111 ? 4.03566 -8.86532 -28.51173 0.727 52.38557 ? 111 LEU A C 1 ATOM 2107 C C B LEU A 1 111 ? 4.01930 -8.84834 -28.50398 0.273 52.32695 ? 111 LEU A C 1 ATOM 2108 O O A LEU A 1 111 ? 4.03090 -7.63451 -28.41409 0.727 50.52918 ? 111 LEU A O 1 ATOM 2109 O O B LEU A 1 111 ? 3.95464 -7.61812 -28.40637 0.273 50.65566 ? 111 LEU A O 1 ATOM 2110 C CB A LEU A 1 111 ? 3.30877 -10.07853 -30.57487 0.727 54.13828 ? 111 LEU A CB 1 ATOM 2111 C CB B LEU A 1 111 ? 3.40478 -9.93832 -30.66347 0.273 54.09575 ? 111 LEU A CB 1 ATOM 2112 C CG A LEU A 1 111 ? 3.33685 -9.98918 -32.09868 0.727 58.22877 ? 111 LEU A CG 1 ATOM 2113 C CG B LEU A 1 111 ? 3.81219 -10.35390 -32.06966 0.273 56.32315 ? 111 LEU A CG 1 ATOM 2114 C CD1 A LEU A 1 111 ? 3.64921 -8.57363 -32.57784 0.727 59.50826 ? 111 LEU A CD1 1 ATOM 2115 C CD1 B LEU A 1 111 ? 2.57936 -10.86804 -32.73026 0.273 60.70752 ? 111 LEU A CD1 1 ATOM 2116 C CD2 A LEU A 1 111 ? 4.32456 -10.99834 -32.67772 0.727 59.40496 ? 111 LEU A CD2 1 ATOM 2117 C CD2 B LEU A 1 111 ? 4.41010 -9.21891 -32.87539 0.273 55.59299 ? 111 LEU A CD2 1 ATOM 2118 H H A LEU A 1 111 ? 5.15767 -11.40966 -29.71349 0.727 64.79827 ? 111 LEU A H 1 ATOM 2119 H H B LEU A 1 111 ? 5.12619 -11.39042 -29.68453 0.273 64.68041 ? 111 LEU A H 1 ATOM 2120 H HA A LEU A 1 111 ? 4.96352 -8.88992 -30.34044 0.727 61.86209 ? 111 LEU A HA 1 ATOM 2121 H HA B LEU A 1 111 ? 5.06688 -8.82540 -30.26172 0.273 61.98997 ? 111 LEU A HA 1 ATOM 2122 H HB2 A LEU A 1 111 ? 3.21043 -11.01819 -30.35518 0.727 64.96593 ? 111 LEU A HB2 1 ATOM 2123 H HB2 B LEU A 1 111 ? 2.97311 -10.70034 -30.24646 0.273 64.91490 ? 111 LEU A HB2 1 ATOM 2124 H HB3 A LEU A 1 111 ? 2.52541 -9.58603 -30.28384 0.727 64.96593 ? 111 LEU A HB3 1 ATOM 2125 H HB3 B LEU A 1 111 ? 2.77564 -9.20462 -30.74570 0.273 64.91490 ? 111 LEU A HB3 1 ATOM 2126 H HG A LEU A 1 111 ? 2.45306 -10.20858 -32.43286 0.727 69.87452 ? 111 LEU A HG 1 ATOM 2127 H HG B LEU A 1 111 ? 4.50876 -11.02767 -32.02828 0.273 67.58779 ? 111 LEU A HG 1 ATOM 2128 H HD11 A LEU A 1 111 ? 3.50831 -8.52639 -33.53639 0.727 71.40992 ? 111 LEU A HD11 1 ATOM 2129 H HD11 B LEU A 1 111 ? 2.78675 -11.10030 -33.64892 0.273 72.84902 ? 111 LEU A HD11 1 ATOM 2130 H HD12 A LEU A 1 111 ? 3.05975 -7.94991 -32.12572 0.727 71.40992 ? 111 LEU A HD12 1 ATOM 2131 H HD12 B LEU A 1 111 ? 2.26909 -11.65316 -32.25254 0.273 72.84902 ? 111 LEU A HD12 1 ATOM 2132 H HD13 A LEU A 1 111 ? 4.57341 -8.36618 -32.36874 0.727 71.40992 ? 111 LEU A HD13 1 ATOM 2133 H HD13 B LEU A 1 111 ? 1.89843 -10.17753 -32.70930 0.273 72.84902 ? 111 LEU A HD13 1 ATOM 2134 H HD21 A LEU A 1 111 ? 4.44268 -10.81771 -33.62340 0.727 71.28596 ? 111 LEU A HD21 1 ATOM 2135 H HD21 B LEU A 1 111 ? 4.52562 -9.50999 -33.79345 0.273 66.71159 ? 111 LEU A HD21 1 ATOM 2136 H HD22 A LEU A 1 111 ? 5.17295 -10.91067 -32.21572 0.727 71.28596 ? 111 LEU A HD22 1 ATOM 2137 H HD22 B LEU A 1 111 ? 3.80956 -8.45787 -32.84276 0.273 66.71159 ? 111 LEU A HD22 1 ATOM 2138 H HD23 A LEU A 1 111 ? 3.97118 -11.89310 -32.55348 0.727 71.28596 ? 111 LEU A HD23 1 ATOM 2139 H HD23 B LEU A 1 111 ? 5.26906 -8.97906 -32.49386 0.273 66.71159 ? 111 LEU A HD23 1 ATOM 2140 N N . LEU A 1 112 ? 3.62449 -9.65977 -27.52014 1.000 49.85060 ? 112 LEU A N 1 ATOM 2141 C CA . LEU A 1 112 ? 3.10498 -9.08756 -26.28444 1.000 49.76233 ? 112 LEU A CA 1 ATOM 2142 C C . LEU A 1 112 ? 4.15823 -8.22063 -25.60961 1.000 50.48277 ? 112 LEU A C 1 ATOM 2143 O O . LEU A 1 112 ? 3.85242 -7.12736 -25.10950 1.000 50.23705 ? 112 LEU A O 1 ATOM 2144 C CB . LEU A 1 112 ? 2.62152 -10.19543 -25.35402 1.000 47.50074 ? 112 LEU A CB 1 ATOM 2145 C CG . LEU A 1 112 ? 2.00460 -9.74035 -24.03316 1.000 55.54678 ? 112 LEU A CG 1 ATOM 2146 C CD1 . LEU A 1 112 ? 0.77818 -8.91735 -24.33023 1.000 59.31992 ? 112 LEU A CD1 1 ATOM 2147 C CD2 . LEU A 1 112 ? 1.63906 -10.94190 -23.18565 1.000 58.01950 ? 112 LEU A CD2 1 ATOM 2148 H H A LEU A 1 112 ? 3.63670 -10.51945 -27.53999 0.727 59.82072 ? 112 LEU A H 1 ATOM 2149 H H B LEU A 1 112 ? 3.64738 -10.51911 -27.54467 0.273 59.82072 ? 112 LEU A H 1 ATOM 2150 H HA . LEU A 1 112 ? 2.33981 -8.52672 -26.48660 1.000 59.71480 ? 112 LEU A HA 1 ATOM 2151 H HB2 . LEU A 1 112 ? 1.94711 -10.71117 -25.82314 1.000 57.00089 ? 112 LEU A HB2 1 ATOM 2152 H HB3 . LEU A 1 112 ? 3.37972 -10.76022 -25.13712 1.000 57.00089 ? 112 LEU A HB3 1 ATOM 2153 H HG . LEU A 1 112 ? 2.63860 -9.20379 -23.53212 1.000 66.65614 ? 112 LEU A HG 1 ATOM 2154 H HD11 . LEU A 1 112 ? 0.27312 -8.79618 -23.51100 1.000 71.18391 ? 112 LEU A HD11 1 ATOM 2155 H HD12 . LEU A 1 112 ? 1.05335 -8.05537 -24.67974 1.000 71.18391 ? 112 LEU A HD12 1 ATOM 2156 H HD13 . LEU A 1 112 ? 0.23682 -9.38297 -24.98676 1.000 71.18391 ? 112 LEU A HD13 1 ATOM 2157 H HD21 . LEU A 1 112 ? 1.25438 -10.63380 -22.35018 1.000 69.62340 ? 112 LEU A HD21 1 ATOM 2158 H HD22 . LEU A 1 112 ? 0.99407 -11.48340 -23.66697 1.000 69.62340 ? 112 LEU A HD22 1 ATOM 2159 H HD23 . LEU A 1 112 ? 2.44015 -11.45983 -23.00984 1.000 69.62340 ? 112 LEU A HD23 1 ATOM 2160 N N . GLN A 1 113 ? 5.41329 -8.67395 -25.61137 1.000 48.49616 ? 113 GLN A N 1 ATOM 2161 C CA . GLN A 1 113 ? 6.47251 -7.88139 -25.00081 1.000 48.96538 ? 113 GLN A CA 1 ATOM 2162 C C . GLN A 1 113 ? 6.70956 -6.59498 -25.77939 1.000 51.99304 ? 113 GLN A C 1 ATOM 2163 O O . GLN A 1 113 ? 6.88395 -5.52897 -25.17848 1.000 52.11937 ? 113 GLN A O 1 ATOM 2164 C CB . GLN A 1 113 ? 7.76241 -8.69188 -24.91679 1.000 57.07310 ? 113 GLN A CB 1 ATOM 2165 C CG . GLN A 1 113 ? 8.98080 -7.86148 -24.55352 1.000 67.68671 ? 113 GLN A CG 1 ATOM 2166 C CD . GLN A 1 113 ? 9.94911 -8.60884 -23.66701 1.000 86.32146 ? 113 GLN A CD 1 ATOM 2167 O OE1 . GLN A 1 113 ? 10.40890 -8.08470 -22.65543 1.000 103.10953 ? 113 GLN A OE1 1 ATOM 2168 N NE2 . GLN A 1 113 ? 10.26148 -9.84417 -24.03920 1.000 84.87506 ? 113 GLN A NE2 1 ATOM 2169 H H . GLN A 1 113 ? 5.66969 -9.42066 -25.95239 1.000 58.19540 ? 113 GLN A H 1 ATOM 2170 H HA . GLN A 1 113 ? 6.20455 -7.65102 -24.09747 1.000 58.75846 ? 113 GLN A HA 1 ATOM 2171 H HB2 . GLN A 1 113 ? 7.65715 -9.37681 -24.23804 1.000 68.48772 ? 113 GLN A HB2 1 ATOM 2172 H HB3 . GLN A 1 113 ? 7.92985 -9.10262 -25.77943 1.000 68.48772 ? 113 GLN A HB3 1 ATOM 2173 H HG2 . GLN A 1 113 ? 9.44809 -7.61236 -25.36622 1.000 81.22405 ? 113 GLN A HG2 1 ATOM 2174 H HG3 . GLN A 1 113 ? 8.69204 -7.06587 -24.07969 1.000 81.22405 ? 113 GLN A HG3 1 ATOM 2175 H HE21 . GLN A 1 113 ? 9.91657 -10.17854 -24.75253 1.000 101.85007 ? 113 GLN A HE21 1 ATOM 2176 H HE22 . GLN A 1 113 ? 10.80875 -10.31013 -23.56699 1.000 101.85007 ? 113 GLN A HE22 1 ATOM 2177 N N . THR A 1 114 ? 6.70740 -6.67878 -27.11560 1.000 49.00331 ? 114 THR A N 1 ATOM 2178 C CA . THR A 1 114 ? 6.93732 -5.49929 -27.94699 1.000 50.72424 ? 114 THR A CA 1 ATOM 2179 C C . THR A 1 114 ? 5.81479 -4.48148 -27.77363 1.000 48.56593 ? 114 THR A C 1 ATOM 2180 O O . THR A 1 114 ? 6.06819 -3.27792 -27.63634 1.000 46.72445 ? 114 THR A O 1 ATOM 2181 C CB . THR A 1 114 ? 7.06196 -5.92385 -29.41474 1.000 50.93590 ? 114 THR A CB 1 ATOM 2182 O OG1 . THR A 1 114 ? 8.22511 -6.74523 -29.59066 1.000 52.71234 ? 114 THR A OG1 1 ATOM 2183 C CG2 . THR A 1 114 ? 7.17846 -4.72322 -30.34016 1.000 50.16732 ? 114 THR A CG2 1 ATOM 2184 H H A THR A 1 114 ? 6.57590 -7.40313 -27.56015 0.180 58.80398 ? 114 THR A H 1 ATOM 2185 H H B THR A 1 114 ? 6.57590 -7.40313 -27.56015 0.820 58.80398 ? 114 THR A H 1 ATOM 2186 H HA . THR A 1 114 ? 7.76840 -5.07533 -27.68155 1.000 60.86909 ? 114 THR A HA 1 ATOM 2187 H HB . THR A 1 114 ? 6.26231 -6.41790 -29.65427 1.000 61.12308 ? 114 THR A HB 1 ATOM 2188 H HG1 . THR A 1 114 ? 8.16490 -7.43439 -29.11417 1.000 63.25480 ? 114 THR A HG1 1 ATOM 2189 H HG21 . THR A 1 114 ? 7.46576 -5.01002 -31.22113 1.000 60.20078 ? 114 THR A HG21 1 ATOM 2190 H HG22 . THR A 1 114 ? 6.31927 -4.27981 -30.41810 1.000 60.20078 ? 114 THR A HG22 1 ATOM 2191 H HG23 . THR A 1 114 ? 7.82663 -4.09384 -29.98707 1.000 60.20078 ? 114 THR A HG23 1 ATOM 2192 N N A LEU A 1 115 ? 4.56340 -4.94799 -27.76947 0.595 47.80110 ? 115 LEU A N 1 ATOM 2193 N N B LEU A 1 115 ? 4.56631 -4.95381 -27.76687 0.405 47.88900 ? 115 LEU A N 1 ATOM 2194 C CA A LEU A 1 115 ? 3.43378 -4.04155 -27.58962 0.595 48.43403 ? 115 LEU A CA 1 ATOM 2195 C CA B LEU A 1 115 ? 3.42345 -4.06410 -27.59198 0.405 48.44503 ? 115 LEU A CA 1 ATOM 2196 C C A LEU A 1 115 ? 3.42360 -3.42992 -26.19439 0.595 49.07557 ? 115 LEU A C 1 ATOM 2197 C C B LEU A 1 115 ? 3.40590 -3.44296 -26.20028 0.405 49.04961 ? 115 LEU A C 1 ATOM 2198 O O A LEU A 1 115 ? 3.08281 -2.25070 -26.02642 0.595 45.45200 ? 115 LEU A O 1 ATOM 2199 O O B LEU A 1 115 ? 3.05581 -2.26614 -26.04215 0.405 45.49811 ? 115 LEU A O 1 ATOM 2200 C CB A LEU A 1 115 ? 2.12525 -4.78608 -27.83979 0.595 48.75644 ? 115 LEU A CB 1 ATOM 2201 C CB B LEU A 1 115 ? 2.13417 -4.84293 -27.84329 0.405 48.82203 ? 115 LEU A CB 1 ATOM 2202 C CG A LEU A 1 115 ? 1.59891 -4.74256 -29.27024 0.595 55.51640 ? 115 LEU A CG 1 ATOM 2203 C CG B LEU A 1 115 ? 0.88060 -4.06975 -28.24223 0.405 48.95025 ? 115 LEU A CG 1 ATOM 2204 C CD1 A LEU A 1 115 ? 0.59628 -5.85433 -29.50465 0.595 58.55607 ? 115 LEU A CD1 1 ATOM 2205 C CD1 B LEU A 1 115 ? 1.02646 -3.45317 -29.61943 0.405 54.41405 ? 115 LEU A CD1 1 ATOM 2206 C CD2 A LEU A 1 115 ? 0.96800 -3.38977 -29.55337 0.595 54.43712 ? 115 LEU A CD2 1 ATOM 2207 C CD2 B LEU A 1 115 ? -0.31780 -5.00277 -28.19635 0.405 52.18805 ? 115 LEU A CD2 1 ATOM 2208 H H A LEU A 1 115 ? 4.34608 -5.77427 -27.86760 0.595 57.36132 ? 115 LEU A H 1 ATOM 2209 H H B LEU A 1 115 ? 4.35637 -5.78242 -27.86133 0.405 57.46680 ? 115 LEU A H 1 ATOM 2210 H HA A LEU A 1 115 ? 3.51147 -3.32241 -28.23592 0.595 58.12084 ? 115 LEU A HA 1 ATOM 2211 H HA B LEU A 1 115 ? 3.48308 -3.34194 -28.23683 0.405 58.13404 ? 115 LEU A HA 1 ATOM 2212 H HB2 A LEU A 1 115 ? 2.25883 -5.71906 -27.61043 0.595 58.50773 ? 115 LEU A HB2 1 ATOM 2213 H HB2 B LEU A 1 115 ? 2.30872 -5.47398 -28.55897 0.405 58.58643 ? 115 LEU A HB2 1 ATOM 2214 H HB3 A LEU A 1 115 ? 1.44251 -4.39880 -27.26989 0.595 58.50773 ? 115 LEU A HB3 1 ATOM 2215 H HB3 B LEU A 1 115 ? 1.91657 -5.31920 -27.02676 0.405 58.58643 ? 115 LEU A HB3 1 ATOM 2216 H HG A LEU A 1 115 ? 2.33752 -4.87227 -29.88549 0.595 66.61968 ? 115 LEU A HG 1 ATOM 2217 H HG B LEU A 1 115 ? 0.74113 -3.33978 -27.61885 0.405 58.74030 ? 115 LEU A HG 1 ATOM 2218 H HD11 A LEU A 1 115 ? 0.27043 -5.79863 -30.41658 0.595 70.26729 ? 115 LEU A HD11 1 ATOM 2219 H HD11 B LEU A 1 115 ? 0.18641 -3.03800 -29.87014 0.405 65.29686 ? 115 LEU A HD11 1 ATOM 2220 H HD12 A LEU A 1 115 ? 1.03267 -6.70862 -29.36092 0.595 70.26729 ? 115 LEU A HD12 1 ATOM 2221 H HD12 B LEU A 1 115 ? 1.73039 -2.78628 -29.59393 0.405 65.29686 ? 115 LEU A HD12 1 ATOM 2222 H HD13 A LEU A 1 115 ? -0.14111 -5.75083 -28.88300 0.595 70.26729 ? 115 LEU A HD13 1 ATOM 2223 H HD13 B LEU A 1 115 ? 1.25374 -4.14989 -30.25490 0.405 65.29686 ? 115 LEU A HD13 1 ATOM 2224 H HD21 A LEU A 1 115 ? 0.62530 -3.38485 -30.46081 0.595 65.32454 ? 115 LEU A HD21 1 ATOM 2225 H HD21 B LEU A 1 115 ? -1.11073 -4.51171 -28.46285 0.405 62.62566 ? 115 LEU A HD21 1 ATOM 2226 H HD22 A LEU A 1 115 ? 0.24369 -3.24149 -28.92545 0.595 65.32454 ? 115 LEU A HD22 1 ATOM 2227 H HD22 B LEU A 1 115 ? -0.16606 -5.74193 -28.80587 0.405 62.62566 ? 115 LEU A HD22 1 ATOM 2228 H HD23 A LEU A 1 115 ? 1.64157 -2.69941 -29.45042 0.595 65.32454 ? 115 LEU A HD23 1 ATOM 2229 H HD23 B LEU A 1 115 ? -0.42382 -5.33642 -27.29173 0.405 62.62566 ? 115 LEU A HD23 1 ATOM 2230 N N . THR A 1 116 ? 3.76367 -4.22045 -25.17691 1.000 45.10803 ? 116 THR A N 1 ATOM 2231 C CA . THR A 1 116 ? 3.73602 -3.70010 -23.81439 1.000 44.41821 ? 116 THR A CA 1 ATOM 2232 C C . THR A 1 116 ? 4.79579 -2.62308 -23.62835 1.000 44.87043 ? 116 THR A C 1 ATOM 2233 O O . THR A 1 116 ? 4.53162 -1.57820 -23.01447 1.000 45.87275 ? 116 THR A O 1 ATOM 2234 C CB . THR A 1 116 ? 3.92825 -4.83125 -22.81223 1.000 51.46842 ? 116 THR A CB 1 ATOM 2235 O OG1 . THR A 1 116 ? 2.88853 -5.80381 -22.97773 1.000 49.03813 ? 116 THR A OG1 1 ATOM 2236 C CG2 . THR A 1 116 ? 3.85652 -4.29278 -21.38213 1.000 51.31920 ? 116 THR A CG2 1 ATOM 2237 H H A THR A 1 116 ? 4.00817 -5.04193 -25.24750 0.595 54.12964 ? 116 THR A H 1 ATOM 2238 H H B THR A 1 116 ? 4.02157 -5.03806 -25.24475 0.405 54.12964 ? 116 THR A H 1 ATOM 2239 H HA . THR A 1 116 ? 2.86699 -3.30480 -23.64284 1.000 53.30186 ? 116 THR A HA 1 ATOM 2240 H HB . THR A 1 116 ? 4.79505 -5.24180 -22.95720 1.000 61.76211 ? 116 THR A HB 1 ATOM 2241 H HG1 . THR A 1 116 ? 2.92225 -6.13178 -23.75032 1.000 58.84576 ? 116 THR A HG1 1 ATOM 2242 H HG21 . THR A 1 116 ? 3.80292 -5.02892 -20.75275 1.000 61.58305 ? 116 THR A HG21 1 ATOM 2243 H HG22 . THR A 1 116 ? 4.64782 -3.76738 -21.18539 1.000 61.58305 ? 116 THR A HG22 1 ATOM 2244 H HG23 . THR A 1 116 ? 3.07216 -3.73170 -21.27785 1.000 61.58305 ? 116 THR A HG23 1 ATOM 2245 N N . GLU A 1 117 ? 6.00110 -2.86536 -24.14501 1.000 45.16504 ? 117 GLU A N 1 ATOM 2246 C CA . GLU A 1 117 ? 7.07068 -1.88124 -24.02023 1.000 50.79039 ? 117 GLU A CA 1 ATOM 2247 C C . GLU A 1 117 ? 6.65319 -0.56296 -24.65611 1.000 48.54743 ? 117 GLU A C 1 ATOM 2248 O O . GLU A 1 117 ? 6.85761 0.50940 -24.08127 1.000 46.43690 ? 117 GLU A O 1 ATOM 2249 C CB . GLU A 1 117 ? 8.35099 -2.39387 -24.68147 1.000 53.67736 ? 117 GLU A CB 1 ATOM 2250 C CG . GLU A 1 117 ? 8.91656 -3.66957 -24.06540 1.000 89.20100 ? 117 GLU A CG 1 ATOM 2251 C CD . GLU A 1 117 ? 10.36145 -3.52196 -23.61861 1.000 125.15992 ? 117 GLU A CD 1 ATOM 2252 O OE1 . GLU A 1 117 ? 11.08837 -2.70285 -24.21763 1.000 130.14777 ? 117 GLU A OE1 1 ATOM 2253 O OE2 . GLU A 1 117 ? 10.76771 -4.21976 -22.66269 1.000 120.01589 ? 117 GLU A OE2 1 ATOM 2254 H H . GLU A 1 117 ? 6.22133 -3.58195 -24.56644 1.000 54.19805 ? 117 GLU A H 1 ATOM 2255 H HA . GLU A 1 117 ? 7.25702 -1.73877 -23.07902 1.000 60.94846 ? 117 GLU A HA 1 ATOM 2256 H HB2 . GLU A 1 117 ? 8.16364 -2.57800 -25.61522 1.000 64.41283 ? 117 GLU A HB2 1 ATOM 2257 H HB3 . GLU A 1 117 ? 9.03208 -1.70702 -24.60893 1.000 64.41283 ? 117 GLU A HB3 1 ATOM 2258 H HG2 . GLU A 1 117 ? 8.38608 -3.90671 -23.28871 1.000 107.04120 ? 117 GLU A HG2 1 ATOM 2259 H HG3 . GLU A 1 117 ? 8.87817 -4.38134 -24.72328 1.000 107.04120 ? 117 GLU A HG3 1 ATOM 2260 N N . SER A 1 118 ? 6.05253 -0.63547 -25.84166 1.000 41.88606 ? 118 SER A N 1 ATOM 2261 C CA . SER A 1 118 ? 5.60319 0.56811 -26.53300 1.000 41.87293 ? 118 SER A CA 1 ATOM 2262 C C . SER A 1 118 ? 4.48148 1.25536 -25.76665 1.000 43.90686 ? 118 SER A C 1 ATOM 2263 O O . SER A 1 118 ? 4.50898 2.47518 -25.55690 1.000 42.88304 ? 118 SER A O 1 ATOM 2264 C CB . SER A 1 118 ? 5.15240 0.18658 -27.94140 1.000 43.60044 ? 118 SER A CB 1 ATOM 2265 O OG . SER A 1 118 ? 4.75209 1.33021 -28.67392 1.000 45.78530 ? 118 SER A OG 1 ATOM 2266 H H . SER A 1 118 ? 5.89370 -1.36653 -26.26584 1.000 50.26327 ? 118 SER A H 1 ATOM 2267 H HA . SER A 1 118 ? 6.33593 1.20001 -26.60150 1.000 50.24752 ? 118 SER A HA 1 ATOM 2268 H HB2 . SER A 1 118 ? 5.89039 -0.24103 -28.40337 1.000 52.32053 ? 118 SER A HB2 1 ATOM 2269 H HB3 . SER A 1 118 ? 4.40219 -0.42494 -27.87722 1.000 52.32053 ? 118 SER A HB3 1 ATOM 2270 H HG . SER A 1 118 ? 4.50309 1.10547 -29.44404 1.000 54.94237 ? 118 SER A HG 1 ATOM 2271 N N . HIS A 1 119 ? 3.49205 0.47588 -25.32309 1.000 45.52839 ? 119 HIS A N 1 ATOM 2272 C CA . HIS A 1 119 ? 2.38300 1.02035 -24.55088 1.000 42.08782 ? 119 HIS A CA 1 ATOM 2273 C C . HIS A 1 119 ? 2.88218 1.78606 -23.33372 1.000 43.76910 ? 119 HIS A C 1 ATOM 2274 O O . HIS A 1 119 ? 2.40887 2.89196 -23.04259 1.000 43.76230 ? 119 HIS A O 1 ATOM 2275 C CB . HIS A 1 119 ? 1.45372 -0.11663 -24.12040 1.000 43.22501 ? 119 HIS A CB 1 ATOM 2276 C CG . HIS A 1 119 ? 0.11606 0.34303 -23.62390 1.000 42.08234 ? 119 HIS A CG 1 ATOM 2277 N ND1 . HIS A 1 119 ? -0.07479 0.88362 -22.37035 1.000 42.48784 ? 119 HIS A ND1 1 ATOM 2278 C CD2 . HIS A 1 119 ? -1.10069 0.32909 -24.21562 1.000 45.76492 ? 119 HIS A CD2 1 ATOM 2279 C CE1 . HIS A 1 119 ? -1.35284 1.17769 -22.21000 1.000 47.27151 ? 119 HIS A CE1 1 ATOM 2280 N NE2 . HIS A 1 119 ? -1.99752 0.84939 -23.31510 1.000 46.65247 ? 119 HIS A NE2 1 ATOM 2281 H H . HIS A 1 119 ? 3.44209 -0.37208 -25.45752 1.000 54.63407 ? 119 HIS A H 1 ATOM 2282 H HA . HIS A 1 119 ? 1.88227 1.63597 -25.10872 1.000 50.50539 ? 119 HIS A HA 1 ATOM 2283 H HB2 . HIS A 1 119 ? 1.30172 -0.69878 -24.88125 1.000 51.87001 ? 119 HIS A HB2 1 ATOM 2284 H HB3 . HIS A 1 119 ? 1.88002 -0.61197 -23.40360 1.000 51.87001 ? 119 HIS A HB3 1 ATOM 2285 H HD1 . HIS A 1 119 ? 0.54174 1.00978 -21.78420 1.000 50.98541 ? 119 HIS A HD1 1 ATOM 2286 H HD2 . HIS A 1 119 ? -1.29372 0.02395 -25.07267 1.000 54.91791 ? 119 HIS A HD2 1 ATOM 2287 H HE1 . HIS A 1 119 ? -1.73371 1.55210 -21.44865 1.000 56.72581 ? 119 HIS A HE1 1 ATOM 2288 N N . ARG A 1 120 ? 3.84409 1.21166 -22.60553 1.000 40.75198 ? 120 ARG A N 1 ATOM 2289 C CA . ARG A 1 120 ? 4.27613 1.81412 -21.34888 1.000 43.59113 ? 120 ARG A CA 1 ATOM 2290 C C . ARG A 1 120 ? 5.02303 3.12217 -21.57974 1.000 43.52854 ? 120 ARG A C 1 ATOM 2291 O O . ARG A 1 120 ? 5.01060 3.99610 -20.70638 1.000 47.93958 ? 120 ARG A O 1 ATOM 2292 C CB . ARG A 1 120 ? 5.13746 0.82201 -20.56259 1.000 45.68812 ? 120 ARG A CB 1 ATOM 2293 C CG . ARG A 1 120 ? 4.39541 -0.46399 -20.22977 1.000 49.87105 ? 120 ARG A CG 1 ATOM 2294 C CD . ARG A 1 120 ? 4.18218 -0.65702 -18.73216 1.000 48.75385 ? 120 ARG A CD 1 ATOM 2295 N NE . ARG A 1 120 ? 3.10017 0.16119 -18.18986 1.000 48.31343 ? 120 ARG A NE 1 ATOM 2296 C CZ . ARG A 1 120 ? 2.74609 0.18819 -16.91125 1.000 49.98133 ? 120 ARG A CZ 1 ATOM 2297 N NH1 . ARG A 1 120 ? 3.33379 -0.58958 -16.00432 1.000 49.95041 ? 120 ARG A NH1 1 ATOM 2298 N NH2 . ARG A 1 120 ? 1.76665 1.00315 -16.52831 1.000 51.89206 ? 120 ARG A NH2 1 ATOM 2299 H H . ARG A 1 120 ? 4.25412 0.48537 -22.81524 1.000 48.90238 ? 120 ARG A H 1 ATOM 2300 H HA . ARG A 1 120 ? 3.49537 2.01634 -20.80998 1.000 52.30936 ? 120 ARG A HA 1 ATOM 2301 H HB2 . ARG A 1 120 ? 5.91663 0.59113 -21.09220 1.000 54.82574 ? 120 ARG A HB2 1 ATOM 2302 H HB3 . ARG A 1 120 ? 5.41320 1.23441 -19.72906 1.000 54.82574 ? 120 ARG A HB3 1 ATOM 2303 H HG2 . ARG A 1 120 ? 3.52405 -0.44498 -20.65553 1.000 59.84526 ? 120 ARG A HG2 1 ATOM 2304 H HG3 . ARG A 1 120 ? 4.90869 -1.21873 -20.55811 1.000 59.84526 ? 120 ARG A HG3 1 ATOM 2305 H HD2 . ARG A 1 120 ? 3.96439 -1.58709 -18.56352 1.000 58.50462 ? 120 ARG A HD2 1 ATOM 2306 H HD3 . ARG A 1 120 ? 4.99816 -0.41749 -18.26558 1.000 58.50462 ? 120 ARG A HD3 1 ATOM 2307 H HE . ARG A 1 120 ? 2.66246 0.65978 -18.73706 1.000 57.97612 ? 120 ARG A HE 1 ATOM 2308 H HH11 . ARG A 1 120 ? 3.96102 -1.12812 -16.24131 1.000 59.94050 ? 120 ARG A HH11 1 ATOM 2309 H HH12 . ARG A 1 120 ? 3.08615 -0.55341 -15.18154 1.000 59.94050 ? 120 ARG A HH12 1 ATOM 2310 H HH21 . ARG A 1 120 ? 1.37243 1.50304 -17.10649 1.000 62.27047 ? 120 ARG A HH21 1 ATOM 2311 H HH22 . ARG A 1 120 ? 1.52776 1.03003 -15.70259 1.000 62.27047 ? 120 ARG A HH22 1 ATOM 2312 N N . ILE A 1 121 ? 5.65131 3.27924 -22.74500 1.000 40.95817 ? 121 ILE A N 1 ATOM 2313 C CA . ILE A 1 121 ? 6.26875 4.54961 -23.11551 1.000 41.62252 ? 121 ILE A CA 1 ATOM 2314 C C . ILE A 1 121 ? 5.19925 5.57448 -23.47727 1.000 44.02757 ? 121 ILE A C 1 ATOM 2315 O O . ILE A 1 121 ? 5.23178 6.71931 -23.01190 1.000 45.88699 ? 121 ILE A O 1 ATOM 2316 C CB . ILE A 1 121 ? 7.25529 4.34423 -24.27669 1.000 45.08529 ? 121 ILE A CB 1 ATOM 2317 C CG1 . ILE A 1 121 ? 8.53113 3.67031 -23.76608 1.000 44.68999 ? 121 ILE A CG1 1 ATOM 2318 C CG2 . ILE A 1 121 ? 7.58345 5.67291 -24.96242 1.000 46.27608 ? 121 ILE A CG2 1 ATOM 2319 C CD1 . ILE A 1 121 ? 9.29418 2.94463 -24.87093 1.000 51.14260 ? 121 ILE A CD1 1 ATOM 2320 H H . ILE A 1 121 ? 5.73417 2.66397 -23.34014 1.000 49.14980 ? 121 ILE A H 1 ATOM 2321 H HA . ILE A 1 121 ? 6.76304 4.88512 -22.35131 1.000 49.94702 ? 121 ILE A HA 1 ATOM 2322 H HB . ILE A 1 121 ? 6.83571 3.76644 -24.93321 1.000 54.10235 ? 121 ILE A HB 1 ATOM 2323 H HG12 . ILE A 1 121 ? 9.11671 4.34581 -23.38966 1.000 53.62798 ? 121 ILE A HG12 1 ATOM 2324 H HG13 . ILE A 1 121 ? 8.29494 3.01988 -23.08633 1.000 53.62798 ? 121 ILE A HG13 1 ATOM 2325 H HG21 . ILE A 1 121 ? 8.39281 5.56645 -25.48635 1.000 55.53129 ? 121 ILE A HG21 1 ATOM 2326 H HG22 . ILE A 1 121 ? 6.84519 5.92059 -25.54080 1.000 55.53129 ? 121 ILE A HG22 1 ATOM 2327 H HG23 . ILE A 1 121 ? 7.71546 6.35402 -24.28450 1.000 55.53129 ? 121 ILE A HG23 1 ATOM 2328 H HD11 . ILE A 1 121 ? 10.07999 2.52399 -24.48821 1.000 61.37112 ? 121 ILE A HD11 1 ATOM 2329 H HD12 . ILE A 1 121 ? 8.71682 2.27140 -25.26376 1.000 61.37112 ? 121 ILE A HD12 1 ATOM 2330 H HD13 . ILE A 1 121 ? 9.55939 3.58805 -25.54664 1.000 61.37112 ? 121 ILE A HD13 1 ATOM 2331 N N . LEU A 1 122 ? 4.23054 5.17486 -24.30375 1.000 40.11593 ? 122 LEU A N 1 ATOM 2332 C CA . LEU A 1 122 ? 3.17536 6.09593 -24.71555 1.000 43.24139 ? 122 LEU A CA 1 ATOM 2333 C C . LEU A 1 122 ? 2.36508 6.60019 -23.52257 1.000 42.20625 ? 122 LEU A C 1 ATOM 2334 O O . LEU A 1 122 ? 1.85708 7.72578 -23.55343 1.000 43.05587 ? 122 LEU A O 1 ATOM 2335 C CB . LEU A 1 122 ? 2.25270 5.42180 -25.73371 1.000 43.94220 ? 122 LEU A CB 1 ATOM 2336 C CG . LEU A 1 122 ? 2.83629 5.06984 -27.10505 1.000 50.35343 ? 122 LEU A CG 1 ATOM 2337 C CD1 . LEU A 1 122 ? 1.75153 4.37973 -27.94319 1.000 54.49136 ? 122 LEU A CD1 1 ATOM 2338 C CD2 . LEU A 1 122 ? 3.38686 6.29284 -27.80193 1.000 49.23369 ? 122 LEU A CD2 1 ATOM 2339 H H . LEU A 1 122 ? 4.16300 4.38450 -24.63596 1.000 48.13911 ? 122 LEU A H 1 ATOM 2340 H HA . LEU A 1 122 ? 3.58701 6.86287 -25.14361 1.000 51.88966 ? 122 LEU A HA 1 ATOM 2341 H HB2 . LEU A 1 122 ? 1.93832 4.59163 -25.34271 1.000 52.73064 ? 122 LEU A HB2 1 ATOM 2342 H HB3 . LEU A 1 122 ? 1.50416 6.01767 -25.89346 1.000 52.73064 ? 122 LEU A HB3 1 ATOM 2343 H HG . LEU A 1 122 ? 3.58438 4.46144 -26.99960 1.000 60.42412 ? 122 LEU A HG 1 ATOM 2344 H HD11 . LEU A 1 122 ? 2.17338 3.90404 -28.67577 1.000 65.38963 ? 122 LEU A HD11 1 ATOM 2345 H HD12 . LEU A 1 122 ? 1.26609 3.75664 -27.38015 1.000 65.38963 ? 122 LEU A HD12 1 ATOM 2346 H HD13 . LEU A 1 122 ? 1.14549 5.05250 -28.29104 1.000 65.38963 ? 122 LEU A HD13 1 ATOM 2347 H HD21 . LEU A 1 122 ? 3.19516 6.22884 -28.75064 1.000 59.08043 ? 122 LEU A HD21 1 ATOM 2348 H HD22 . LEU A 1 122 ? 2.96490 7.08397 -27.43184 1.000 59.08043 ? 122 LEU A HD22 1 ATOM 2349 H HD23 . LEU A 1 122 ? 4.34563 6.33231 -27.66012 1.000 59.08043 ? 122 LEU A HD23 1 ATOM 2350 N N . GLU A 1 123 ? 2.22980 5.79304 -22.46481 1.000 40.15594 ? 123 GLU A N 1 ATOM 2351 C CA . GLU A 1 123 ? 1.47647 6.25627 -21.30532 1.000 42.04544 ? 123 GLU A CA 1 ATOM 2352 C C . GLU A 1 123 ? 2.04863 7.55184 -20.74938 1.000 41.86689 ? 123 GLU A C 1 ATOM 2353 O O . GLU A 1 123 ? 1.30033 8.38463 -20.22515 1.000 43.42959 ? 123 GLU A O 1 ATOM 2354 C CB . GLU A 1 123 ? 1.48124 5.20445 -20.19623 1.000 44.12718 ? 123 GLU A CB 1 ATOM 2355 C CG . GLU A 1 123 ? 0.72900 3.92626 -20.49599 1.000 45.01769 ? 123 GLU A CG 1 ATOM 2356 C CD . GLU A 1 123 ? 1.14134 2.82280 -19.54858 1.000 47.49146 ? 123 GLU A CD 1 ATOM 2357 O OE1 . GLU A 1 123 ? 1.39566 3.14237 -18.36667 1.000 47.63822 ? 123 GLU A OE1 1 ATOM 2358 O OE2 . GLU A 1 123 ? 1.22775 1.64485 -19.97499 1.000 43.36006 ? 123 GLU A OE2 1 ATOM 2359 H H . GLU A 1 123 ? 2.55489 4.99959 -22.39882 1.000 48.18713 ? 123 GLU A H 1 ATOM 2360 H HA . GLU A 1 123 ? 0.56051 6.40267 -21.58901 1.000 50.45453 ? 123 GLU A HA 1 ATOM 2361 H HB2 . GLU A 1 123 ? 2.40197 4.95975 -20.01376 1.000 52.95261 ? 123 GLU A HB2 1 ATOM 2362 H HB3 . GLU A 1 123 ? 1.07890 5.59563 -19.40503 1.000 52.95261 ? 123 GLU A HB3 1 ATOM 2363 H HG2 . GLU A 1 123 ? -0.22323 4.08004 -20.39347 1.000 54.02123 ? 123 GLU A HG2 1 ATOM 2364 H HG3 . GLU A 1 123 ? 0.92340 3.64193 -21.40278 1.000 54.02123 ? 123 GLU A HG3 1 ATOM 2365 N N . LYS A 1 124 ? 3.36993 7.71920 -20.81648 1.000 41.06840 ? 124 LYS A N 1 ATOM 2366 C CA A LYS A 1 124 ? 4.00245 8.89216 -20.22742 0.600 47.44311 ? 124 LYS A CA 1 ATOM 2367 C CA B LYS A 1 124 ? 4.00586 8.89134 -20.23073 0.400 47.43362 ? 124 LYS A CA 1 ATOM 2368 C C . LYS A 1 124 ? 3.77577 10.14560 -21.06426 1.000 40.79781 ? 124 LYS A C 1 ATOM 2369 O O . LYS A 1 124 ? 3.97027 11.25932 -20.55742 1.000 42.87600 ? 124 LYS A O 1 ATOM 2370 C CB A LYS A 1 124 ? 5.50651 8.65739 -20.05798 0.600 49.11773 ? 124 LYS A CB 1 ATOM 2371 C CB B LYS A 1 124 ? 5.51165 8.66060 -20.07463 0.400 49.14972 ? 124 LYS A CB 1 ATOM 2372 C CG A LYS A 1 124 ? 5.89154 7.56474 -19.06747 0.600 54.32894 ? 124 LYS A CG 1 ATOM 2373 C CG B LYS A 1 124 ? 5.91340 7.44743 -19.24054 0.400 54.54358 ? 124 LYS A CG 1 ATOM 2374 C CD A LYS A 1 124 ? 5.38952 7.86646 -17.67048 0.600 58.69339 ? 124 LYS A CD 1 ATOM 2375 C CD B LYS A 1 124 ? 5.15685 7.37492 -17.92615 0.400 57.55713 ? 124 LYS A CD 1 ATOM 2376 C CE A LYS A 1 124 ? 6.17665 7.09505 -16.62226 0.600 71.57042 ? 124 LYS A CE 1 ATOM 2377 C CE B LYS A 1 124 ? 5.81663 6.42008 -16.92516 0.400 69.68575 ? 124 LYS A CE 1 ATOM 2378 N NZ A LYS A 1 124 ? 5.39863 6.94814 -15.36400 0.600 69.50068 ? 124 LYS A NZ 1 ATOM 2379 N NZ B LYS A 1 124 ? 6.95547 5.63728 -17.48866 0.400 65.70615 ? 124 LYS A NZ 1 ATOM 2380 H H A LYS A 1 124 ? 3.91529 7.17208 -21.19442 0.600 49.28208 ? 124 LYS A H 1 ATOM 2381 H H B LYS A 1 124 ? 3.91464 7.17090 -21.19364 0.400 49.28208 ? 124 LYS A H 1 ATOM 2382 H HA A LYS A 1 124 ? 3.62090 9.03777 -19.34758 0.600 56.93173 ? 124 LYS A HA 1 ATOM 2383 H HA B LYS A 1 124 ? 3.62877 9.03283 -19.34830 0.400 56.92035 ? 124 LYS A HA 1 ATOM 2384 H HB2 A LYS A 1 124 ? 5.87564 8.40904 -20.91994 0.600 58.94128 ? 124 LYS A HB2 1 ATOM 2385 H HB2 B LYS A 1 124 ? 5.89423 8.54173 -20.95803 0.400 58.97966 ? 124 LYS A HB2 1 ATOM 2386 H HB3 A LYS A 1 124 ? 5.91137 9.48298 -19.74913 0.600 58.94128 ? 124 LYS A HB3 1 ATOM 2387 H HB3 B LYS A 1 124 ? 5.89655 9.44258 -19.64888 0.400 58.97966 ? 124 LYS A HB3 1 ATOM 2388 H HG2 A LYS A 1 124 ? 5.50417 6.72272 -19.35360 0.600 65.19473 ? 124 LYS A HG2 1 ATOM 2389 H HG2 B LYS A 1 124 ? 5.72366 6.63935 -19.74242 0.400 65.45230 ? 124 LYS A HG2 1 ATOM 2390 H HG3 A LYS A 1 124 ? 6.85807 7.49052 -19.03290 0.600 65.19473 ? 124 LYS A HG3 1 ATOM 2391 H HG3 B LYS A 1 124 ? 6.86112 7.49876 -19.04029 0.400 65.45230 ? 124 LYS A HG3 1 ATOM 2392 H HD2 A LYS A 1 124 ? 5.48816 8.81450 -17.49051 0.600 70.43207 ? 124 LYS A HD2 1 ATOM 2393 H HD2 B LYS A 1 124 ? 5.12884 8.25820 -17.52624 0.400 69.06855 ? 124 LYS A HD2 1 ATOM 2394 H HD3 A LYS A 1 124 ? 4.45632 7.61099 -17.60137 0.600 70.43207 ? 124 LYS A HD3 1 ATOM 2395 H HD3 B LYS A 1 124 ? 4.25560 7.05849 -18.09506 0.400 69.06855 ? 124 LYS A HD3 1 ATOM 2396 H HE2 A LYS A 1 124 ? 6.38151 6.20936 -16.96061 0.600 85.88451 ? 124 LYS A HE2 1 ATOM 2397 H HE2 B LYS A 1 124 ? 6.15681 6.93812 -16.17896 0.400 83.62290 ? 124 LYS A HE2 1 ATOM 2398 H HE3 A LYS A 1 124 ? 6.99735 7.57126 -16.42081 0.600 85.88451 ? 124 LYS A HE3 1 ATOM 2399 H HE3 B LYS A 1 124 ? 5.15074 5.78732 -16.61356 0.400 83.62290 ? 124 LYS A HE3 1 ATOM 2400 H HZ1 A LYS A 1 124 ? 5.87305 6.49294 -14.76415 0.600 83.40082 ? 124 LYS A HZ1 1 ATOM 2401 H HZ1 B LYS A 1 124 ? 6.69798 5.21499 -18.22858 0.400 78.84738 ? 124 LYS A HZ1 1 ATOM 2402 H HZ2 A LYS A 1 124 ? 5.20479 7.75023 -15.03056 0.600 83.40082 ? 124 LYS A HZ2 1 ATOM 2403 H HZ2 B LYS A 1 124 ? 7.63066 6.18209 -17.68714 0.400 78.84738 ? 124 LYS A HZ2 1 ATOM 2404 H HZ3 A LYS A 1 124 ? 4.64015 6.51102 -15.52438 0.600 83.40082 ? 124 LYS A HZ3 1 ATOM 2405 H HZ3 B LYS A 1 124 ? 7.23461 5.03575 -16.89507 0.400 78.84738 ? 124 LYS A HZ3 1 ATOM 2406 N N . TYR A 1 125 ? 3.38975 9.99018 -22.33033 1.000 40.68775 ? 125 TYR A N 1 ATOM 2407 C CA . TYR A 1 125 ? 3.11376 11.11898 -23.20713 1.000 42.99416 ? 125 TYR A CA 1 ATOM 2408 C C . TYR A 1 125 ? 1.62754 11.39251 -23.35785 1.000 44.37636 ? 125 TYR A C 1 ATOM 2409 O O . TYR A 1 125 ? 1.25522 12.30141 -24.10594 1.000 47.43176 ? 125 TYR A O 1 ATOM 2410 C CB . TYR A 1 125 ? 3.72312 10.87876 -24.59237 1.000 42.46591 ? 125 TYR A CB 1 ATOM 2411 C CG . TYR A 1 125 ? 5.22270 10.92190 -24.60069 1.000 39.41224 ? 125 TYR A CG 1 ATOM 2412 C CD1 . TYR A 1 125 ? 5.90373 12.12300 -24.56894 1.000 38.61545 ? 125 TYR A CD1 1 ATOM 2413 C CD2 . TYR A 1 125 ? 5.96786 9.74465 -24.59028 1.000 45.67465 ? 125 TYR A CD2 1 ATOM 2414 C CE1 . TYR A 1 125 ? 7.27239 12.16444 -24.56142 1.000 39.88064 ? 125 TYR A CE1 1 ATOM 2415 C CE2 . TYR A 1 125 ? 7.33673 9.77827 -24.58461 1.000 48.74228 ? 125 TYR A CE2 1 ATOM 2416 C CZ . TYR A 1 125 ? 7.98566 10.98895 -24.57057 1.000 47.27868 ? 125 TYR A CZ 1 ATOM 2417 O OH . TYR A 1 125 ? 9.35167 11.02574 -24.56553 1.000 45.20589 ? 125 TYR A OH 1 ATOM 2418 H H . TYR A 1 125 ? 3.27964 9.22540 -22.70794 1.000 48.82530 ? 125 TYR A H 1 ATOM 2419 H HA . TYR A 1 125 ? 3.53210 11.90840 -22.82938 1.000 51.59299 ? 125 TYR A HA 1 ATOM 2420 H HB2 . TYR A 1 125 ? 3.44906 10.00321 -24.90735 1.000 50.95910 ? 125 TYR A HB2 1 ATOM 2421 H HB3 . TYR A 1 125 ? 3.40253 11.56475 -25.19861 1.000 50.95910 ? 125 TYR A HB3 1 ATOM 2422 H HD1 . TYR A 1 125 ? 5.42339 12.91917 -24.55234 1.000 46.33854 ? 125 TYR A HD1 1 ATOM 2423 H HD2 . TYR A 1 125 ? 5.52937 8.92452 -24.58713 1.000 54.80957 ? 125 TYR A HD2 1 ATOM 2424 H HE1 . TYR A 1 125 ? 7.71624 12.98162 -24.55021 1.000 47.85676 ? 125 TYR A HE1 1 ATOM 2425 H HE2 . TYR A 1 125 ? 7.82416 8.98626 -24.59024 1.000 58.49074 ? 125 TYR A HE2 1 ATOM 2426 H HH . TYR A 1 125 ? 9.65997 10.24513 -24.53087 1.000 54.24707 ? 125 TYR A HH 1 ATOM 2427 N N . THR A 1 126 ? 0.78259 10.65631 -22.64509 1.000 44.54897 ? 126 THR A N 1 ATOM 2428 C CA A THR A 1 126 ? -0.66775 10.74110 -22.73092 0.873 46.74709 ? 126 THR A CA 1 ATOM 2429 C CA B THR A 1 126 ? -0.65858 10.81586 -22.75197 0.127 46.98102 ? 126 THR A CA 1 ATOM 2430 C C . THR A 1 126 ? -1.24520 11.25135 -21.41579 1.000 49.35636 ? 126 THR A C 1 ATOM 2431 O O . THR A 1 126 ? -0.75535 10.89055 -20.34469 1.000 51.11230 ? 126 THR A O 1 ATOM 2432 C CB A THR A 1 126 ? -1.26224 9.35756 -23.01847 0.873 49.55776 ? 126 THR A CB 1 ATOM 2433 C CB B THR A 1 126 ? -1.31829 9.51494 -23.21810 0.127 50.23962 ? 126 THR A CB 1 ATOM 2434 O OG1 A THR A 1 126 ? -0.60035 8.77214 -24.14401 0.873 52.00691 ? 126 THR A OG1 1 ATOM 2435 O OG1 B THR A 1 126 ? -0.85511 8.42844 -22.40943 0.127 51.19712 ? 126 THR A OG1 1 ATOM 2436 C CG2 A THR A 1 126 ? -2.74980 9.46494 -23.27680 0.873 52.24232 ? 126 THR A CG2 1 ATOM 2437 C CG2 B THR A 1 126 ? -0.97100 9.24203 -24.67662 0.127 52.22218 ? 126 THR A CG2 1 ATOM 2438 H H A THR A 1 126 ? 1.04146 10.06823 -22.07347 0.873 53.45876 ? 126 THR A H 1 ATOM 2439 H H B THR A 1 126 ? 1.02574 10.05007 -22.08566 0.127 53.45876 ? 126 THR A H 1 ATOM 2440 H HA A THR A 1 126 ? -0.91159 11.35856 -23.43816 0.873 56.09651 ? 126 THR A HA 1 ATOM 2441 H HA B THR A 1 126 ? -0.86055 11.51037 -23.39832 0.127 56.37722 ? 126 THR A HA 1 ATOM 2442 H HB A THR A 1 126 ? -1.13657 8.77886 -22.25022 0.873 59.46931 ? 126 THR A HB 1 ATOM 2443 H HB B THR A 1 126 ? -2.28216 9.58889 -23.13815 0.127 60.28754 ? 126 THR A HB 1 ATOM 2444 H HG1 A THR A 1 126 ? 0.21235 8.65201 -23.96886 0.873 62.40829 ? 126 THR A HG1 1 ATOM 2445 H HG1 B THR A 1 126 ? -1.17687 7.70465 -22.68906 0.127 61.43655 ? 126 THR A HG1 1 ATOM 2446 H HG21 A THR A 1 126 ? -3.10405 8.60111 -23.53987 0.873 62.69078 ? 126 THR A HG21 1 ATOM 2447 H HG21 B THR A 1 126 ? -1.18321 8.32269 -24.90176 0.127 62.66662 ? 126 THR A HG21 1 ATOM 2448 H HG22 A THR A 1 126 ? -3.20558 9.76061 -22.47322 0.873 62.69078 ? 126 THR A HG22 1 ATOM 2449 H HG22 B THR A 1 126 ? -1.47856 9.83290 -25.25468 0.127 62.66662 ? 126 THR A HG22 1 ATOM 2450 H HG23 A THR A 1 126 ? -2.91791 10.10370 -23.98717 0.873 62.69078 ? 126 THR A HG23 1 ATOM 2451 H HG23 B THR A 1 126 ? -0.02441 9.39225 -24.82597 0.127 62.66662 ? 126 THR A HG23 1 ATOM 2452 N N . GLN A 1 127 ? -2.30940 12.04682 -21.48815 1.000 58.62459 ? 127 GLN A N 1 ATOM 2453 C CA . GLN A 1 127 ? -2.95666 12.49109 -20.25693 1.000 59.10049 ? 127 GLN A CA 1 ATOM 2454 C C . GLN A 1 127 ? -3.68080 11.32561 -19.58528 1.000 59.17707 ? 127 GLN A C 1 ATOM 2455 O O . GLN A 1 127 ? -4.34693 10.53642 -20.25954 1.000 54.76288 ? 127 GLN A O 1 ATOM 2456 C CB . GLN A 1 127 ? -3.95104 13.62260 -20.51361 1.000 67.87383 ? 127 GLN A CB 1 ATOM 2457 C CG . GLN A 1 127 ? -3.51550 14.62923 -21.54574 1.000 78.11134 ? 127 GLN A CG 1 ATOM 2458 C CD . GLN A 1 127 ? -4.62774 15.03039 -22.46671 1.000 102.94781 ? 127 GLN A CD 1 ATOM 2459 O OE1 . GLN A 1 127 ? -5.81020 14.84551 -22.17222 1.000 106.02817 ? 127 GLN A OE1 1 ATOM 2460 N NE2 . GLN A 1 127 ? -4.25760 15.62606 -23.59069 1.000 102.37203 ? 127 GLN A NE2 1 ATOM 2461 H H . GLN A 1 127 ? -2.66633 12.33542 -22.21541 1.000 70.34950 ? 127 GLN A H 1 ATOM 2462 H HA . GLN A 1 127 ? -2.27106 12.82742 -19.65883 1.000 70.92059 ? 127 GLN A HA 1 ATOM 2463 H HB2 . GLN A 1 127 ? -4.78567 13.23449 -20.81966 1.000 81.44859 ? 127 GLN A HB2 1 ATOM 2464 H HB3 . GLN A 1 127 ? -4.09300 14.10128 -19.68199 1.000 81.44859 ? 127 GLN A HB3 1 ATOM 2465 H HG2 . GLN A 1 127 ? -3.19639 15.42669 -21.09505 1.000 93.73361 ? 127 GLN A HG2 1 ATOM 2466 H HG3 . GLN A 1 127 ? -2.80496 14.24477 -22.08260 1.000 93.73361 ? 127 GLN A HG3 1 ATOM 2467 H HE21 . GLN A 1 127 ? -3.42350 15.75956 -23.75210 1.000 122.84644 ? 127 GLN A HE21 1 ATOM 2468 H HE22 . GLN A 1 127 ? -4.85144 15.87924 -24.15890 1.000 122.84644 ? 127 GLN A HE22 1 ATOM 2469 N N . PRO A 1 128 ? -3.59486 11.20564 -18.25447 1.000 60.30902 ? 128 PRO A N 1 ATOM 2470 C CA . PRO A 1 128 ? -4.22787 10.05619 -17.58711 1.000 63.92355 ? 128 PRO A CA 1 ATOM 2471 C C . PRO A 1 128 ? -5.73150 10.01239 -17.76413 1.000 63.22939 ? 128 PRO A C 1 ATOM 2472 O O . PRO A 1 128 ? -6.32420 8.92738 -17.70101 1.000 62.63649 ? 128 PRO A O 1 ATOM 2473 C CB . PRO A 1 128 ? -3.84567 10.25427 -16.10962 1.000 77.22393 ? 128 PRO A CB 1 ATOM 2474 C CG . PRO A 1 128 ? -2.71425 11.23035 -16.12872 1.000 62.78365 ? 128 PRO A CG 1 ATOM 2475 C CD . PRO A 1 128 ? -3.00347 12.13222 -17.27363 1.000 73.92200 ? 128 PRO A CD 1 ATOM 2476 H HA . PRO A 1 128 ? -3.83894 9.23036 -17.91519 1.000 76.70826 ? 128 PRO A HA 1 ATOM 2477 H HB2 . PRO A 1 128 ? -4.60241 10.60993 -15.61794 1.000 92.66871 ? 128 PRO A HB2 1 ATOM 2478 H HB3 . PRO A 1 128 ? -3.56771 9.40849 -15.72453 1.000 92.66871 ? 128 PRO A HB3 1 ATOM 2479 H HG2 . PRO A 1 128 ? -2.69059 11.72538 -15.29489 1.000 75.34038 ? 128 PRO A HG2 1 ATOM 2480 H HG3 . PRO A 1 128 ? -1.87532 10.76149 -16.26011 1.000 75.34038 ? 128 PRO A HG3 1 ATOM 2481 H HD2 . PRO A 1 128 ? -3.63416 12.82509 -17.02251 1.000 88.70640 ? 128 PRO A HD2 1 ATOM 2482 H HD3 . PRO A 1 128 ? -2.18981 12.53302 -17.61745 1.000 88.70640 ? 128 PRO A HD3 1 ATOM 2483 N N . SER A 1 129 ? -6.36816 11.16776 -17.97382 1.000 49.00033 ? 129 SER A N 1 ATOM 2484 C CA . SER A 1 129 ? -7.81226 11.19324 -18.17936 1.000 64.56426 ? 129 SER A CA 1 ATOM 2485 C C . SER A 1 129 ? -8.22675 10.36721 -19.39248 1.000 60.01487 ? 129 SER A C 1 ATOM 2486 O O . SER A 1 129 ? -9.33645 9.82096 -19.42562 1.000 56.43261 ? 129 SER A O 1 ATOM 2487 C CB . SER A 1 129 ? -8.28096 12.63971 -18.33350 1.000 66.51324 ? 129 SER A CB 1 ATOM 2488 O OG . SER A 1 129 ? -7.82754 13.18533 -19.55438 1.000 63.53728 ? 129 SER A OG 1 ATOM 2489 H H . SER A 1 129 ? -5.99013 11.93974 -18.00105 1.000 58.80040 ? 129 SER A H 1 ATOM 2490 H HA . SER A 1 129 ? -8.24855 10.81098 -17.40191 1.000 77.47712 ? 129 SER A HA 1 ATOM 2491 H HB2 . SER A 1 129 ? -9.25061 12.66108 -18.31848 1.000 79.81589 ? 129 SER A HB2 1 ATOM 2492 H HB3 . SER A 1 129 ? -7.92611 13.16677 -17.60058 1.000 79.81589 ? 129 SER A HB3 1 ATOM 2493 H HG . SER A 1 129 ? -8.09488 13.97789 -19.63174 1.000 76.24473 ? 129 SER A HG 1 ATOM 2494 N N . ILE A 1 130 ? -7.36687 10.27867 -20.40707 1.000 53.90299 ? 130 ILE A N 1 ATOM 2495 C CA . ILE A 1 130 ? -7.67035 9.42639 -21.55118 1.000 55.51126 ? 130 ILE A CA 1 ATOM 2496 C C . ILE A 1 130 ? -7.81802 7.97629 -21.10161 1.000 52.67722 ? 130 ILE A C 1 ATOM 2497 O O . ILE A 1 130 ? -8.73228 7.26628 -21.54034 1.000 50.99259 ? 130 ILE A O 1 ATOM 2498 C CB . ILE A 1 130 ? -6.58306 9.57012 -22.63085 1.000 55.37152 ? 130 ILE A CB 1 ATOM 2499 C CG1 . ILE A 1 130 ? -6.55586 10.97509 -23.24105 1.000 66.12285 ? 130 ILE A CG1 1 ATOM 2500 C CG2 . ILE A 1 130 ? -6.80113 8.56474 -23.75769 1.000 58.57709 ? 130 ILE A CG2 1 ATOM 2501 C CD1 . ILE A 1 130 ? -7.89758 11.49608 -23.70856 1.000 67.43594 ? 130 ILE A CD1 1 ATOM 2502 H H . ILE A 1 130 ? -6.61550 10.69424 -20.45552 1.000 64.68358 ? 130 ILE A H 1 ATOM 2503 H HA . ILE A 1 130 ? -8.51339 9.71416 -21.93508 1.000 66.61352 ? 130 ILE A HA 1 ATOM 2504 H HB . ILE A 1 130 ? -5.73795 9.40295 -22.18506 1.000 66.44582 ? 130 ILE A HB 1 ATOM 2505 H HG12 . ILE A 1 130 ? -6.22072 11.59343 -22.57305 1.000 79.34742 ? 130 ILE A HG12 1 ATOM 2506 H HG13 . ILE A 1 130 ? -5.96434 10.96448 -24.00975 1.000 79.34742 ? 130 ILE A HG13 1 ATOM 2507 H HG21 . ILE A 1 130 ? -6.11404 8.69075 -24.43070 1.000 70.29251 ? 130 ILE A HG21 1 ATOM 2508 H HG22 . ILE A 1 130 ? -6.74773 7.66687 -23.39455 1.000 70.29251 ? 130 ILE A HG22 1 ATOM 2509 H HG23 . ILE A 1 130 ? -7.67700 8.71234 -24.14750 1.000 70.29251 ? 130 ILE A HG23 1 ATOM 2510 H HD11 . ILE A 1 130 ? -7.77730 12.37879 -24.09231 1.000 80.92313 ? 130 ILE A HD11 1 ATOM 2511 H HD12 . ILE A 1 130 ? -8.25596 10.89099 -24.37663 1.000 80.92313 ? 130 ILE A HD12 1 ATOM 2512 H HD13 . ILE A 1 130 ? -8.49944 11.54464 -22.94941 1.000 80.92313 ? 130 ILE A HD13 1 ATOM 2513 N N . PHE A 1 131 ? -6.92346 7.51208 -20.21825 1.000 54.07403 ? 131 PHE A N 1 ATOM 2514 C CA . PHE A 1 131 ? -6.94534 6.10584 -19.82026 1.000 55.37300 ? 131 PHE A CA 1 ATOM 2515 C C . PHE A 1 131 ? -8.21411 5.75665 -19.05694 1.000 56.07155 ? 131 PHE A C 1 ATOM 2516 O O . PHE A 1 131 ? -8.74317 4.64894 -19.20421 1.000 57.21048 ? 131 PHE A O 1 ATOM 2517 C CB . PHE A 1 131 ? -5.72073 5.76695 -18.97000 1.000 55.28700 ? 131 PHE A CB 1 ATOM 2518 C CG . PHE A 1 131 ? -4.43942 5.79671 -19.72762 1.000 51.77777 ? 131 PHE A CG 1 ATOM 2519 C CD1 . PHE A 1 131 ? -3.48225 6.75309 -19.44811 1.000 63.00597 ? 131 PHE A CD1 1 ATOM 2520 C CD2 . PHE A 1 131 ? -4.18355 4.85707 -20.71133 1.000 66.86316 ? 131 PHE A CD2 1 ATOM 2521 C CE1 . PHE A 1 131 ? -2.29638 6.78540 -20.14714 1.000 63.89226 ? 131 PHE A CE1 1 ATOM 2522 C CE2 . PHE A 1 131 ? -2.99852 4.88071 -21.40712 1.000 68.46407 ? 131 PHE A CE2 1 ATOM 2523 C CZ . PHE A 1 131 ? -2.05336 5.84538 -21.12370 1.000 69.24245 ? 131 PHE A CZ 1 ATOM 2524 H H . PHE A 1 131 ? -6.30830 7.98278 -19.84460 1.000 64.88883 ? 131 PHE A H 1 ATOM 2525 H HA . PHE A 1 131 ? -6.91457 5.56916 -20.62767 1.000 66.44760 ? 131 PHE A HA 1 ATOM 2526 H HB2 . PHE A 1 131 ? -5.65345 6.41191 -18.24861 1.000 66.34440 ? 131 PHE A HB2 1 ATOM 2527 H HB3 . PHE A 1 131 ? -5.82992 4.87389 -18.60747 1.000 66.34440 ? 131 PHE A HB3 1 ATOM 2528 H HD1 . PHE A 1 131 ? -3.64054 7.38144 -18.78101 1.000 75.60717 ? 131 PHE A HD1 1 ATOM 2529 H HD2 . PHE A 1 131 ? -4.81826 4.20488 -20.90287 1.000 80.23580 ? 131 PHE A HD2 1 ATOM 2530 H HE1 . PHE A 1 131 ? -1.66210 7.43944 -19.96051 1.000 76.67071 ? 131 PHE A HE1 1 ATOM 2531 H HE2 . PHE A 1 131 ? -2.83387 4.24745 -22.06801 1.000 82.15688 ? 131 PHE A HE2 1 ATOM 2532 H HZ . PHE A 1 131 ? -1.25067 5.86071 -21.59312 1.000 83.09094 ? 131 PHE A HZ 1 ATOM 2533 N N . LYS A 1 132 ? -8.71255 6.66448 -18.21805 1.000 52.56394 ? 132 LYS A N 1 ATOM 2534 C CA . LYS A 1 132 ? -9.92128 6.31636 -17.48810 1.000 62.05430 ? 132 LYS A CA 1 ATOM 2535 C C . LYS A 1 132 ? -11.09461 6.15631 -18.44217 1.000 61.57296 ? 132 LYS A C 1 ATOM 2536 O O . LYS A 1 132 ? -11.94584 5.28953 -18.23325 1.000 56.30685 ? 132 LYS A O 1 ATOM 2537 C CB . LYS A 1 132 ? -10.25718 7.33663 -16.39058 1.000 72.61914 ? 132 LYS A CB 1 ATOM 2538 C CG . LYS A 1 132 ? -9.93917 8.80084 -16.65259 1.000 86.28852 ? 132 LYS A CG 1 ATOM 2539 C CD . LYS A 1 132 ? -11.15675 9.54659 -17.19550 1.000 94.10022 ? 132 LYS A CD 1 ATOM 2540 C CE . LYS A 1 132 ? -11.10105 11.03111 -16.86839 1.000 99.68088 ? 132 LYS A CE 1 ATOM 2541 N NZ . LYS A 1 132 ? -12.17234 11.81473 -17.54602 1.000 99.87184 ? 132 LYS A NZ 1 ATOM 2542 H H . LYS A 1 132 ? -8.38587 7.44499 -18.06415 1.000 63.07673 ? 132 LYS A H 1 ATOM 2543 H HA . LYS A 1 132 ? -9.76109 5.47707 -17.02893 1.000 74.46516 ? 132 LYS A HA 1 ATOM 2544 H HB2 . LYS A 1 132 ? -11.21115 7.28566 -16.22255 1.000 87.14297 ? 132 LYS A HB2 1 ATOM 2545 H HB3 . LYS A 1 132 ? -9.76591 7.08439 -15.59313 1.000 87.14297 ? 132 LYS A HB3 1 ATOM 2546 H HG2 . LYS A 1 132 ? -9.66641 9.22421 -15.82357 1.000 103.54623 ? 132 LYS A HG2 1 ATOM 2547 H HG3 . LYS A 1 132 ? -9.22605 8.86309 -17.30718 1.000 103.54623 ? 132 LYS A HG3 1 ATOM 2548 H HD2 . LYS A 1 132 ? -11.18820 9.44909 -18.16008 1.000 112.92026 ? 132 LYS A HD2 1 ATOM 2549 H HD3 . LYS A 1 132 ? -11.96136 9.17806 -16.79840 1.000 112.92026 ? 132 LYS A HD3 1 ATOM 2550 H HE2 . LYS A 1 132 ? -11.20524 11.14765 -15.91107 1.000 119.61706 ? 132 LYS A HE2 1 ATOM 2551 H HE3 . LYS A 1 132 ? -10.24467 11.38559 -17.15449 1.000 119.61706 ? 132 LYS A HE3 1 ATOM 2552 H HZ1 . LYS A 1 132 ? -12.09551 12.67707 -17.33971 1.000 119.84621 ? 132 LYS A HZ1 1 ATOM 2553 H HZ2 . LYS A 1 132 ? -12.10545 11.72183 -18.42863 1.000 119.84621 ? 132 LYS A HZ2 1 ATOM 2554 H HZ3 . LYS A 1 132 ? -12.97251 11.52546 -17.28496 1.000 119.84621 ? 132 LYS A HZ3 1 ATOM 2555 N N . ILE A 1 133 ? -11.13897 6.94756 -19.51724 1.000 50.49988 ? 133 ILE A N 1 ATOM 2556 C CA . ILE A 1 133 ? -12.20872 6.78835 -20.49712 1.000 51.58482 ? 133 ILE A CA 1 ATOM 2557 C C . ILE A 1 133 ? -12.09995 5.42397 -21.16974 1.000 50.01859 ? 133 ILE A C 1 ATOM 2558 O O . ILE A 1 133 ? -13.08397 4.68180 -21.28012 1.000 50.51480 ? 133 ILE A O 1 ATOM 2559 C CB . ILE A 1 133 ? -12.17057 7.93488 -21.52501 1.000 56.86672 ? 133 ILE A CB 1 ATOM 2560 C CG1 . ILE A 1 133 ? -12.39577 9.28068 -20.82722 1.000 54.45852 ? 133 ILE A CG1 1 ATOM 2561 C CG2 . ILE A 1 133 ? -13.22571 7.72477 -22.59460 1.000 51.33004 ? 133 ILE A CG2 1 ATOM 2562 C CD1 . ILE A 1 133 ? -12.16064 10.47788 -21.72114 1.000 63.90644 ? 133 ILE A CD1 1 ATOM 2563 H H . ILE A 1 133 ? -10.57320 7.56989 -19.69671 1.000 60.59986 ? 133 ILE A H 1 ATOM 2564 H HA . ILE A 1 133 ? -13.06254 6.83061 -20.03874 1.000 61.90178 ? 133 ILE A HA 1 ATOM 2565 H HB . ILE A 1 133 ? -11.29550 7.93799 -21.94351 1.000 68.24006 ? 133 ILE A HB 1 ATOM 2566 H HG12 . ILE A 1 133 ? -13.31321 9.32024 -20.51476 1.000 65.35023 ? 133 ILE A HG12 1 ATOM 2567 H HG13 . ILE A 1 133 ? -11.78616 9.34814 -20.07574 1.000 65.35023 ? 133 ILE A HG13 1 ATOM 2568 H HG21 . ILE A 1 133 ? -13.26767 8.51450 -23.15627 1.000 61.59605 ? 133 ILE A HG21 1 ATOM 2569 H HG22 . ILE A 1 133 ? -12.98464 6.95161 -23.12846 1.000 61.59605 ? 133 ILE A HG22 1 ATOM 2570 H HG23 . ILE A 1 133 ? -14.08376 7.57699 -22.16704 1.000 61.59605 ? 133 ILE A HG23 1 ATOM 2571 H HD11 . ILE A 1 133 ? -12.10300 11.27547 -21.17212 1.000 76.68773 ? 133 ILE A HD11 1 ATOM 2572 H HD12 . ILE A 1 133 ? -11.33123 10.35062 -22.20774 1.000 76.68773 ? 133 ILE A HD12 1 ATOM 2573 H HD13 . ILE A 1 133 ? -12.90040 10.55745 -22.34349 1.000 76.68773 ? 133 ILE A HD13 1 ATOM 2574 N N . ILE A 1 134 ? -10.89858 5.07265 -21.62927 1.000 49.45670 ? 134 ILE A N 1 ATOM 2575 C CA . ILE A 1 134 ? -10.70619 3.78184 -22.28560 1.000 53.36552 ? 134 ILE A CA 1 ATOM 2576 C C . ILE A 1 134 ? -11.11614 2.65091 -21.35291 1.000 54.35076 ? 134 ILE A C 1 ATOM 2577 O O . ILE A 1 134 ? -11.86239 1.73828 -21.73087 1.000 52.98381 ? 134 ILE A O 1 ATOM 2578 C CB . ILE A 1 134 ? -9.24087 3.62394 -22.73389 1.000 50.91450 ? 134 ILE A CB 1 ATOM 2579 C CG1 . ILE A 1 134 ? -8.88404 4.67935 -23.78525 1.000 55.70011 ? 134 ILE A CG1 1 ATOM 2580 C CG2 . ILE A 1 134 ? -8.99158 2.19042 -23.24755 1.000 55.38858 ? 134 ILE A CG2 1 ATOM 2581 C CD1 . ILE A 1 134 ? -7.40141 4.73756 -24.10189 1.000 51.20081 ? 134 ILE A CD1 1 ATOM 2582 H H . ILE A 1 134 ? -10.18963 5.55635 -21.57426 1.000 59.34805 ? 134 ILE A H 1 ATOM 2583 H HA . ILE A 1 134 ? -11.27256 3.74898 -23.07239 1.000 64.03863 ? 134 ILE A HA 1 ATOM 2584 H HB . ILE A 1 134 ? -8.66061 3.76938 -21.97031 1.000 61.09740 ? 134 ILE A HB 1 ATOM 2585 H HG12 . ILE A 1 134 ? -9.35607 4.47446 -24.60751 1.000 66.84014 ? 134 ILE A HG12 1 ATOM 2586 H HG13 . ILE A 1 134 ? -9.15267 5.55172 -23.45706 1.000 66.84014 ? 134 ILE A HG13 1 ATOM 2587 H HG21 . ILE A 1 134 ? -8.15209 2.17045 -23.73309 1.000 66.46629 ? 134 ILE A HG21 1 ATOM 2588 H HG22 . ILE A 1 134 ? -8.94990 1.58623 -22.48984 1.000 66.46629 ? 134 ILE A HG22 1 ATOM 2589 H HG23 . ILE A 1 134 ? -9.71969 1.93440 -23.83509 1.000 66.46629 ? 134 ILE A HG23 1 ATOM 2590 H HD11 . ILE A 1 134 ? -7.22043 5.53693 -24.62070 1.000 61.44097 ? 134 ILE A HD11 1 ATOM 2591 H HD12 . ILE A 1 134 ? -6.90174 4.76241 -23.27086 1.000 61.44097 ? 134 ILE A HD12 1 ATOM 2592 H HD13 . ILE A 1 134 ? -7.15622 3.94970 -24.61185 1.000 61.44097 ? 134 ILE A HD13 1 ATOM 2593 N N . SER A 1 135 ? -10.63906 2.70204 -20.11142 1.000 51.69676 ? 135 SER A N 1 ATOM 2594 C CA . SER A 1 135 ? -10.86210 1.59594 -19.18844 1.000 58.04296 ? 135 SER A CA 1 ATOM 2595 C C . SER A 1 135 ? -12.34237 1.36709 -18.91666 1.000 58.17697 ? 135 SER A C 1 ATOM 2596 O O . SER A 1 135 ? -12.73317 0.24621 -18.57271 1.000 63.84800 ? 135 SER A O 1 ATOM 2597 C CB . SER A 1 135 ? -10.10982 1.85912 -17.88227 1.000 58.87603 ? 135 SER A CB 1 ATOM 2598 O OG . SER A 1 135 ? -10.78288 2.82536 -17.09233 1.000 64.72193 ? 135 SER A OG 1 ATOM 2599 H H . SER A 1 135 ? -10.18896 3.35747 -19.78366 1.000 62.03611 ? 135 SER A H 1 ATOM 2600 H HA . SER A 1 135 ? -10.50939 0.77929 -19.57519 1.000 69.65156 ? 135 SER A HA 1 ATOM 2601 H HB2 . SER A 1 135 ? -10.04855 1.03050 -17.38173 1.000 70.65124 ? 135 SER A HB2 1 ATOM 2602 H HB3 . SER A 1 135 ? -9.22115 2.18694 -18.09128 1.000 70.65124 ? 135 SER A HB3 1 ATOM 2603 H HG . SER A 1 135 ? -10.83933 3.55079 -17.51205 1.000 77.66631 ? 135 SER A HG 1 ATOM 2604 N N . GLN A 1 136 ? -13.17420 2.39436 -19.08864 1.000 58.96766 ? 136 GLN A N 1 ATOM 2605 C CA . GLN A 1 136 ? -14.60804 2.28987 -18.85395 1.000 65.87689 ? 136 GLN A CA 1 ATOM 2606 C C . GLN A 1 136 ? -15.36274 1.74174 -20.05599 1.000 68.06873 ? 136 GLN A C 1 ATOM 2607 O O . GLN A 1 136 ? -16.58402 1.56653 -19.97149 1.000 72.58617 ? 136 GLN A O 1 ATOM 2608 C CB . GLN A 1 136 ? -15.17104 3.66455 -18.48121 1.000 75.81704 ? 136 GLN A CB 1 ATOM 2609 C CG . GLN A 1 136 ? -14.77575 4.13793 -17.09160 1.000 82.19599 ? 136 GLN A CG 1 ATOM 2610 C CD . GLN A 1 136 ? -15.28369 5.53468 -16.78689 1.000 103.38643 ? 136 GLN A CD 1 ATOM 2611 O OE1 . GLN A 1 136 ? -15.64045 6.29094 -17.69210 1.000 93.14664 ? 136 GLN A OE1 1 ATOM 2612 N NE2 . GLN A 1 136 ? -15.30777 5.88866 -15.50769 1.000 133.09013 ? 136 GLN A NE2 1 ATOM 2613 H H . GLN A 1 136 ? -12.92483 3.17622 -19.34577 1.000 70.76120 ? 136 GLN A H 1 ATOM 2614 H HA . GLN A 1 136 ? -14.75984 1.68825 -18.10836 1.000 79.05226 ? 136 GLN A HA 1 ATOM 2615 H HB2 . GLN A 1 136 ? -14.84452 4.31781 -19.11960 1.000 90.98045 ? 136 GLN A HB2 1 ATOM 2616 H HB3 . GLN A 1 136 ? -16.13959 3.62337 -18.51465 1.000 90.98045 ? 136 GLN A HB3 1 ATOM 2617 H HG2 . GLN A 1 136 ? -15.14837 3.53177 -16.43233 1.000 98.63519 ? 136 GLN A HG2 1 ATOM 2618 H HG3 . GLN A 1 136 ? -13.80820 4.14810 -17.02352 1.000 98.63519 ? 136 GLN A HG3 1 ATOM 2619 H HE21 . GLN A 1 136 ? -15.04384 5.33633 -14.90364 1.000 159.70815 ? 136 GLN A HE21 1 ATOM 2620 H HE22 . GLN A 1 136 ? -15.58731 6.67031 -15.28301 1.000 159.70815 ? 136 GLN A HE22 1 ATOM 2621 N N . GLY A 1 137 ? -14.67542 1.48351 -21.16584 1.000 66.85289 ? 137 GLY A N 1 ATOM 2622 C CA . GLY A 1 137 ? -15.29076 0.91082 -22.34356 1.000 63.49138 ? 137 GLY A CA 1 ATOM 2623 C C . GLY A 1 137 ? -15.67861 1.89422 -23.42134 1.000 61.83635 ? 137 GLY A C 1 ATOM 2624 O O . GLY A 1 137 ? -16.36384 1.50078 -24.37218 1.000 70.22014 ? 137 GLY A O 1 ATOM 2625 H H . GLY A 1 137 ? -13.83408 1.63673 -21.25673 1.000 80.22347 ? 137 GLY A H 1 ATOM 2626 H HA2 . GLY A 1 137 ? -14.67142 0.27576 -22.73601 1.000 76.18965 ? 137 GLY A HA2 1 ATOM 2627 H HA3 . GLY A 1 137 ? -16.09514 0.44129 -22.07264 1.000 76.18965 ? 137 GLY A HA3 1 ATOM 2628 N N . THR A 1 138 ? -15.26642 3.15463 -23.30900 1.000 56.64359 ? 138 THR A N 1 ATOM 2629 C CA . THR A 1 138 ? -15.57876 4.18447 -24.28619 1.000 61.89592 ? 138 THR A CA 1 ATOM 2630 C C . THR A 1 138 ? -14.32721 4.48749 -25.09471 1.000 57.41822 ? 138 THR A C 1 ATOM 2631 O O . THR A 1 138 ? -13.22720 4.55316 -24.54409 1.000 57.34624 ? 138 THR A O 1 ATOM 2632 C CB . THR A 1 138 ? -16.08079 5.45311 -23.59265 1.000 62.61731 ? 138 THR A CB 1 ATOM 2633 O OG1 . THR A 1 138 ? -17.34778 5.18966 -22.97816 1.000 70.79796 ? 138 THR A OG1 1 ATOM 2634 C CG2 . THR A 1 138 ? -16.23401 6.59707 -24.58342 1.000 62.62817 ? 138 THR A CG2 1 ATOM 2635 H H . THR A 1 138 ? -14.78984 3.44256 -22.65358 1.000 67.97231 ? 138 THR A H 1 ATOM 2636 H HA . THR A 1 138 ? -16.27371 3.88054 -24.89081 1.000 74.27510 ? 138 THR A HA 1 ATOM 2637 H HB . THR A 1 138 ? -15.43668 5.72367 -22.91972 1.000 75.14077 ? 138 THR A HB 1 ATOM 2638 H HG1 . THR A 1 138 ? -17.63284 5.88287 -22.59895 1.000 84.95755 ? 138 THR A HG1 1 ATOM 2639 H HG21 . THR A 1 138 ? -16.75883 7.31051 -24.18785 1.000 75.15380 ? 138 THR A HG21 1 ATOM 2640 H HG22 . THR A 1 138 ? -15.36166 6.94515 -24.82577 1.000 75.15380 ? 138 THR A HG22 1 ATOM 2641 H HG23 . THR A 1 138 ? -16.68181 6.28405 -25.38492 1.000 75.15380 ? 138 THR A HG23 1 ATOM 2642 N N . ASN A 1 139 ? -14.48313 4.64567 -26.40502 1.000 54.71860 ? 139 ASN A N 1 ATOM 2643 C CA . ASN A 1 139 ? -13.35561 5.04459 -27.23238 1.000 51.80985 ? 139 ASN A CA 1 ATOM 2644 C C . ASN A 1 139 ? -13.36171 6.56488 -27.26835 1.000 45.97853 ? 139 ASN A C 1 ATOM 2645 O O . ASN A 1 139 ? -14.29722 7.15398 -27.82977 1.000 46.22096 ? 139 ASN A O 1 ATOM 2646 C CB . ASN A 1 139 ? -13.45374 4.46279 -28.63130 1.000 59.40579 ? 139 ASN A CB 1 ATOM 2647 C CG . ASN A 1 139 ? -12.28799 4.88180 -29.50744 1.000 55.40944 ? 139 ASN A CG 1 ATOM 2648 O OD1 . ASN A 1 139 ? -11.51804 5.77446 -29.15007 1.000 55.41853 ? 139 ASN A OD1 1 ATOM 2649 N ND2 . ASN A 1 139 ? -12.14140 4.22679 -30.65169 1.000 70.81722 ? 139 ASN A ND2 1 ATOM 2650 H H . ASN A 1 139 ? -15.22148 4.52925 -26.83031 1.000 65.66233 ? 139 ASN A H 1 ATOM 2651 H HA . ASN A 1 139 ? -12.52206 4.72290 -26.85474 1.000 62.17182 ? 139 ASN A HA 1 ATOM 2652 H HB2 . ASN A 1 139 ? -13.45659 3.49448 -28.57409 1.000 71.28694 ? 139 ASN A HB2 1 ATOM 2653 H HB3 . ASN A 1 139 ? -14.27267 4.77289 -29.04853 1.000 71.28694 ? 139 ASN A HB3 1 ATOM 2654 H HD21 . ASN A 1 139 ? -12.69236 3.60104 -30.86258 1.000 84.98067 ? 139 ASN A HD21 1 ATOM 2655 H HD22 . ASN A 1 139 ? -11.49542 4.42791 -31.18258 1.000 84.98067 ? 139 ASN A HD22 1 ATOM 2656 N N . PRO A 1 140 ? -12.38754 7.24174 -26.65578 1.000 44.97098 ? 140 PRO A N 1 ATOM 2657 C CA . PRO A 1 140 ? -12.45341 8.71176 -26.59268 1.000 42.87577 ? 140 PRO A CA 1 ATOM 2658 C C . PRO A 1 140 ? -12.45326 9.36519 -27.95970 1.000 45.43995 ? 140 PRO A C 1 ATOM 2659 O O . PRO A 1 140 ? -12.91155 10.50470 -28.08928 1.000 45.83229 ? 140 PRO A O 1 ATOM 2660 C CB . PRO A 1 140 ? -11.20819 9.09702 -25.78117 1.000 48.76331 ? 140 PRO A CB 1 ATOM 2661 C CG . PRO A 1 140 ? -10.31946 7.89481 -25.81037 1.000 51.80937 ? 140 PRO A CG 1 ATOM 2662 C CD . PRO A 1 140 ? -11.20568 6.69898 -25.96004 1.000 48.55716 ? 140 PRO A CD 1 ATOM 2663 H HA . PRO A 1 140 ? -13.24155 8.99003 -26.10044 1.000 51.45093 ? 140 PRO A HA 1 ATOM 2664 H HB2 . PRO A 1 140 ? -10.77140 9.85869 -26.19345 1.000 58.51598 ? 140 PRO A HB2 1 ATOM 2665 H HB3 . PRO A 1 140 ? -11.46462 9.31411 -24.87122 1.000 58.51598 ? 140 PRO A HB3 1 ATOM 2666 H HG2 . PRO A 1 140 ? -9.71062 7.96215 -26.56248 1.000 62.17124 ? 140 PRO A HG2 1 ATOM 2667 H HG3 . PRO A 1 140 ? -9.81835 7.84410 -24.98139 1.000 62.17124 ? 140 PRO A HG3 1 ATOM 2668 H HD2 . PRO A 1 140 ? -10.77442 6.01376 -26.49425 1.000 58.26859 ? 140 PRO A HD2 1 ATOM 2669 H HD3 . PRO A 1 140 ? -11.44992 6.33899 -25.09306 1.000 58.26859 ? 140 PRO A HD3 1 ATOM 2670 N N . LEU A 1 141 ? -11.98236 8.66546 -28.99108 1.000 47.65847 ? 141 LEU A N 1 ATOM 2671 C CA . LEU A 1 141 ? -11.98145 9.24452 -30.32761 1.000 51.36114 ? 141 LEU A CA 1 ATOM 2672 C C . LEU A 1 141 ? -13.38757 9.46051 -30.86665 1.000 51.17796 ? 141 LEU A C 1 ATOM 2673 O O . LEU A 1 141 ? -13.56386 10.28182 -31.77662 1.000 51.47802 ? 141 LEU A O 1 ATOM 2674 C CB . LEU A 1 141 ? -11.19199 8.34841 -31.28151 1.000 51.08210 ? 141 LEU A CB 1 ATOM 2675 C CG . LEU A 1 141 ? -9.70835 8.21315 -30.93142 1.000 52.94245 ? 141 LEU A CG 1 ATOM 2676 C CD1 . LEU A 1 141 ? -9.07882 7.06912 -31.70827 1.000 61.58482 ? 141 LEU A CD1 1 ATOM 2677 C CD2 . LEU A 1 141 ? -8.96949 9.50335 -31.20921 1.000 54.20640 ? 141 LEU A CD2 1 ATOM 2678 H H . LEU A 1 141 ? -11.66403 7.86803 -28.94241 1.000 57.19016 ? 141 LEU A H 1 ATOM 2679 H HA . LEU A 1 141 ? -11.54254 10.10879 -30.29178 1.000 61.63337 ? 141 LEU A HA 1 ATOM 2680 H HB2 . LEU A 1 141 ? -11.58113 7.46005 -31.26490 1.000 61.29852 ? 141 LEU A HB2 1 ATOM 2681 H HB3 . LEU A 1 141 ? -11.25138 8.71995 -32.17556 1.000 61.29852 ? 141 LEU A HB3 1 ATOM 2682 H HG . LEU A 1 141 ? -9.63010 8.01946 -29.98418 1.000 63.53094 ? 141 LEU A HG 1 ATOM 2683 H HD11 . LEU A 1 141 ? -8.13965 7.00720 -31.47369 1.000 73.90178 ? 141 LEU A HD11 1 ATOM 2684 H HD12 . LEU A 1 141 ? -9.53252 6.24338 -31.47758 1.000 73.90178 ? 141 LEU A HD12 1 ATOM 2685 H HD13 . LEU A 1 141 ? -9.17176 7.24343 -32.65795 1.000 73.90178 ? 141 LEU A HD13 1 ATOM 2686 H HD21 . LEU A 1 141 ? -8.02528 9.37132 -31.03050 1.000 65.04769 ? 141 LEU A HD21 1 ATOM 2687 H HD22 . LEU A 1 141 ? -9.09917 9.74766 -32.13894 1.000 65.04769 ? 141 LEU A HD22 1 ATOM 2688 H HD23 . LEU A 1 141 ? -9.32121 10.19923 -30.63220 1.000 65.04769 ? 141 LEU A HD23 1 ATOM 2689 N N . ASN A 1 142 ? -14.38690 8.75858 -30.32585 1.000 48.57677 ? 142 ASN A N 1 ATOM 2690 C CA . ASN A 1 142 ? -15.75842 8.84871 -30.80473 1.000 54.51252 ? 142 ASN A CA 1 ATOM 2691 C C . ASN A 1 142 ? -16.62660 9.79832 -29.98769 1.000 50.78410 ? 142 ASN A C 1 ATOM 2692 O O . ASN A 1 142 ? -17.83162 9.88884 -30.24652 1.000 54.21304 ? 142 ASN A O 1 ATOM 2693 C CB . ASN A 1 142 ? -16.41010 7.46361 -30.80250 1.000 60.58542 ? 142 ASN A CB 1 ATOM 2694 C CG . ASN A 1 142 ? -15.77564 6.52031 -31.79800 1.000 66.95198 ? 142 ASN A CG 1 ATOM 2695 O OD1 . ASN A 1 142 ? -15.28860 6.94165 -32.84951 1.000 67.96705 ? 142 ASN A OD1 1 ATOM 2696 N ND2 . ASN A 1 142 ? -15.76925 5.23569 -31.46889 1.000 72.77900 ? 142 ASN A ND2 1 ATOM 2697 H H . ASN A 1 142 ? -14.28826 8.21395 -29.66763 1.000 58.29213 ? 142 ASN A H 1 ATOM 2698 H HA . ASN A 1 142 ? -15.73159 9.17839 -31.71659 1.000 65.41502 ? 142 ASN A HA 1 ATOM 2699 H HB2 . ASN A 1 142 ? -16.32029 7.07299 -29.91918 1.000 72.70250 ? 142 ASN A HB2 1 ATOM 2700 H HB3 . ASN A 1 142 ? -17.34836 7.55491 -31.03104 1.000 72.70250 ? 142 ASN A HB3 1 ATOM 2701 H HD21 . ASN A 1 142 ? -15.42010 4.65723 -32.00094 1.000 87.33480 ? 142 ASN A HD21 1 ATOM 2702 H HD22 . ASN A 1 142 ? -16.11426 4.98107 -30.72341 1.000 87.33480 ? 142 ASN A HD22 1 ATOM 2703 N N . ILE A 1 143 ? -16.06165 10.47235 -28.98989 1.000 48.31310 ? 143 ILE A N 1 ATOM 2704 C CA . ILE A 1 143 ? -16.82257 11.44398 -28.21092 1.000 44.63331 ? 143 ILE A CA 1 ATOM 2705 C C . ILE A 1 143 ? -17.10363 12.65675 -29.08514 1.000 48.64634 ? 143 ILE A C 1 ATOM 2706 O O . ILE A 1 143 ? -16.19371 13.20693 -29.71315 1.000 49.31340 ? 143 ILE A O 1 ATOM 2707 C CB . ILE A 1 143 ? -16.05263 11.82728 -26.93757 1.000 47.90691 ? 143 ILE A CB 1 ATOM 2708 C CG1 . ILE A 1 143 ? -15.97169 10.63769 -25.96711 1.000 50.34473 ? 143 ILE A CG1 1 ATOM 2709 C CG2 . ILE A 1 143 ? -16.69154 13.02436 -26.23566 1.000 52.13632 ? 143 ILE A CG2 1 ATOM 2710 C CD1 . ILE A 1 143 ? -14.88844 10.81557 -24.90612 1.000 53.51868 ? 143 ILE A CD1 1 ATOM 2711 H H . ILE A 1 143 ? -15.24198 10.38597 -28.74438 1.000 57.97572 ? 143 ILE A H 1 ATOM 2712 H HA . ILE A 1 143 ? -17.67005 11.05726 -27.94048 1.000 53.55997 ? 143 ILE A HA 1 ATOM 2713 H HB . ILE A 1 143 ? -15.15547 12.07397 -27.21170 1.000 57.48829 ? 143 ILE A HB 1 ATOM 2714 H HG12 . ILE A 1 143 ? -16.82370 10.54140 -25.51355 1.000 60.41368 ? 143 ILE A HG12 1 ATOM 2715 H HG13 . ILE A 1 143 ? -15.77067 9.83288 -26.46987 1.000 60.41368 ? 143 ILE A HG13 1 ATOM 2716 H HG21 . ILE A 1 143 ? -16.29689 13.12160 -25.35493 1.000 62.56358 ? 143 ILE A HG21 1 ATOM 2717 H HG22 . ILE A 1 143 ? -16.52800 13.82295 -26.76142 1.000 62.56358 ? 143 ILE A HG22 1 ATOM 2718 H HG23 . ILE A 1 143 ? -17.64595 12.87091 -26.15536 1.000 62.56358 ? 143 ILE A HG23 1 ATOM 2719 H HD11 . ILE A 1 143 ? -14.76654 9.97623 -24.43543 1.000 64.22242 ? 143 ILE A HD11 1 ATOM 2720 H HD12 . ILE A 1 143 ? -14.06062 11.07458 -25.34031 1.000 64.22242 ? 143 ILE A HD12 1 ATOM 2721 H HD13 . ILE A 1 143 ? -15.16594 11.50630 -24.28419 1.000 64.22242 ? 143 ILE A HD13 1 ATOM 2722 N N . ARG A 1 144 ? -18.37212 13.07367 -29.14020 1.000 46.07462 ? 144 ARG A N 1 ATOM 2723 C CA . ARG A 1 144 ? -18.76924 14.22174 -29.94641 1.000 48.75351 ? 144 ARG A CA 1 ATOM 2724 C C . ARG A 1 144 ? -18.44534 15.52161 -29.20484 1.000 47.36259 ? 144 ARG A C 1 ATOM 2725 O O . ARG A 1 144 ? -18.52513 15.57534 -27.97318 1.000 46.42947 ? 144 ARG A O 1 ATOM 2726 C CB . ARG A 1 144 ? -20.26542 14.14577 -30.25044 1.000 54.72226 ? 144 ARG A CB 1 ATOM 2727 C CG . ARG A 1 144 ? -20.68857 12.81469 -30.89967 1.000 71.56343 ? 144 ARG A CG 1 ATOM 2728 C CD . ARG A 1 144 ? -21.15588 12.85537 -32.35902 1.000 96.84909 ? 144 ARG A CD 1 ATOM 2729 N NE . ARG A 1 144 ? -22.59250 13.10595 -32.41715 1.000 115.74810 ? 144 ARG A NE 1 ATOM 2730 C CZ . ARG A 1 144 ? -23.16656 14.12441 -33.04482 1.000 132.50675 ? 144 ARG A CZ 1 ATOM 2731 N NH1 . ARG A 1 144 ? -22.52799 14.81387 -33.96694 1.000 125.08216 ? 144 ARG A NH1 1 ATOM 2732 N NH2 . ARG A 1 144 ? -24.43250 14.42463 -32.77050 1.000 139.78455 ? 144 ARG A NH2 1 ATOM 2733 H H . ARG A 1 144 ? -19.02293 12.70444 -28.71629 1.000 55.28954 ? 144 ARG A H 1 ATOM 2734 H HA . ARG A 1 144 ? -18.28853 14.22809 -30.78889 1.000 58.50421 ? 144 ARG A HA 1 ATOM 2735 H HB2 . ARG A 1 144 ? -20.75920 14.24318 -29.42122 1.000 65.66671 ? 144 ARG A HB2 1 ATOM 2736 H HB3 . ARG A 1 144 ? -20.49803 14.86252 -30.86123 1.000 65.66671 ? 144 ARG A HB3 1 ATOM 2737 H HG2 . ARG A 1 144 ? -19.92900 12.21229 -30.86671 1.000 85.87612 ? 144 ARG A HG2 1 ATOM 2738 H HG3 . ARG A 1 144 ? -21.42339 12.45071 -30.38154 1.000 85.87612 ? 144 ARG A HG3 1 ATOM 2739 H HD2 . ARG A 1 144 ? -20.69631 13.56840 -32.82944 1.000 116.21890 ? 144 ARG A HD2 1 ATOM 2740 H HD3 . ARG A 1 144 ? -20.97101 12.00379 -32.78509 1.000 116.21890 ? 144 ARG A HD3 1 ATOM 2741 H HE . ARG A 1 144 ? -23.10804 12.54920 -32.01238 1.000 138.89772 ? 144 ARG A HE 1 ATOM 2742 H HH11 . ARG A 1 144 ? -21.71941 14.60775 -34.17507 1.000 150.09859 ? 144 ARG A HH11 1 ATOM 2743 H HH12 . ARG A 1 144 ? -22.91946 15.47034 -34.36115 1.000 150.09859 ? 144 ARG A HH12 1 ATOM 2744 H HH21 . ARG A 1 144 ? -24.86886 13.96089 -32.19246 1.000 167.74146 ? 144 ARG A HH21 1 ATOM 2745 H HH22 . ARG A 1 144 ? -24.81493 15.08255 -33.17112 1.000 167.74146 ? 144 ARG A HH22 1 ATOM 2746 N N . PRO A 1 145 ? -18.06075 16.58323 -29.91871 1.000 44.34921 ? 145 PRO A N 1 ATOM 2747 C CA . PRO A 1 145 ? -17.77898 17.85309 -29.23258 1.000 41.97668 ? 145 PRO A CA 1 ATOM 2748 C C . PRO A 1 145 ? -19.03744 18.44096 -28.61718 1.000 43.80076 ? 145 PRO A C 1 ATOM 2749 O O . PRO A 1 145 ? -20.15102 18.23609 -29.10174 1.000 48.43977 ? 145 PRO A O 1 ATOM 2750 C CB . PRO A 1 145 ? -17.22560 18.75261 -30.34530 1.000 50.04572 ? 145 PRO A CB 1 ATOM 2751 C CG . PRO A 1 145 ? -17.75951 18.17846 -31.58912 1.000 49.78217 ? 145 PRO A CG 1 ATOM 2752 C CD . PRO A 1 145 ? -17.81213 16.69538 -31.37120 1.000 47.18213 ? 145 PRO A CD 1 ATOM 2753 H HA . PRO A 1 145 ? -17.10234 17.73472 -28.54771 1.000 50.37202 ? 145 PRO A HA 1 ATOM 2754 H HB2 . PRO A 1 145 ? -17.53613 19.66306 -30.22061 1.000 60.05487 ? 145 PRO A HB2 1 ATOM 2755 H HB3 . PRO A 1 145 ? -16.25591 18.72903 -30.33900 1.000 60.05487 ? 145 PRO A HB3 1 ATOM 2756 H HG2 . PRO A 1 145 ? -18.64697 18.53205 -31.75732 1.000 59.73860 ? 145 PRO A HG2 1 ATOM 2757 H HG3 . PRO A 1 145 ? -17.17022 18.39576 -32.32831 1.000 59.73860 ? 145 PRO A HG3 1 ATOM 2758 H HD2 . PRO A 1 145 ? -18.53592 16.29594 -31.87861 1.000 56.61856 ? 145 PRO A HD2 1 ATOM 2759 H HD3 . PRO A 1 145 ? -16.96942 16.27958 -31.61174 1.000 56.61856 ? 145 PRO A HD3 1 ATOM 2760 N N . LYS A 1 146 ? -18.85297 19.14111 -27.50347 1.000 43.39365 ? 146 LYS A N 1 ATOM 2761 C CA A LYS A 1 146 ? -19.96169 19.73246 -26.77191 0.395 47.92126 ? 146 LYS A CA 1 ATOM 2762 C CA B LYS A 1 146 ? -19.96665 19.74277 -26.79040 0.605 47.91714 ? 146 LYS A CA 1 ATOM 2763 C C . LYS A 1 146 ? -19.54311 21.09972 -26.25557 1.000 44.90440 ? 146 LYS A C 1 ATOM 2764 O O . LYS A 1 146 ? -18.37145 21.32864 -25.95636 1.000 46.44306 ? 146 LYS A O 1 ATOM 2765 C CB A LYS A 1 146 ? -20.41064 18.89141 -25.56208 0.395 49.66796 ? 146 LYS A CB 1 ATOM 2766 C CB B LYS A 1 146 ? -20.42960 18.85682 -25.62954 0.605 49.70516 ? 146 LYS A CB 1 ATOM 2767 C CG A LYS A 1 146 ? -20.29961 17.38883 -25.71704 0.395 51.07270 ? 146 LYS A CG 1 ATOM 2768 C CG B LYS A 1 146 ? -19.32213 18.58975 -24.62916 0.605 48.47179 ? 146 LYS A CG 1 ATOM 2769 C CD A LYS A 1 146 ? -21.55339 16.77520 -26.31170 0.395 53.82592 ? 146 LYS A CD 1 ATOM 2770 C CD B LYS A 1 146 ? -19.68855 17.49900 -23.63509 0.605 58.38780 ? 146 LYS A CD 1 ATOM 2771 C CE A LYS A 1 146 ? -21.26892 15.36170 -26.79548 0.395 51.08796 ? 146 LYS A CE 1 ATOM 2772 C CE B LYS A 1 146 ? -18.55419 17.27306 -22.64163 0.605 60.16457 ? 146 LYS A CE 1 ATOM 2773 N NZ A LYS A 1 146 ? -20.26802 14.67051 -25.92068 0.395 43.13112 ? 146 LYS A NZ 1 ATOM 2774 N NZ B LYS A 1 146 ? -19.06312 17.06112 -21.25350 0.605 71.25102 ? 146 LYS A NZ 1 ATOM 2775 H H A LYS A 1 146 ? -18.08372 19.28846 -27.14829 0.395 52.07238 ? 146 LYS A H 1 ATOM 2776 H H B LYS A 1 146 ? -18.08596 19.28120 -27.14060 0.605 52.07238 ? 146 LYS A H 1 ATOM 2777 H HA A LYS A 1 146 ? -20.70990 19.81483 -27.38372 0.395 57.50551 ? 146 LYS A HA 1 ATOM 2778 H HA B LYS A 1 146 ? -20.71121 19.87085 -27.39879 0.605 57.50057 ? 146 LYS A HA 1 ATOM 2779 H HB2 A LYS A 1 146 ? -19.86476 19.14155 -24.80028 0.395 59.60155 ? 146 LYS A HB2 1 ATOM 2780 H HB2 B LYS A 1 146 ? -21.15685 19.29871 -25.16398 0.605 59.64619 ? 146 LYS A HB2 1 ATOM 2781 H HB3 A LYS A 1 146 ? -21.34249 19.09243 -25.38278 0.395 59.60155 ? 146 LYS A HB3 1 ATOM 2782 H HB3 B LYS A 1 146 ? -20.73038 18.00449 -25.98163 0.605 59.64619 ? 146 LYS A HB3 1 ATOM 2783 H HG2 A LYS A 1 146 ? -19.55596 17.18394 -26.30518 0.395 61.28724 ? 146 LYS A HG2 1 ATOM 2784 H HG2 B LYS A 1 146 ? -18.52530 18.30780 -25.10505 0.605 58.16615 ? 146 LYS A HG2 1 ATOM 2785 H HG3 A LYS A 1 146 ? -20.15306 16.98927 -24.84538 0.395 61.28724 ? 146 LYS A HG3 1 ATOM 2786 H HG3 B LYS A 1 146 ? -19.14108 19.40223 -24.13116 0.605 58.16615 ? 146 LYS A HG3 1 ATOM 2787 H HD2 A LYS A 1 146 ? -22.24963 16.73796 -25.63733 0.395 64.59110 ? 146 LYS A HD2 1 ATOM 2788 H HD2 B LYS A 1 146 ? -20.48186 17.76191 -23.14271 0.605 70.06536 ? 146 LYS A HD2 1 ATOM 2789 H HD3 A LYS A 1 146 ? -21.85055 17.30735 -27.06630 0.395 64.59110 ? 146 LYS A HD3 1 ATOM 2790 H HD3 B LYS A 1 146 ? -19.85256 16.66914 -24.10979 0.605 70.06536 ? 146 LYS A HD3 1 ATOM 2791 H HE2 A LYS A 1 146 ? -22.09100 14.84698 -26.78335 0.395 61.30555 ? 146 LYS A HE2 1 ATOM 2792 H HE2 B LYS A 1 146 ? -18.05169 16.48592 -22.90395 0.605 72.19749 ? 146 LYS A HE2 1 ATOM 2793 H HE3 A LYS A 1 146 ? -20.91275 15.39681 -27.69703 0.395 61.30555 ? 146 LYS A HE3 1 ATOM 2794 H HE3 B LYS A 1 146 ? -17.97416 18.05052 -22.63664 0.605 72.19749 ? 146 LYS A HE3 1 ATOM 2795 H HZ1 A LYS A 1 146 ? -20.48070 14.78657 -25.06429 0.395 51.75735 ? 146 LYS A HZ1 1 ATOM 2796 H HZ1 B LYS A 1 146 ? -18.38135 16.93812 -20.69480 0.605 85.50122 ? 146 LYS A HZ1 1 ATOM 2797 H HZ2 A LYS A 1 146 ? -20.25749 13.79884 -26.10010 0.395 51.75735 ? 146 LYS A HZ2 1 ATOM 2798 H HZ2 B LYS A 1 146 ? -19.52925 17.77145 -20.98842 0.605 85.50122 ? 146 LYS A HZ2 1 ATOM 2799 H HZ3 A LYS A 1 146 ? -19.45583 15.00483 -26.06446 0.395 51.75735 ? 146 LYS A HZ3 1 ATOM 2800 H HZ3 B LYS A 1 146 ? -19.58994 16.34423 -21.22858 0.605 85.50122 ? 146 LYS A HZ3 1 ATOM 2801 N N . ALA A 1 147 ? -20.51412 21.99682 -26.13090 1.000 44.39414 ? 147 ALA A N 1 ATOM 2802 C CA . ALA A 1 147 ? -20.26993 23.27476 -25.47056 1.000 42.43263 ? 147 ALA A CA 1 ATOM 2803 C C . ALA A 1 147 ? -20.58576 23.11081 -23.99032 1.000 44.93060 ? 147 ALA A C 1 ATOM 2804 O O . ALA A 1 147 ? -21.63026 22.55716 -23.63343 1.000 47.80301 ? 147 ALA A O 1 ATOM 2805 C CB . ALA A 1 147 ? -21.12129 24.38468 -26.08393 1.000 48.49589 ? 147 ALA A CB 1 ATOM 2806 H H . ALA A 1 147 ? -21.31761 21.89012 -26.41834 1.000 53.27297 ? 147 ALA A H 1 ATOM 2807 H HA . ALA A 1 147 ? -19.34192 23.53650 -25.57633 1.000 50.91916 ? 147 ALA A HA 1 ATOM 2808 H HB1 . ALA A 1 147 ? -20.99807 25.19792 -25.56977 1.000 58.19507 ? 147 ALA A HB1 1 ATOM 2809 H HB2 . ALA A 1 147 ? -20.84055 24.52762 -27.00134 1.000 58.19507 ? 147 ALA A HB2 1 ATOM 2810 H HB3 . ALA A 1 147 ? -22.05333 24.11694 -26.06112 1.000 58.19507 ? 147 ALA A HB3 1 ATOM 2811 N N . VAL A 1 148 ? -19.68492 23.57919 -23.13106 1.000 40.47340 ? 148 VAL A N 1 ATOM 2812 C CA . VAL A 1 148 ? -19.83535 23.38171 -21.69571 1.000 43.01359 ? 148 VAL A CA 1 ATOM 2813 C C . VAL A 1 148 ? -19.17796 24.53743 -20.96245 1.000 44.49213 ? 148 VAL A C 1 ATOM 2814 O O . VAL A 1 148 ? -18.20616 25.13278 -21.43570 1.000 43.14832 ? 148 VAL A O 1 ATOM 2815 C CB . VAL A 1 148 ? -19.22689 22.02337 -21.26378 1.000 49.19612 ? 148 VAL A CB 1 ATOM 2816 C CG1 . VAL A 1 148 ? -17.80275 21.89008 -21.77693 1.000 48.96016 ? 148 VAL A CG1 1 ATOM 2817 C CG2 . VAL A 1 148 ? -19.25864 21.86972 -19.76204 1.000 60.57748 ? 148 VAL A CG2 1 ATOM 2818 H H . VAL A 1 148 ? -18.97836 24.01452 -23.35660 1.000 48.56809 ? 148 VAL A H 1 ATOM 2819 H HA . VAL A 1 148 ? -20.77786 23.39344 -21.46669 1.000 51.61631 ? 148 VAL A HA 1 ATOM 2820 H HB . VAL A 1 148 ? -19.76150 21.31209 -21.65003 1.000 59.03535 ? 148 VAL A HB 1 ATOM 2821 H HG11 . VAL A 1 148 ? -17.41411 21.07533 -21.42191 1.000 58.75220 ? 148 VAL A HG11 1 ATOM 2822 H HG12 . VAL A 1 148 ? -17.81837 21.85413 -22.74613 1.000 58.75220 ? 148 VAL A HG12 1 ATOM 2823 H HG13 . VAL A 1 148 ? -17.28790 22.65770 -21.48265 1.000 58.75220 ? 148 VAL A HG13 1 ATOM 2824 H HG21 . VAL A 1 148 ? -19.08910 20.94182 -19.53587 1.000 72.69297 ? 148 VAL A HG21 1 ATOM 2825 H HG22 . VAL A 1 148 ? -18.57406 22.43562 -19.37215 1.000 72.69297 ? 148 VAL A HG22 1 ATOM 2826 H HG23 . VAL A 1 148 ? -20.13268 22.13532 -19.43582 1.000 72.69297 ? 148 VAL A HG23 1 ATOM 2827 N N . GLU A 1 149 ? -19.70196 24.84640 -19.77853 1.000 44.11433 ? 149 GLU A N 1 ATOM 2828 C CA . GLU A 1 149 ? -19.09410 25.87901 -18.95661 1.000 44.74766 ? 149 GLU A CA 1 ATOM 2829 C C . GLU A 1 149 ? -17.93247 25.29458 -18.15845 1.000 42.15218 ? 149 GLU A C 1 ATOM 2830 O O . GLU A 1 149 ? -18.07851 24.25644 -17.50508 1.000 43.30621 ? 149 GLU A O 1 ATOM 2831 C CB . GLU A 1 149 ? -20.13056 26.49706 -18.01288 1.000 53.28457 ? 149 GLU A CB 1 ATOM 2832 C CG . GLU A 1 149 ? -19.80829 27.94163 -17.64785 1.000 66.70045 ? 149 GLU A CG 1 ATOM 2833 C CD . GLU A 1 149 ? -21.00235 28.87428 -17.75213 1.000 84.47991 ? 149 GLU A CD 1 ATOM 2834 O OE1 . GLU A 1 149 ? -20.80021 30.08015 -18.03433 1.000 83.03651 ? 149 GLU A OE1 1 ATOM 2835 O OE2 . GLU A 1 149 ? -22.13999 28.39853 -17.54935 1.000 82.40743 ? 149 GLU A OE2 1 ATOM 2836 H H . GLU A 1 149 ? -20.39892 24.47595 -19.43705 1.000 52.93719 ? 149 GLU A H 1 ATOM 2837 H HA . GLU A 1 149 ? -18.75069 26.58325 -19.52846 1.000 53.69719 ? 149 GLU A HA 1 ATOM 2838 H HB2 . GLU A 1 149 ? -20.99892 26.48295 -18.44491 1.000 63.94149 ? 149 GLU A HB2 1 ATOM 2839 H HB3 . GLU A 1 149 ? -20.15941 25.97934 -17.19310 1.000 63.94149 ? 149 GLU A HB3 1 ATOM 2840 H HG2 . GLU A 1 149 ? -19.48919 27.96950 -16.73227 1.000 80.04054 ? 149 GLU A HG2 1 ATOM 2841 H HG3 . GLU A 1 149 ? -19.12153 28.27066 -18.24869 1.000 80.04054 ? 149 GLU A HG3 1 ATOM 2842 N N . LYS A 1 150 ? -16.78776 25.97482 -18.20041 1.000 41.67631 ? 150 LYS A N 1 ATOM 2843 C CA . LYS A 1 150 ? -15.60898 25.59403 -17.43584 1.000 40.69114 ? 150 LYS A CA 1 ATOM 2844 C C . LYS A 1 150 ? -15.00269 26.80941 -16.74666 1.000 41.57252 ? 150 LYS A C 1 ATOM 2845 O O . LYS A 1 150 ? -15.18890 27.95193 -17.17730 1.000 42.07978 ? 150 LYS A O 1 ATOM 2846 C CB . LYS A 1 150 ? -14.51812 24.97553 -18.32505 1.000 41.36121 ? 150 LYS A CB 1 ATOM 2847 C CG . LYS A 1 150 ? -14.96256 23.78216 -19.12850 1.000 45.81022 ? 150 LYS A CG 1 ATOM 2848 C CD . LYS A 1 150 ? -15.01584 22.53003 -18.29362 1.000 45.93233 ? 150 LYS A CD 1 ATOM 2849 C CE . LYS A 1 150 ? -14.90835 21.31092 -19.16932 1.000 51.73865 ? 150 LYS A CE 1 ATOM 2850 N NZ . LYS A 1 150 ? -15.53407 20.14513 -18.52977 1.000 53.04335 ? 150 LYS A NZ 1 ATOM 2851 H H . LYS A 1 150 ? -16.66929 26.67966 -18.67871 1.000 50.01157 ? 150 LYS A H 1 ATOM 2852 H HA . LYS A 1 150 ? -15.89183 24.95177 -16.76620 1.000 48.82936 ? 150 LYS A HA 1 ATOM 2853 H HB2 . LYS A 1 150 ? -14.21089 25.65053 -18.95026 1.000 49.63346 ? 150 LYS A HB2 1 ATOM 2854 H HB3 . LYS A 1 150 ? -13.78446 24.68947 -17.75866 1.000 49.63346 ? 150 LYS A HB3 1 ATOM 2855 H HG2 . LYS A 1 150 ? -15.85013 23.94803 -19.48290 1.000 54.97226 ? 150 LYS A HG2 1 ATOM 2856 H HG3 . LYS A 1 150 ? -14.33721 23.63532 -19.85533 1.000 54.97226 ? 150 LYS A HG3 1 ATOM 2857 H HD2 . LYS A 1 150 ? -14.27678 22.52599 -17.66539 1.000 55.11880 ? 150 LYS A HD2 1 ATOM 2858 H HD3 . LYS A 1 150 ? -15.85858 22.49376 -17.81468 1.000 55.11880 ? 150 LYS A HD3 1 ATOM 2859 H HE2 . LYS A 1 150 ? -15.35928 21.47774 -20.01178 1.000 62.08637 ? 150 LYS A HE2 1 ATOM 2860 H HE3 . LYS A 1 150 ? -13.97301 21.10880 -19.32800 1.000 62.08637 ? 150 LYS A HE3 1 ATOM 2861 H HZ1 . LYS A 1 150 ? -15.26777 20.08312 -17.68281 1.000 63.65202 ? 150 LYS A HZ1 1 ATOM 2862 H HZ2 . LYS A 1 150 ? -16.42013 20.22659 -18.54872 1.000 63.65202 ? 150 LYS A HZ2 1 ATOM 2863 H HZ3 . LYS A 1 150 ? -15.30314 19.40124 -18.96035 1.000 63.65202 ? 150 LYS A HZ3 1 ATOM 2864 N N . ILE A 1 151 ? -14.24134 26.53618 -15.68913 1.000 38.45403 ? 151 ILE A N 1 ATOM 2865 C CA . ILE A 1 151 ? -13.27940 27.48223 -15.13606 1.000 39.20502 ? 151 ILE A CA 1 ATOM 2866 C C . ILE A 1 151 ? -11.93094 27.18891 -15.77925 1.000 37.92173 ? 151 ILE A C 1 ATOM 2867 O O . ILE A 1 151 ? -11.42316 26.07090 -15.66326 1.000 37.82225 ? 151 ILE A O 1 ATOM 2868 C CB . ILE A 1 151 ? -13.17342 27.35214 -13.60643 1.000 40.13457 ? 151 ILE A CB 1 ATOM 2869 C CG1 . ILE A 1 151 ? -14.53538 27.46301 -12.92734 1.000 52.14871 ? 151 ILE A CG1 1 ATOM 2870 C CG2 . ILE A 1 151 ? -12.18712 28.39178 -13.09815 1.000 37.72392 ? 151 ILE A CG2 1 ATOM 2871 C CD1 . ILE A 1 151 ? -15.20987 28.77025 -13.11090 1.000 53.64536 ? 151 ILE A CD1 1 ATOM 2872 H H . ILE A 1 151 ? -14.26542 25.78892 -15.26414 1.000 46.14483 ? 151 ILE A H 1 ATOM 2873 H HA . ILE A 1 151 ? -13.55817 28.38644 -15.34959 1.000 47.04603 ? 151 ILE A HA 1 ATOM 2874 H HB . ILE A 1 151 ? -12.84542 26.46691 -13.38353 1.000 48.16148 ? 151 ILE A HB 1 ATOM 2875 H HG12 . ILE A 1 151 ? -15.11872 26.77890 -13.29148 1.000 62.57845 ? 151 ILE A HG12 1 ATOM 2876 H HG13 . ILE A 1 151 ? -14.41749 27.32565 -11.97438 1.000 62.57845 ? 151 ILE A HG13 1 ATOM 2877 H HG21 . ILE A 1 151 ? -12.16812 28.36171 -12.12881 1.000 45.26871 ? 151 ILE A HG21 1 ATOM 2878 H HG22 . ILE A 1 151 ? -11.30667 28.19167 -13.45263 1.000 45.26871 ? 151 ILE A HG22 1 ATOM 2879 H HG23 . ILE A 1 151 ? -12.47204 29.26974 -13.39634 1.000 45.26871 ? 151 ILE A HG23 1 ATOM 2880 H HD11 . ILE A 1 151 ? -16.06840 28.74872 -12.65995 1.000 64.37443 ? 151 ILE A HD11 1 ATOM 2881 H HD12 . ILE A 1 151 ? -14.65406 29.46851 -12.73089 1.000 64.37443 ? 151 ILE A HD12 1 ATOM 2882 H HD13 . ILE A 1 151 ? -15.33821 28.92899 -14.05918 1.000 64.37443 ? 151 ILE A HD13 1 ATOM 2883 N N . VAL A 1 152 ? -11.33829 28.18152 -16.44883 1.000 36.22451 ? 152 VAL A N 1 ATOM 2884 C CA . VAL A 1 152 ? -10.04163 28.01824 -17.09972 1.000 35.96947 ? 152 VAL A CA 1 ATOM 2885 C C . VAL A 1 152 ? -8.95943 28.59965 -16.19744 1.000 38.24766 ? 152 VAL A C 1 ATOM 2886 O O . VAL A 1 152 ? -9.11507 29.70121 -15.65778 1.000 38.77537 ? 152 VAL A O 1 ATOM 2887 C CB . VAL A 1 152 ? -10.02187 28.67274 -18.49067 1.000 36.67608 ? 152 VAL A CB 1 ATOM 2888 C CG1 . VAL A 1 152 ? -8.66369 28.43331 -19.16861 1.000 39.05403 ? 152 VAL A CG1 1 ATOM 2889 C CG2 . VAL A 1 152 ? -11.13963 28.12449 -19.31454 1.000 38.92636 ? 152 VAL A CG2 1 ATOM 2890 H H . VAL A 1 152 ? -11.67492 28.96773 -16.53918 1.000 43.46942 ? 152 VAL A H 1 ATOM 2891 H HA . VAL A 1 152 ? -9.86204 27.07154 -17.21115 1.000 43.16337 ? 152 VAL A HA 1 ATOM 2892 H HB . VAL A 1 152 ? -10.14491 29.63134 -18.40801 1.000 44.01130 ? 152 VAL A HB 1 ATOM 2893 H HG11 . VAL A 1 152 ? -8.72151 28.70768 -20.09720 1.000 46.86484 ? 152 VAL A HG11 1 ATOM 2894 H HG12 . VAL A 1 152 ? -7.98601 28.95516 -18.71109 1.000 46.86484 ? 152 VAL A HG12 1 ATOM 2895 H HG13 . VAL A 1 152 ? -8.44623 27.48950 -19.11548 1.000 46.86484 ? 152 VAL A HG13 1 ATOM 2896 H HG21 . VAL A 1 152 ? -11.05844 28.46080 -20.22074 1.000 46.71163 ? 152 VAL A HG21 1 ATOM 2897 H HG22 . VAL A 1 152 ? -11.08595 27.15597 -19.31511 1.000 46.71163 ? 152 VAL A HG22 1 ATOM 2898 H HG23 . VAL A 1 152 ? -11.98384 28.40876 -18.93061 1.000 46.71163 ? 152 VAL A HG23 1 ATOM 2899 N N . PHE A 1 153 ? -7.88951 27.82449 -16.00396 1.000 35.28583 ? 153 PHE A N 1 ATOM 2900 C CA . PHE A 1 153 ? -6.74144 28.13023 -15.15557 1.000 36.17737 ? 153 PHE A CA 1 ATOM 2901 C C . PHE A 1 153 ? -5.51795 28.30102 -16.05254 1.000 36.04239 ? 153 PHE A C 1 ATOM 2902 O O . PHE A 1 153 ? -5.24258 27.43905 -16.88916 1.000 35.83700 ? 153 PHE A O 1 ATOM 2903 C CB . PHE A 1 153 ? -6.54374 26.97636 -14.14673 1.000 35.94045 ? 153 PHE A CB 1 ATOM 2904 C CG . PHE A 1 153 ? -5.26168 27.02714 -13.34005 1.000 37.57232 ? 153 PHE A CG 1 ATOM 2905 C CD1 . PHE A 1 153 ? -4.02535 26.76636 -13.90840 1.000 37.11663 ? 153 PHE A CD1 1 ATOM 2906 C CD2 . PHE A 1 153 ? -5.31964 27.25981 -11.97005 1.000 40.56323 ? 153 PHE A CD2 1 ATOM 2907 C CE1 . PHE A 1 153 ? -2.87069 26.80852 -13.14809 1.000 38.41640 ? 153 PHE A CE1 1 ATOM 2908 C CE2 . PHE A 1 153 ? -4.17431 27.28290 -11.20677 1.000 37.53593 ? 153 PHE A CE2 1 ATOM 2909 C CZ . PHE A 1 153 ? -2.94956 27.05232 -11.79030 1.000 40.93564 ? 153 PHE A CZ 1 ATOM 2910 H H . PHE A 1 153 ? -7.80173 27.05804 -16.38402 1.000 42.34300 ? 153 PHE A H 1 ATOM 2911 H HA . PHE A 1 153 ? -6.86322 28.95581 -14.66112 1.000 43.41285 ? 153 PHE A HA 1 ATOM 2912 H HB2 . PHE A 1 153 ? -7.28154 26.99177 -13.51721 1.000 43.12854 ? 153 PHE A HB2 1 ATOM 2913 H HB3 . PHE A 1 153 ? -6.54327 26.13931 -14.63689 1.000 43.12854 ? 153 PHE A HB3 1 ATOM 2914 H HD1 . PHE A 1 153 ? -3.97109 26.56012 -14.81362 1.000 44.53996 ? 153 PHE A HD1 1 ATOM 2915 H HD2 . PHE A 1 153 ? -6.14406 27.40183 -11.56378 1.000 48.67587 ? 153 PHE A HD2 1 ATOM 2916 H HE1 . PHE A 1 153 ? -2.04298 26.67307 -13.54990 1.000 46.09969 ? 153 PHE A HE1 1 ATOM 2917 H HE2 . PHE A 1 153 ? -4.22837 27.45478 -10.29439 1.000 45.04312 ? 153 PHE A HE2 1 ATOM 2918 H HZ . PHE A 1 153 ? -2.17721 27.06055 -11.27231 1.000 49.12277 ? 153 PHE A HZ 1 ATOM 2919 N N . PHE A 1 154 ? -4.80057 29.41722 -15.88889 1.000 33.94114 ? 154 PHE A N 1 ATOM 2920 C CA . PHE A 1 154 ? -3.51666 29.65833 -16.54243 1.000 34.54928 ? 154 PHE A CA 1 ATOM 2921 C C . PHE A 1 154 ? -2.48911 30.02593 -15.47978 1.000 41.62222 ? 154 PHE A C 1 ATOM 2922 O O . PHE A 1 154 ? -2.76128 30.88999 -14.63650 1.000 39.63825 ? 154 PHE A O 1 ATOM 2923 C CB . PHE A 1 154 ? -3.56073 30.82220 -17.52140 1.000 37.13154 ? 154 PHE A CB 1 ATOM 2924 C CG . PHE A 1 154 ? -3.69727 30.42025 -18.94686 1.000 38.75076 ? 154 PHE A CG 1 ATOM 2925 C CD1 . PHE A 1 154 ? -4.86192 29.83806 -19.39144 1.000 44.78397 ? 154 PHE A CD1 1 ATOM 2926 C CD2 . PHE A 1 154 ? -2.66331 30.62154 -19.83550 1.000 47.15595 ? 154 PHE A CD2 1 ATOM 2927 C CE1 . PHE A 1 154 ? -4.99894 29.46377 -20.71137 1.000 48.32695 ? 154 PHE A CE1 1 ATOM 2928 C CE2 . PHE A 1 154 ? -2.79361 30.24729 -21.16077 1.000 47.19118 ? 154 PHE A CE2 1 ATOM 2929 C CZ . PHE A 1 154 ? -3.96059 29.66300 -21.59020 1.000 44.99478 ? 154 PHE A CZ 1 ATOM 2930 H H . PHE A 1 154 ? -5.04805 30.06973 -15.38631 1.000 40.72937 ? 154 PHE A H 1 ATOM 2931 H HA . PHE A 1 154 ? -3.27275 28.84624 -17.01351 1.000 41.45914 ? 154 PHE A HA 1 ATOM 2932 H HB2 . PHE A 1 154 ? -4.32034 31.38363 -17.30077 1.000 44.55785 ? 154 PHE A HB2 1 ATOM 2933 H HB3 . PHE A 1 154 ? -2.73798 31.32900 -17.43694 1.000 44.55785 ? 154 PHE A HB3 1 ATOM 2934 H HD1 . PHE A 1 154 ? -5.56258 29.69580 -18.79669 1.000 53.74076 ? 154 PHE A HD1 1 ATOM 2935 H HD2 . PHE A 1 154 ? -1.87193 31.01196 -19.54192 1.000 56.58715 ? 154 PHE A HD2 1 ATOM 2936 H HE1 . PHE A 1 154 ? -5.79179 29.07750 -21.00647 1.000 57.99234 ? 154 PHE A HE1 1 ATOM 2937 H HE2 . PHE A 1 154 ? -2.09510 30.39040 -21.75785 1.000 56.62942 ? 154 PHE A HE2 1 ATOM 2938 H HZ . PHE A 1 154 ? -4.04842 29.40140 -22.47832 1.000 53.99374 ? 154 PHE A HZ 1 ATOM 2939 N N . SER A 1 155 ? -1.30781 29.41996 -15.53625 1.000 35.07528 ? 155 SER A N 1 ATOM 2940 C CA A SER A 1 155 ? -0.19078 29.82513 -14.68521 0.703 34.91832 ? 155 SER A CA 1 ATOM 2941 C CA B SER A 1 155 ? -0.19327 29.82972 -14.69015 0.297 35.15573 ? 155 SER A CA 1 ATOM 2942 C C . SER A 1 155 ? 1.07297 29.84621 -15.53136 1.000 41.87631 ? 155 SER A C 1 ATOM 2943 O O . SER A 1 155 ? 1.27713 28.96673 -16.37038 1.000 41.32831 ? 155 SER A O 1 ATOM 2944 C CB A SER A 1 155 ? -0.01912 28.89974 -13.46253 0.703 35.91611 ? 155 SER A CB 1 ATOM 2945 C CB B SER A 1 155 ? -0.01394 28.89924 -13.48901 0.297 35.88444 ? 155 SER A CB 1 ATOM 2946 O OG A SER A 1 155 ? 0.33379 27.56080 -13.77897 0.703 36.56992 ? 155 SER A OG 1 ATOM 2947 O OG B SER A 1 155 ? 0.91709 29.44322 -12.56757 0.297 40.40201 ? 155 SER A OG 1 ATOM 2948 H H A SER A 1 155 ? -1.12556 28.76553 -16.06362 0.703 42.09034 ? 155 SER A H 1 ATOM 2949 H H B SER A 1 155 ? -1.12596 28.76340 -16.06110 0.297 42.09034 ? 155 SER A H 1 ATOM 2950 H HA A SER A 1 155 ? -0.34596 30.71760 -14.33831 0.703 41.90199 ? 155 SER A HA 1 ATOM 2951 H HA B SER A 1 155 ? -0.35375 30.72256 -14.34666 0.297 42.18688 ? 155 SER A HA 1 ATOM 2952 H HB2 A SER A 1 155 ? 0.67985 29.27009 -12.90112 0.703 43.09934 ? 155 SER A HB2 1 ATOM 2953 H HB2 B SER A 1 155 ? -0.86923 28.78703 -13.04541 0.297 43.06132 ? 155 SER A HB2 1 ATOM 2954 H HB3 A SER A 1 155 ? -0.85941 28.88262 -12.97827 0.703 43.09934 ? 155 SER A HB3 1 ATOM 2955 H HB3 B SER A 1 155 ? 0.31362 28.04084 -13.80005 0.297 43.06132 ? 155 SER A HB3 1 ATOM 2956 H HG A SER A 1 155 ? 1.09700 27.53997 -14.12923 0.703 43.88390 ? 155 SER A HG 1 ATOM 2957 H HG B SER A 1 155 ? 1.44844 29.95762 -12.96589 0.297 48.48242 ? 155 SER A HG 1 ATOM 2958 N N . ASP A 1 156 ? 1.91922 30.84997 -15.30176 1.000 35.65535 ? 156 ASP A N 1 ATOM 2959 C CA . ASP A 1 156 ? 3.08504 31.08752 -16.14966 1.000 35.84658 ? 156 ASP A CA 1 ATOM 2960 C C . ASP A 1 156 ? 4.24046 31.56804 -15.28838 1.000 37.37537 ? 156 ASP A C 1 ATOM 2961 O O . ASP A 1 156 ? 4.05812 32.42996 -14.42773 1.000 38.07327 ? 156 ASP A O 1 ATOM 2962 C CB . ASP A 1 156 ? 2.67798 32.11034 -17.23053 1.000 37.50016 ? 156 ASP A CB 1 ATOM 2963 C CG . ASP A 1 156 ? 3.76871 32.43575 -18.22900 1.000 39.25386 ? 156 ASP A CG 1 ATOM 2964 O OD1 . ASP A 1 156 ? 4.89417 32.80267 -17.85975 1.000 38.09258 ? 156 ASP A OD1 1 ATOM 2965 O OD2 . ASP A 1 156 ? 3.44288 32.39623 -19.43435 1.000 43.08777 ? 156 ASP A OD2 1 ATOM 2966 H H . ASP A 1 156 ? 1.83807 31.41131 -14.65530 1.000 42.78642 ? 156 ASP A H 1 ATOM 2967 H HA . ASP A 1 156 ? 3.40601 30.28029 -16.58123 1.000 43.01590 ? 156 ASP A HA 1 ATOM 2968 H HB2 . ASP A 1 156 ? 1.92454 31.75333 -17.72628 1.000 45.00019 ? 156 ASP A HB2 1 ATOM 2969 H HB3 . ASP A 1 156 ? 2.42502 32.93844 -16.79331 1.000 45.00019 ? 156 ASP A HB3 1 ATOM 2970 N N . ILE A 1 157 ? 5.42916 30.98859 -15.51028 1.000 36.39273 ? 157 ILE A N 1 ATOM 2971 C CA . ILE A 1 157 ? 6.61805 31.36963 -14.75173 1.000 37.45199 ? 157 ILE A CA 1 ATOM 2972 C C . ILE A 1 157 ? 7.03138 32.80348 -15.05827 1.000 38.77938 ? 157 ILE A C 1 ATOM 2973 O O . ILE A 1 157 ? 7.08809 33.23783 -16.21866 1.000 37.17835 ? 157 ILE A O 1 ATOM 2974 C CB . ILE A 1 157 ? 7.78158 30.39660 -15.04990 1.000 34.92233 ? 157 ILE A CB 1 ATOM 2975 C CG1 . ILE A 1 157 ? 7.38396 28.97891 -14.62289 1.000 38.28911 ? 157 ILE A CG1 1 ATOM 2976 C CG2 . ILE A 1 157 ? 9.09569 30.88637 -14.38549 1.000 40.09807 ? 157 ILE A CG2 1 ATOM 2977 C CD1 . ILE A 1 157 ? 8.38377 27.92960 -15.00003 1.000 38.32462 ? 157 ILE A CD1 1 ATOM 2978 H H . ILE A 1 157 ? 5.56900 30.37340 -16.09473 1.000 43.67127 ? 157 ILE A H 1 ATOM 2979 H HA . ILE A 1 157 ? 6.39390 31.32071 -13.80926 1.000 44.94239 ? 157 ILE A HA 1 ATOM 2980 H HB . ILE A 1 157 ? 7.95387 30.37624 -16.00426 1.000 41.90679 ? 157 ILE A HB 1 ATOM 2981 H HG12 . ILE A 1 157 ? 7.28562 28.96030 -13.65806 1.000 45.94694 ? 157 ILE A HG12 1 ATOM 2982 H HG13 . ILE A 1 157 ? 6.54181 28.75066 -15.04666 1.000 45.94694 ? 157 ILE A HG13 1 ATOM 2983 H HG21 . ILE A 1 157 ? 9.74955 30.17042 -14.41335 1.000 48.11768 ? 157 ILE A HG21 1 ATOM 2984 H HG22 . ILE A 1 157 ? 9.42774 31.65673 -14.87251 1.000 48.11768 ? 157 ILE A HG22 1 ATOM 2985 H HG23 . ILE A 1 157 ? 8.91204 31.13098 -13.46498 1.000 48.11768 ? 157 ILE A HG23 1 ATOM 2986 H HD11 . ILE A 1 157 ? 7.97051 27.05582 -14.91859 1.000 45.98955 ? 157 ILE A HD11 1 ATOM 2987 H HD12 . ILE A 1 157 ? 8.66667 28.07763 -15.91597 1.000 45.98955 ? 157 ILE A HD12 1 ATOM 2988 H HD13 . ILE A 1 157 ? 9.14662 27.99154 -14.40411 1.000 45.98955 ? 157 ILE A HD13 1 ATOM 2989 N N . VAL A 1 158 ? 7.35490 33.54237 -13.99942 1.000 37.67114 ? 158 VAL A N 1 ATOM 2990 C CA . VAL A 1 158 ? 7.85101 34.90644 -14.11669 1.000 38.04861 ? 158 VAL A CA 1 ATOM 2991 C C . VAL A 1 158 ? 9.30801 34.91110 -14.57006 1.000 38.50688 ? 158 VAL A C 1 ATOM 2992 O O . VAL A 1 158 ? 10.16288 34.26697 -13.95291 1.000 41.44095 ? 158 VAL A O 1 ATOM 2993 C CB . VAL A 1 158 ? 7.69666 35.64421 -12.77359 1.000 39.69536 ? 158 VAL A CB 1 ATOM 2994 C CG1 . VAL A 1 158 ? 8.20664 37.05424 -12.91801 1.000 43.20808 ? 158 VAL A CG1 1 ATOM 2995 C CG2 . VAL A 1 158 ? 6.24029 35.58379 -12.30586 1.000 41.68968 ? 158 VAL A CG2 1 ATOM 2996 H H . VAL A 1 158 ? 7.29395 33.26883 -13.18636 1.000 45.20537 ? 158 VAL A H 1 ATOM 2997 H HA . VAL A 1 158 ? 7.33920 35.36032 -14.80439 1.000 45.65833 ? 158 VAL A HA 1 ATOM 2998 H HB . VAL A 1 158 ? 8.22588 35.21593 -12.08265 1.000 47.63444 ? 158 VAL A HB 1 ATOM 2999 H HG11 . VAL A 1 158 ? 7.89293 37.58200 -12.16703 1.000 51.84970 ? 158 VAL A HG11 1 ATOM 3000 H HG12 . VAL A 1 158 ? 9.17646 37.03964 -12.92987 1.000 51.84970 ? 158 VAL A HG12 1 ATOM 3001 H HG13 . VAL A 1 158 ? 7.87127 37.42791 -13.74795 1.000 51.84970 ? 158 VAL A HG13 1 ATOM 3002 H HG21 . VAL A 1 158 ? 6.13553 36.15007 -11.52531 1.000 50.02761 ? 158 VAL A HG21 1 ATOM 3003 H HG22 . VAL A 1 158 ? 5.66549 35.89732 -13.02154 1.000 50.02761 ? 158 VAL A HG22 1 ATOM 3004 H HG23 . VAL A 1 158 ? 6.01854 34.66657 -12.08126 1.000 50.02761 ? 158 VAL A HG23 1 ATOM 3005 N N . SER A 1 159 ? 9.58102 35.62350 -15.67271 1.000 38.84298 ? 159 SER A N 1 ATOM 3006 C CA A SER A 1 159 ? 10.94201 35.87220 -16.14649 0.822 42.56826 ? 159 SER A CA 1 ATOM 3007 C CA B SER A 1 159 ? 10.94080 35.87227 -16.15836 0.178 42.69614 ? 159 SER A CA 1 ATOM 3008 C C . SER A 1 159 ? 11.70099 34.57109 -16.40379 1.000 45.60532 ? 159 SER A C 1 ATOM 3009 O O . SER A 1 159 ? 12.89612 34.46316 -16.12661 1.000 48.14316 ? 159 SER A O 1 ATOM 3010 C CB A SER A 1 159 ? 11.70767 36.76304 -15.15657 0.822 45.91921 ? 159 SER A CB 1 ATOM 3011 C CB B SER A 1 159 ? 11.71220 36.77853 -15.19291 0.178 46.18089 ? 159 SER A CB 1 ATOM 3012 O OG A SER A 1 159 ? 12.70517 37.51175 -15.82656 0.822 60.63517 ? 159 SER A OG 1 ATOM 3013 O OG B SER A 1 159 ? 12.23343 36.04049 -14.10455 0.178 52.50231 ? 159 SER A OG 1 ATOM 3014 H H A SER A 1 159 ? 8.97816 35.97963 -16.17203 0.822 46.61158 ? 159 SER A H 1 ATOM 3015 H H B SER A 1 159 ? 8.97675 35.98202 -16.16861 0.178 46.61158 ? 159 SER A H 1 ATOM 3016 H HA A SER A 1 159 ? 10.88551 36.33653 -16.99626 0.822 51.08191 ? 159 SER A HA 1 ATOM 3017 H HA B SER A 1 159 ? 10.87474 36.32698 -17.01263 0.178 51.23536 ? 159 SER A HA 1 ATOM 3018 H HB2 A SER A 1 159 ? 11.08442 37.37388 -14.73312 0.822 55.10306 ? 159 SER A HB2 1 ATOM 3019 H HB2 B SER A 1 159 ? 12.44655 37.19440 -15.67112 0.178 55.41707 ? 159 SER A HB2 1 ATOM 3020 H HB3 A SER A 1 159 ? 12.12932 36.20215 -14.48685 0.822 55.10306 ? 159 SER A HB3 1 ATOM 3021 H HB3 B SER A 1 159 ? 11.11068 37.45887 -14.85201 0.178 55.41707 ? 159 SER A HB3 1 ATOM 3022 H HG A SER A 1 159 ? 13.11253 38.00192 -15.27940 0.822 72.76220 ? 159 SER A HG 1 ATOM 3023 H HG B SER A 1 159 ? 12.86773 35.55487 -14.36424 0.178 63.00278 ? 159 SER A HG 1 ATOM 3024 N N . PHE A 1 160 ? 11.00733 33.57792 -16.96007 1.000 42.76785 ? 160 PHE A N 1 ATOM 3025 C CA . PHE A 1 160 ? 11.67266 32.32594 -17.31385 1.000 40.30850 ? 160 PHE A CA 1 ATOM 3026 C C . PHE A 1 160 ? 12.82062 32.53563 -18.29282 1.000 46.75148 ? 160 PHE A C 1 ATOM 3027 O O . PHE A 1 160 ? 13.80741 31.79152 -18.25806 1.000 47.64828 ? 160 PHE A O 1 ATOM 3028 C CB . PHE A 1 160 ? 10.67212 31.35711 -17.92821 1.000 41.97429 ? 160 PHE A CB 1 ATOM 3029 C CG . PHE A 1 160 ? 11.27939 30.04585 -18.33570 1.000 48.36857 ? 160 PHE A CG 1 ATOM 3030 C CD1 . PHE A 1 160 ? 11.52951 29.06699 -17.39210 1.000 54.24005 ? 160 PHE A CD1 1 ATOM 3031 C CD2 . PHE A 1 160 ? 11.60650 29.80115 -19.65270 1.000 54.98150 ? 160 PHE A CD2 1 ATOM 3032 C CE1 . PHE A 1 160 ? 12.08871 27.85423 -17.76625 1.000 52.60085 ? 160 PHE A CE1 1 ATOM 3033 C CE2 . PHE A 1 160 ? 12.17454 28.59716 -20.02529 1.000 54.68072 ? 160 PHE A CE2 1 ATOM 3034 C CZ . PHE A 1 160 ? 12.40934 27.63011 -19.07499 1.000 50.41456 ? 160 PHE A CZ 1 ATOM 3035 H H . PHE A 1 160 ? 10.16669 33.60270 -17.13980 1.000 51.32142 ? 160 PHE A H 1 ATOM 3036 H HA . PHE A 1 160 ? 12.03110 31.94223 -16.49826 1.000 48.37020 ? 160 PHE A HA 1 ATOM 3037 H HB2 . PHE A 1 160 ? 9.97593 31.17276 -17.27842 1.000 50.36914 ? 160 PHE A HB2 1 ATOM 3038 H HB3 . PHE A 1 160 ? 10.28752 31.76499 -18.71980 1.000 50.36914 ? 160 PHE A HB3 1 ATOM 3039 H HD1 . PHE A 1 160 ? 11.32112 29.22296 -16.49927 1.000 65.08806 ? 160 PHE A HD1 1 ATOM 3040 H HD2 . PHE A 1 160 ? 11.44344 30.45226 -20.29642 1.000 65.97780 ? 160 PHE A HD2 1 ATOM 3041 H HE1 . PHE A 1 160 ? 12.24487 27.19583 -17.12826 1.000 63.12102 ? 160 PHE A HE1 1 ATOM 3042 H HE2 . PHE A 1 160 ? 12.39710 28.44140 -20.91473 1.000 65.61687 ? 160 PHE A HE2 1 ATOM 3043 H HZ . PHE A 1 160 ? 12.78875 26.81877 -19.32535 1.000 60.49748 ? 160 PHE A HZ 1 ATOM 3044 N N . SER A 1 161 ? 12.70252 33.52010 -19.18587 1.000 43.78930 ? 161 SER A N 1 ATOM 3045 C CA . SER A 1 161 ? 13.72736 33.72195 -20.20761 1.000 51.09225 ? 161 SER A CA 1 ATOM 3046 C C . SER A 1 161 ? 15.09095 33.91809 -19.57248 1.000 54.07296 ? 161 SER A C 1 ATOM 3047 O O . SER A 1 161 ? 16.12635 33.61821 -20.18111 1.000 54.60585 ? 161 SER A O 1 ATOM 3048 C CB . SER A 1 161 ? 13.36847 34.93035 -21.06828 1.000 59.83768 ? 161 SER A CB 1 ATOM 3049 O OG . SER A 1 161 ? 12.28760 34.63079 -21.93284 1.000 64.55059 ? 161 SER A OG 1 ATOM 3050 H H . SER A 1 161 ? 12.04801 34.07685 -19.22108 1.000 52.54716 ? 161 SER A H 1 ATOM 3051 H HA . SER A 1 161 ? 13.76523 32.94283 -20.78418 1.000 61.31071 ? 161 SER A HA 1 ATOM 3052 H HB2 . SER A 1 161 ? 13.11500 35.66616 -20.48929 1.000 71.80521 ? 161 SER A HB2 1 ATOM 3053 H HB3 . SER A 1 161 ? 14.13985 35.17835 -21.60155 1.000 71.80521 ? 161 SER A HB3 1 ATOM 3054 H HG . SER A 1 161 ? 12.10459 35.29994 -22.40649 1.000 77.46070 ? 161 SER A HG 1 ATOM 3055 N N . THR A 1 162 ? 15.10190 34.41334 -18.34310 1.000 49.09332 ? 162 THR A N 1 ATOM 3056 C CA . THR A 1 162 ? 16.34923 34.64406 -17.63398 1.000 57.84527 ? 162 THR A CA 1 ATOM 3057 C C . THR A 1 162 ? 17.02069 33.32424 -17.27255 1.000 58.99530 ? 162 THR A C 1 ATOM 3058 O O . THR A 1 162 ? 18.23809 33.17124 -17.44169 1.000 56.36741 ? 162 THR A O 1 ATOM 3059 C CB . THR A 1 162 ? 16.05241 35.48001 -16.39214 1.000 64.99159 ? 162 THR A CB 1 ATOM 3060 O OG1 . THR A 1 162 ? 15.62965 36.78530 -16.80589 1.000 59.21761 ? 162 THR A OG1 1 ATOM 3061 C CG2 . THR A 1 162 ? 17.28958 35.61098 -15.51416 1.000 79.30494 ? 162 THR A CG2 1 ATOM 3062 H H . THR A 1 162 ? 14.39869 34.62494 -17.89553 1.000 58.91198 ? 162 THR A H 1 ATOM 3063 H HA . THR A 1 162 ? 16.96941 35.13582 -18.19474 1.000 69.41432 ? 162 THR A HA 1 ATOM 3064 H HB . THR A 1 162 ? 15.35795 35.05103 -15.86811 1.000 77.98991 ? 162 THR A HB 1 ATOM 3065 H HG1 . THR A 1 162 ? 15.43719 37.25135 -16.13406 1.000 71.06113 ? 162 THR A HG1 1 ATOM 3066 H HG21 . THR A 1 162 ? 17.08419 36.14153 -14.72852 1.000 95.16593 ? 162 THR A HG21 1 ATOM 3067 H HG22 . THR A 1 162 ? 17.59019 34.73314 -15.23144 1.000 95.16593 ? 162 THR A HG22 1 ATOM 3068 H HG23 . THR A 1 162 ? 18.00300 36.04387 -16.00866 1.000 95.16593 ? 162 THR A HG23 1 ATOM 3069 N N . PHE A 1 163 ? 16.24492 32.36676 -16.74855 1.000 50.75751 ? 163 PHE A N 1 ATOM 3070 C CA . PHE A 1 163 ? 16.78009 31.03642 -16.47714 1.000 48.95905 ? 163 PHE A CA 1 ATOM 3071 C C . PHE A 1 163 ? 17.47291 30.49120 -17.71901 1.000 46.04543 ? 163 PHE A C 1 ATOM 3072 O O . PHE A 1 163 ? 18.61906 30.03634 -17.66611 1.000 53.72366 ? 163 PHE A O 1 ATOM 3073 C CB . PHE A 1 163 ? 15.67111 30.05398 -16.07075 1.000 48.05980 ? 163 PHE A CB 1 ATOM 3074 C CG . PHE A 1 163 ? 15.04271 30.31469 -14.72504 1.000 48.78200 ? 163 PHE A CG 1 ATOM 3075 C CD1 . PHE A 1 163 ? 13.97535 31.18906 -14.60065 1.000 62.02327 ? 163 PHE A CD1 1 ATOM 3076 C CD2 . PHE A 1 163 ? 15.48250 29.64171 -13.59757 1.000 49.90129 ? 163 PHE A CD2 1 ATOM 3077 C CE1 . PHE A 1 163 ? 13.38153 31.40790 -13.36837 1.000 56.40223 ? 163 PHE A CE1 1 ATOM 3078 C CE2 . PHE A 1 163 ? 14.90036 29.86053 -12.36392 1.000 51.69997 ? 163 PHE A CE2 1 ATOM 3079 C CZ . PHE A 1 163 ? 13.84407 30.73602 -12.25011 1.000 51.46080 ? 163 PHE A CZ 1 ATOM 3080 H H . PHE A 1 163 ? 15.41517 32.46458 -16.54475 1.000 60.90901 ? 163 PHE A H 1 ATOM 3081 H HA . PHE A 1 163 ? 17.40290 31.11282 -15.73743 1.000 58.75086 ? 163 PHE A HA 1 ATOM 3082 H HB2 . PHE A 1 163 ? 14.96461 30.09844 -16.73391 1.000 57.67176 ? 163 PHE A HB2 1 ATOM 3083 H HB3 . PHE A 1 163 ? 16.04758 29.16035 -16.04646 1.000 57.67176 ? 163 PHE A HB3 1 ATOM 3084 H HD1 . PHE A 1 163 ? 13.65432 31.63351 -15.35185 1.000 74.42792 ? 163 PHE A HD1 1 ATOM 3085 H HD2 . PHE A 1 163 ? 16.18118 29.03244 -13.67203 1.000 59.88155 ? 163 PHE A HD2 1 ATOM 3086 H HE1 . PHE A 1 163 ? 12.67299 32.00550 -13.29254 1.000 67.68267 ? 163 PHE A HE1 1 ATOM 3087 H HE2 . PHE A 1 163 ? 15.22138 29.41735 -11.61196 1.000 62.03997 ? 163 PHE A HE2 1 ATOM 3088 H HZ . PHE A 1 163 ? 13.44195 30.87579 -11.42327 1.000 61.75296 ? 163 PHE A HZ 1 ATOM 3089 N N . ALA A 1 164 ? 16.76322 30.53054 -18.85096 1.000 52.65621 ? 164 ALA A N 1 ATOM 3090 C CA . ALA A 1 164 ? 17.26432 29.94544 -20.08869 1.000 52.37160 ? 164 ALA A CA 1 ATOM 3091 C C . ALA A 1 164 ? 18.56216 30.59315 -20.53638 1.000 65.31230 ? 164 ALA A C 1 ATOM 3092 O O . ALA A 1 164 ? 19.37894 29.94822 -21.20411 1.000 61.94191 ? 164 ALA A O 1 ATOM 3093 C CB . ALA A 1 164 ? 16.20353 30.07984 -21.18240 1.000 52.39678 ? 164 ALA A CB 1 ATOM 3094 H H . ALA A 1 164 ? 15.98650 30.89198 -18.92617 1.000 63.18745 ? 164 ALA A H 1 ATOM 3095 H HA . ALA A 1 164 ? 17.44083 29.00309 -19.94134 1.000 62.84592 ? 164 ALA A HA 1 ATOM 3096 H HB1 . ALA A 1 164 ? 16.54539 29.69223 -22.00325 1.000 62.87614 ? 164 ALA A HB1 1 ATOM 3097 H HB2 . ALA A 1 164 ? 15.40159 29.61056 -20.90391 1.000 62.87614 ? 164 ALA A HB2 1 ATOM 3098 H HB3 . ALA A 1 164 ? 16.00657 31.01998 -21.31749 1.000 62.87614 ? 164 ALA A HB3 1 ATOM 3099 N N . GLU A 1 165 ? 18.77454 31.85894 -20.17883 1.000 62.38650 ? 165 GLU A N 1 ATOM 3100 C CA . GLU A 1 165 ? 19.95890 32.56500 -20.64664 1.000 71.96735 ? 165 GLU A CA 1 ATOM 3101 C C . GLU A 1 165 ? 21.17103 32.30385 -19.76396 1.000 68.75178 ? 165 GLU A C 1 ATOM 3102 O O . GLU A 1 165 ? 22.30541 32.36744 -20.24872 1.000 68.35700 ? 165 GLU A O 1 ATOM 3103 C CB . GLU A 1 165 ? 19.67801 34.06821 -20.71471 1.000 82.30602 ? 165 GLU A CB 1 ATOM 3104 C CG . GLU A 1 165 ? 19.59280 34.61429 -22.13023 1.000 105.63922 ? 165 GLU A CG 1 ATOM 3105 C CD . GLU A 1 165 ? 20.90922 34.50059 -22.87628 1.000 142.93781 ? 165 GLU A CD 1 ATOM 3106 O OE1 . GLU A 1 165 ? 20.96140 33.76061 -23.88161 1.000 143.72734 ? 165 GLU A OE1 1 ATOM 3107 O OE2 . GLU A 1 165 ? 21.89206 35.14735 -22.45556 1.000 140.09181 ? 165 GLU A OE2 1 ATOM 3108 H H . GLU A 1 165 ? 18.25494 32.32236 -19.67400 1.000 74.86381 ? 165 GLU A H 1 ATOM 3109 H HA . GLU A 1 165 ? 20.17064 32.25537 -21.54117 1.000 86.36082 ? 165 GLU A HA 1 ATOM 3110 H HB2 . GLU A 1 165 ? 18.83078 34.24677 -20.27742 1.000 98.76723 ? 165 GLU A HB2 1 ATOM 3111 H HB3 . GLU A 1 165 ? 20.39263 34.53948 -20.25851 1.000 98.76723 ? 165 GLU A HB3 1 ATOM 3112 H HG2 . GLU A 1 165 ? 18.92324 34.11466 -22.62314 1.000 126.76706 ? 165 GLU A HG2 1 ATOM 3113 H HG3 . GLU A 1 165 ? 19.34716 35.55198 -22.09417 1.000 126.76706 ? 165 GLU A HG3 1 ATOM 3114 N N . LYS A 1 166 ? 20.95496 31.98518 -18.48662 1.000 61.39175 ? 166 LYS A N 1 ATOM 3115 C CA . LYS A 1 166 ? 22.02276 31.96081 -17.50074 1.000 64.46257 ? 166 LYS A CA 1 ATOM 3116 C C . LYS A 1 166 ? 22.42981 30.56940 -17.03022 1.000 68.07687 ? 166 LYS A C 1 ATOM 3117 O O . LYS A 1 166 ? 23.52627 30.42348 -16.48234 1.000 66.90218 ? 166 LYS A O 1 ATOM 3118 C CB . LYS A 1 166 ? 21.60562 32.78008 -16.26871 1.000 72.34306 ? 166 LYS A CB 1 ATOM 3119 C CG . LYS A 1 166 ? 21.25275 34.23053 -16.56995 1.000 88.94311 ? 166 LYS A CG 1 ATOM 3120 C CD . LYS A 1 166 ? 22.45688 35.02243 -17.05486 1.000 107.43316 ? 166 LYS A CD 1 ATOM 3121 C CE . LYS A 1 166 ? 22.05164 36.40848 -17.53361 1.000 112.18432 ? 166 LYS A CE 1 ATOM 3122 N NZ . LYS A 1 166 ? 22.58630 37.48485 -16.65522 1.000 118.85438 ? 166 LYS A NZ 1 ATOM 3123 H H . LYS A 1 166 ? 20.18448 31.77674 -18.16644 1.000 73.67010 ? 166 LYS A H 1 ATOM 3124 H HA . LYS A 1 166 ? 22.80881 32.36510 -17.90020 1.000 77.35508 ? 166 LYS A HA 1 ATOM 3125 H HB2 . LYS A 1 166 ? 20.82488 32.36449 -15.87042 1.000 86.81167 ? 166 LYS A HB2 1 ATOM 3126 H HB3 . LYS A 1 166 ? 22.34004 32.78199 -15.63504 1.000 86.81167 ? 166 LYS A HB3 1 ATOM 3127 H HG2 . LYS A 1 166 ? 20.57452 34.25669 -17.26293 1.000 106.73174 ? 166 LYS A HG2 1 ATOM 3128 H HG3 . LYS A 1 166 ? 20.91869 34.65200 -15.76270 1.000 106.73174 ? 166 LYS A HG3 1 ATOM 3129 H HD2 . LYS A 1 166 ? 23.09000 35.12360 -16.32696 1.000 128.91980 ? 166 LYS A HD2 1 ATOM 3130 H HD3 . LYS A 1 166 ? 22.87392 34.55352 -17.79453 1.000 128.91980 ? 166 LYS A HD3 1 ATOM 3131 H HE2 . LYS A 1 166 ? 22.39685 36.54978 -18.42902 1.000 134.62119 ? 166 LYS A HE2 1 ATOM 3132 H HE3 . LYS A 1 166 ? 21.08386 36.47401 -17.53698 1.000 134.62119 ? 166 LYS A HE3 1 ATOM 3133 H HZ1 . LYS A 1 166 ? 22.32917 38.28108 -16.95854 1.000 142.62526 ? 166 LYS A HZ1 1 ATOM 3134 H HZ2 . LYS A 1 166 ? 22.28204 37.37983 -15.82546 1.000 142.62526 ? 166 LYS A HZ2 1 ATOM 3135 H HZ3 . LYS A 1 166 ? 23.47568 37.45393 -16.64282 1.000 142.62526 ? 166 LYS A HZ3 1 ATOM 3136 N N . LEU A 1 167 ? 21.58798 29.55508 -17.21972 1.000 52.40733 ? 167 LEU A N 1 ATOM 3137 C CA . LEU A 1 167 ? 21.80229 28.22200 -16.67084 1.000 47.66010 ? 167 LEU A CA 1 ATOM 3138 C C . LEU A 1 167 ? 22.09898 27.20640 -17.77392 1.000 48.18654 ? 167 LEU A C 1 ATOM 3139 O O . LEU A 1 167 ? 21.65698 27.37913 -18.91265 1.000 50.46216 ? 167 LEU A O 1 ATOM 3140 C CB . LEU A 1 167 ? 20.56442 27.73816 -15.90609 1.000 50.47390 ? 167 LEU A CB 1 ATOM 3141 C CG . LEU A 1 167 ? 20.10146 28.54421 -14.69315 1.000 59.41116 ? 167 LEU A CG 1 ATOM 3142 C CD1 . LEU A 1 167 ? 18.81731 27.95642 -14.12414 1.000 58.03368 ? 167 LEU A CD1 1 ATOM 3143 C CD2 . LEU A 1 167 ? 21.19956 28.56171 -13.65186 1.000 61.78182 ? 167 LEU A CD2 1 ATOM 3144 H H . LEU A 1 167 ? 20.86273 29.61781 -17.67763 1.000 62.88880 ? 167 LEU A H 1 ATOM 3145 H HA . LEU A 1 167 ? 22.56016 28.25509 -16.06632 1.000 57.19212 ? 167 LEU A HA 1 ATOM 3146 H HB2 . LEU A 1 167 ? 19.82144 27.72397 -16.52953 1.000 60.56869 ? 167 LEU A HB2 1 ATOM 3147 H HB3 . LEU A 1 167 ? 20.74822 26.84024 -15.58851 1.000 60.56869 ? 167 LEU A HB3 1 ATOM 3148 H HG . LEU A 1 167 ? 19.91175 29.45869 -14.95514 1.000 71.29339 ? 167 LEU A HG 1 ATOM 3149 H HD11 . LEU A 1 167 ? 18.53576 28.48927 -13.36407 1.000 69.64041 ? 167 LEU A HD11 1 ATOM 3150 H HD12 . LEU A 1 167 ? 18.13201 27.97116 -14.81046 1.000 69.64041 ? 167 LEU A HD12 1 ATOM 3151 H HD13 . LEU A 1 167 ? 18.98513 27.04310 -13.84382 1.000 69.64041 ? 167 LEU A HD13 1 ATOM 3152 H HD21 . LEU A 1 167 ? 20.85788 28.96668 -12.83936 1.000 74.13818 ? 167 LEU A HD21 1 ATOM 3153 H HD22 . LEU A 1 167 ? 21.48095 27.65056 -13.47430 1.000 74.13818 ? 167 LEU A HD22 1 ATOM 3154 H HD23 . LEU A 1 167 ? 21.94728 29.07886 -13.99008 1.000 74.13818 ? 167 LEU A HD23 1 ATOM 3155 N N . PRO A 1 168 ? 22.82526 26.12745 -17.46326 1.000 48.55177 ? 168 PRO A N 1 ATOM 3156 C CA . PRO A 1 168 ? 22.95753 25.03080 -18.43066 1.000 52.16700 ? 168 PRO A CA 1 ATOM 3157 C C . PRO A 1 168 ? 21.60147 24.41872 -18.74245 1.000 50.07892 ? 168 PRO A C 1 ATOM 3158 O O . PRO A 1 168 ? 20.67315 24.46033 -17.93135 1.000 45.80923 ? 168 PRO A O 1 ATOM 3159 C CB . PRO A 1 168 ? 23.87692 24.02987 -17.71757 1.000 53.38462 ? 168 PRO A CB 1 ATOM 3160 C CG . PRO A 1 168 ? 24.58368 24.83725 -16.68223 1.000 59.86170 ? 168 PRO A CG 1 ATOM 3161 C CD . PRO A 1 168 ? 23.56263 25.83171 -16.22246 1.000 52.41899 ? 168 PRO A CD 1 ATOM 3162 H HA . PRO A 1 168 ? 23.38216 25.33354 -19.24855 1.000 62.60040 ? 168 PRO A HA 1 ATOM 3163 H HB2 . PRO A 1 168 ? 23.34802 23.32648 -17.30963 1.000 64.06155 ? 168 PRO A HB2 1 ATOM 3164 H HB3 . PRO A 1 168 ? 24.50521 23.64800 -18.35028 1.000 64.06155 ? 168 PRO A HB3 1 ATOM 3165 H HG2 . PRO A 1 168 ? 24.86786 24.26613 -15.95151 1.000 71.83404 ? 168 PRO A HG2 1 ATOM 3166 H HG3 . PRO A 1 168 ? 25.35172 25.28182 -17.07386 1.000 71.83404 ? 168 PRO A HG3 1 ATOM 3167 H HD2 . PRO A 1 168 ? 22.97685 25.44527 -15.55281 1.000 62.90279 ? 168 PRO A HD2 1 ATOM 3168 H HD3 . PRO A 1 168 ? 23.98731 26.62983 -15.87096 1.000 62.90279 ? 168 PRO A HD3 1 ATOM 3169 N N A VAL A 1 169 ? 21.50218 23.83383 -19.93658 0.646 48.07778 ? 169 VAL A N 1 ATOM 3170 N N B VAL A 1 169 ? 21.50839 23.81905 -19.93282 0.354 48.10923 ? 169 VAL A N 1 ATOM 3171 C CA A VAL A 1 169 ? 20.21302 23.36699 -20.44067 0.646 47.38178 ? 169 VAL A CA 1 ATOM 3172 C CA B VAL A 1 169 ? 20.21916 23.36036 -20.44429 0.354 47.40010 ? 169 VAL A CA 1 ATOM 3173 C C A VAL A 1 169 ? 19.56428 22.37820 -19.47556 0.646 45.58117 ? 169 VAL A C 1 ATOM 3174 C C B VAL A 1 169 ? 19.56456 22.37680 -19.48050 0.354 45.61816 ? 169 VAL A C 1 ATOM 3175 O O A VAL A 1 169 ? 18.35244 22.42814 -19.23786 0.646 44.25407 ? 169 VAL A O 1 ATOM 3176 O O B VAL A 1 169 ? 18.35310 22.43448 -19.24158 0.354 44.44680 ? 169 VAL A O 1 ATOM 3177 C CB A VAL A 1 169 ? 20.39788 22.75532 -21.84237 0.646 50.33890 ? 169 VAL A CB 1 ATOM 3178 C CB B VAL A 1 169 ? 20.39270 22.74362 -21.84628 0.354 50.27297 ? 169 VAL A CB 1 ATOM 3179 C CG1 A VAL A 1 169 ? 19.22081 21.89432 -22.21523 0.646 45.15664 ? 169 VAL A CG1 1 ATOM 3180 C CG1 B VAL A 1 169 ? 21.15580 23.69658 -22.75549 0.354 51.92798 ? 169 VAL A CG1 1 ATOM 3181 C CG2 A VAL A 1 169 ? 20.59771 23.85696 -22.86988 0.646 55.58556 ? 169 VAL A CG2 1 ATOM 3182 C CG2 B VAL A 1 169 ? 21.11114 21.40517 -21.76252 0.354 46.37736 ? 169 VAL A CG2 1 ATOM 3183 H H A VAL A 1 169 ? 22.16189 23.69629 -20.47086 0.646 57.69334 ? 169 VAL A H 1 ATOM 3184 H H B VAL A 1 169 ? 22.17210 23.66771 -20.45836 0.354 57.73107 ? 169 VAL A H 1 ATOM 3185 H HA A VAL A 1 169 ? 19.61673 24.12901 -20.50894 0.646 56.85813 ? 169 VAL A HA 1 ATOM 3186 H HA B VAL A 1 169 ? 19.63379 24.13029 -20.51820 0.354 56.88012 ? 169 VAL A HA 1 ATOM 3187 H HB A VAL A 1 169 ? 21.18630 22.19033 -21.83446 0.646 60.40668 ? 169 VAL A HB 1 ATOM 3188 H HB B VAL A 1 169 ? 19.51400 22.59129 -22.22782 0.354 60.32756 ? 169 VAL A HB 1 ATOM 3189 H HG11 A VAL A 1 169 ? 19.22048 21.75860 -23.17569 0.646 54.18797 ? 169 VAL A HG11 1 ATOM 3190 H HG11 B VAL A 1 169 ? 21.04810 23.40931 -23.67570 0.354 62.31357 ? 169 VAL A HG11 1 ATOM 3191 H HG12 A VAL A 1 169 ? 19.29721 21.04088 -21.76059 0.646 54.18797 ? 169 VAL A HG12 1 ATOM 3192 H HG12 B VAL A 1 169 ? 20.79963 24.59198 -22.64465 0.354 62.31357 ? 169 VAL A HG12 1 ATOM 3193 H HG13 A VAL A 1 169 ? 18.40390 22.34159 -21.94409 0.646 54.18797 ? 169 VAL A HG13 1 ATOM 3194 H HG13 B VAL A 1 169 ? 22.09463 23.68154 -22.51201 0.354 62.31357 ? 169 VAL A HG13 1 ATOM 3195 H HG21 A VAL A 1 169 ? 20.71775 23.45504 -23.74450 0.646 66.70268 ? 169 VAL A HG21 1 ATOM 3196 H HG21 B VAL A 1 169 ? 21.43150 21.16291 -22.64546 0.354 55.65283 ? 169 VAL A HG21 1 ATOM 3197 H HG22 A VAL A 1 169 ? 19.81554 24.43063 -22.87400 0.646 66.70268 ? 169 VAL A HG22 1 ATOM 3198 H HG22 B VAL A 1 169 ? 21.85891 21.48592 -21.14997 0.354 55.65283 ? 169 VAL A HG22 1 ATOM 3199 H HG23 A VAL A 1 169 ? 21.38442 24.37201 -22.63174 0.646 66.70268 ? 169 VAL A HG23 1 ATOM 3200 H HG23 B VAL A 1 169 ? 20.49040 20.73320 -21.43998 0.354 55.65283 ? 169 VAL A HG23 1 ATOM 3201 N N . GLU A 1 170 ? 20.34545 21.45188 -18.91869 1.000 48.62352 ? 170 GLU A N 1 ATOM 3202 C CA . GLU A 1 170 ? 19.75569 20.45442 -18.02943 1.000 47.11583 ? 170 GLU A CA 1 ATOM 3203 C C . GLU A 1 170 ? 19.12073 21.08926 -16.80208 1.000 48.68545 ? 170 GLU A C 1 ATOM 3204 O O . GLU A 1 170 ? 18.10315 20.59730 -16.30160 1.000 49.18577 ? 170 GLU A O 1 ATOM 3205 C CB . GLU A 1 170 ? 20.81227 19.44984 -17.59673 1.000 52.15737 ? 170 GLU A CB 1 ATOM 3206 C CG . GLU A 1 170 ? 21.29707 18.61840 -18.72843 1.000 72.44509 ? 170 GLU A CG 1 ATOM 3207 C CD . GLU A 1 170 ? 21.40581 17.18597 -18.33770 1.000 97.51863 ? 170 GLU A CD 1 ATOM 3208 O OE1 . GLU A 1 170 ? 22.23175 16.87265 -17.45279 1.000 121.28131 ? 170 GLU A OE1 1 ATOM 3209 O OE2 . GLU A 1 170 ? 20.69084 16.34549 -18.92238 1.000 88.74886 ? 170 GLU A OE2 1 ATOM 3210 H H A GLU A 1 170 ? 21.19448 21.38133 -19.03608 0.646 58.34823 ? 170 GLU A H 1 ATOM 3211 H H B GLU A 1 170 ? 21.19498 21.38262 -19.03317 0.354 58.34823 ? 170 GLU A H 1 ATOM 3212 H HA . GLU A 1 170 ? 19.06306 19.98400 -18.51919 1.000 56.53899 ? 170 GLU A HA 1 ATOM 3213 H HB2 . GLU A 1 170 ? 21.57082 19.92708 -17.22560 1.000 62.58884 ? 170 GLU A HB2 1 ATOM 3214 H HB3 . GLU A 1 170 ? 20.43290 18.85845 -16.92797 1.000 62.58884 ? 170 GLU A HB3 1 ATOM 3215 H HG2 . GLU A 1 170 ? 20.67404 18.68754 -19.46866 1.000 86.93411 ? 170 GLU A HG2 1 ATOM 3216 H HG3 . GLU A 1 170 ? 22.17422 18.92844 -19.00300 1.000 86.93411 ? 170 GLU A HG3 1 ATOM 3217 N N . GLU A 1 171 ? 19.70595 22.17188 -16.29965 1.000 47.39374 ? 171 GLU A N 1 ATOM 3218 C CA A GLU A 1 171 ? 19.13993 22.81534 -15.12238 0.437 45.42560 ? 171 GLU A CA 1 ATOM 3219 C CA B GLU A 1 171 ? 19.15822 22.84055 -15.12408 0.563 45.35466 ? 171 GLU A CA 1 ATOM 3220 C C . GLU A 1 171 ? 17.88416 23.60290 -15.46307 1.000 50.08262 ? 171 GLU A C 1 ATOM 3221 O O . GLU A 1 171 ? 16.95085 23.65259 -14.65445 1.000 45.78869 ? 171 GLU A O 1 ATOM 3222 C CB A GLU A 1 171 ? 20.18272 23.72216 -14.47410 0.437 55.27134 ? 171 GLU A CB 1 ATOM 3223 C CB B GLU A 1 171 ? 20.20358 23.78862 -14.53879 0.563 55.24136 ? 171 GLU A CB 1 ATOM 3224 C CG A GLU A 1 171 ? 21.16396 22.97701 -13.58720 0.437 63.92870 ? 171 GLU A CG 1 ATOM 3225 C CG B GLU A 1 171 ? 20.52232 23.56071 -13.07615 0.563 70.83365 ? 171 GLU A CG 1 ATOM 3226 C CD A GLU A 1 171 ? 21.32018 23.63045 -12.22855 0.437 76.13610 ? 171 GLU A CD 1 ATOM 3227 C CD B GLU A 1 171 ? 21.91979 24.03063 -12.72068 0.563 74.84044 ? 171 GLU A CD 1 ATOM 3228 O OE1 A GLU A 1 171 ? 20.45418 23.40310 -11.35511 0.437 75.10840 ? 171 GLU A OE1 1 ATOM 3229 O OE1 B GLU A 1 171 ? 22.12222 25.26031 -12.62284 0.563 66.99817 ? 171 GLU A OE1 1 ATOM 3230 O OE2 A GLU A 1 171 ? 22.30725 24.37284 -12.03713 0.437 78.53619 ? 171 GLU A OE2 1 ATOM 3231 O OE2 B GLU A 1 171 ? 22.81330 23.17254 -12.54807 0.563 74.13000 ? 171 GLU A OE2 1 ATOM 3232 H H A GLU A 1 171 ? 20.41437 22.54418 -16.61451 0.437 56.87249 ? 171 GLU A H 1 ATOM 3233 H H B GLU A 1 171 ? 20.41630 22.53792 -16.61749 0.563 56.87249 ? 171 GLU A H 1 ATOM 3234 H HA A GLU A 1 171 ? 18.89691 22.13758 -14.47239 0.437 54.51073 ? 171 GLU A HA 1 ATOM 3235 H HA B GLU A 1 171 ? 18.93913 22.17229 -14.45601 0.563 54.42559 ? 171 GLU A HA 1 ATOM 3236 H HB2 A GLU A 1 171 ? 20.68994 24.16488 -15.17240 0.437 66.32561 ? 171 GLU A HB2 1 ATOM 3237 H HB2 B GLU A 1 171 ? 21.02896 23.68153 -15.03697 0.563 66.28964 ? 171 GLU A HB2 1 ATOM 3238 H HB3 A GLU A 1 171 ? 19.72759 24.38072 -13.92633 0.437 66.32561 ? 171 GLU A HB3 1 ATOM 3239 H HB3 B GLU A 1 171 ? 19.87798 24.69800 -14.62776 0.563 66.28964 ? 171 GLU A HB3 1 ATOM 3240 H HG2 A GLU A 1 171 ? 20.84545 22.07086 -13.45175 0.437 76.71444 ? 171 GLU A HG2 1 ATOM 3241 H HG2 B GLU A 1 171 ? 19.88886 24.05301 -12.53092 0.563 85.00038 ? 171 GLU A HG2 1 ATOM 3242 H HG3 A GLU A 1 171 ? 22.03338 22.96229 -14.01708 0.437 76.71444 ? 171 GLU A HG3 1 ATOM 3243 H HG3 B GLU A 1 171 ? 20.46208 22.61260 -12.88028 0.563 85.00038 ? 171 GLU A HG3 1 ATOM 3244 N N . VAL A 1 172 ? 17.83275 24.20595 -16.65123 1.000 42.78379 ? 172 VAL A N 1 ATOM 3245 C CA . VAL A 1 172 ? 16.62545 24.89594 -17.09099 1.000 41.53626 ? 172 VAL A CA 1 ATOM 3246 C C . VAL A 1 172 ? 15.45192 23.92665 -17.14883 1.000 40.90032 ? 172 VAL A C 1 ATOM 3247 O O . VAL A 1 172 ? 14.35268 24.22475 -16.66944 1.000 40.12057 ? 172 VAL A O 1 ATOM 3248 C CB . VAL A 1 172 ? 16.85747 25.56306 -18.46054 1.000 43.18773 ? 172 VAL A CB 1 ATOM 3249 C CG1 . VAL A 1 172 ? 15.55849 26.21969 -18.94072 1.000 42.43351 ? 172 VAL A CG1 1 ATOM 3250 C CG2 . VAL A 1 172 ? 18.00775 26.56442 -18.40637 1.000 48.06532 ? 172 VAL A CG2 1 ATOM 3251 H H . VAL A 1 172 ? 18.48003 24.22921 -17.21698 1.000 51.34054 ? 172 VAL A H 1 ATOM 3252 H HA . VAL A 1 172 ? 16.41698 25.58812 -16.44421 1.000 49.84351 ? 172 VAL A HA 1 ATOM 3253 H HB . VAL A 1 172 ? 17.11385 24.88522 -19.10529 1.000 51.82528 ? 172 VAL A HB 1 ATOM 3254 H HG11 . VAL A 1 172 ? 15.76321 26.83306 -19.66375 1.000 50.92022 ? 172 VAL A HG11 1 ATOM 3255 H HG12 . VAL A 1 172 ? 14.95282 25.52971 -19.25378 1.000 50.92022 ? 172 VAL A HG12 1 ATOM 3256 H HG13 . VAL A 1 172 ? 15.15649 26.70217 -18.20146 1.000 50.92022 ? 172 VAL A HG13 1 ATOM 3257 H HG21 . VAL A 1 172 ? 18.12159 26.96238 -19.28361 1.000 57.67838 ? 172 VAL A HG21 1 ATOM 3258 H HG22 . VAL A 1 172 ? 17.79715 27.25242 -17.75583 1.000 57.67838 ? 172 VAL A HG22 1 ATOM 3259 H HG23 . VAL A 1 172 ? 18.81864 26.10011 -18.14603 1.000 57.67838 ? 172 VAL A HG23 1 ATOM 3260 N N . VAL A 1 173 ? 15.65637 22.76769 -17.78278 1.000 39.18330 ? 173 VAL A N 1 ATOM 3261 C CA . VAL A 1 173 ? 14.57940 21.78813 -17.89430 1.000 38.68695 ? 173 VAL A CA 1 ATOM 3262 C C . VAL A 1 173 ? 14.17890 21.28272 -16.51172 1.000 41.03340 ? 173 VAL A C 1 ATOM 3263 O O . VAL A 1 173 ? 12.99689 21.03381 -16.24642 1.000 40.61557 ? 173 VAL A O 1 ATOM 3264 C CB . VAL A 1 173 ? 15.00658 20.64372 -18.84041 1.000 43.28217 ? 173 VAL A CB 1 ATOM 3265 C CG1 . VAL A 1 173 ? 13.96409 19.52768 -18.86396 1.000 46.92004 ? 173 VAL A CG1 1 ATOM 3266 C CG2 . VAL A 1 173 ? 15.22140 21.18402 -20.25371 1.000 44.13946 ? 173 VAL A CG2 1 ATOM 3267 H H . VAL A 1 173 ? 16.39713 22.53062 -18.14975 1.000 47.01996 ? 173 VAL A H 1 ATOM 3268 H HA . VAL A 1 173 ? 13.79866 22.21078 -18.28509 1.000 46.42433 ? 173 VAL A HA 1 ATOM 3269 H HB . VAL A 1 173 ? 15.83909 20.26965 -18.51192 1.000 51.93860 ? 173 VAL A HB 1 ATOM 3270 H HG11 . VAL A 1 173 ? 14.11675 18.96930 -19.64230 1.000 56.30405 ? 173 VAL A HG11 1 ATOM 3271 H HG12 . VAL A 1 173 ? 14.04952 18.99863 -18.05544 1.000 56.30405 ? 173 VAL A HG12 1 ATOM 3272 H HG13 . VAL A 1 173 ? 13.07937 19.92285 -18.90874 1.000 56.30405 ? 173 VAL A HG13 1 ATOM 3273 H HG21 . VAL A 1 173 ? 15.46245 20.44935 -20.83941 1.000 52.96736 ? 173 VAL A HG21 1 ATOM 3274 H HG22 . VAL A 1 173 ? 14.39973 21.59707 -20.56217 1.000 52.96736 ? 173 VAL A HG22 1 ATOM 3275 H HG23 . VAL A 1 173 ? 15.93518 21.84059 -20.23569 1.000 52.96736 ? 173 VAL A HG23 1 ATOM 3276 N N . SER A 1 174 ? 15.13822 21.16415 -15.59441 1.000 43.64153 ? 174 SER A N 1 ATOM 3277 C CA A SER A 1 174 ? 14.81250 20.70996 -14.24852 0.899 46.07046 ? 174 SER A CA 1 ATOM 3278 C CA B SER A 1 174 ? 14.81616 20.71217 -14.24429 0.101 46.14701 ? 174 SER A CA 1 ATOM 3279 C C . SER A 1 174 ? 13.89222 21.69723 -13.53600 1.000 46.19971 ? 174 SER A C 1 ATOM 3280 O O . SER A 1 174 ? 12.95181 21.29137 -12.84361 1.000 42.93433 ? 174 SER A O 1 ATOM 3281 C CB A SER A 1 174 ? 16.10401 20.49567 -13.45452 0.899 52.61826 ? 174 SER A CB 1 ATOM 3282 C CB B SER A 1 174 ? 16.10172 20.50717 -13.44165 0.101 52.51776 ? 174 SER A CB 1 ATOM 3283 O OG A SER A 1 174 ? 15.81962 20.02790 -12.15276 0.899 58.45356 ? 174 SER A OG 1 ATOM 3284 O OG B SER A 1 174 ? 15.82805 19.91841 -12.18234 0.101 57.93682 ? 174 SER A OG 1 ATOM 3285 H H A SER A 1 174 ? 15.97040 21.33758 -15.72473 0.899 52.36984 ? 174 SER A H 1 ATOM 3286 H H B SER A 1 174 ? 15.97041 21.33641 -15.72622 0.101 52.36984 ? 174 SER A H 1 ATOM 3287 H HA A SER A 1 174 ? 14.34493 19.86179 -14.30236 0.899 55.28455 ? 174 SER A HA 1 ATOM 3288 H HA B SER A 1 174 ? 14.35678 19.85971 -14.30070 0.101 55.37641 ? 174 SER A HA 1 ATOM 3289 H HB2 A SER A 1 174 ? 16.65200 19.83985 -13.91335 0.899 63.14191 ? 174 SER A HB2 1 ATOM 3290 H HB2 B SER A 1 174 ? 16.69428 19.92298 -13.94015 0.101 63.02131 ? 174 SER A HB2 1 ATOM 3291 H HB3 A SER A 1 174 ? 16.57933 21.33881 -13.39060 0.899 63.14191 ? 174 SER A HB3 1 ATOM 3292 H HB3 B SER A 1 174 ? 16.52574 21.36819 -13.30110 0.101 63.02131 ? 174 SER A HB3 1 ATOM 3293 H HG A SER A 1 174 ? 16.53445 19.90525 -11.72899 0.899 70.14427 ? 174 SER A HG 1 ATOM 3294 H HG B SER A 1 174 ? 16.54246 19.81238 -11.75342 0.101 69.52419 ? 174 SER A HG 1 ATOM 3295 N N . VAL A 1 175 ? 14.13262 23.00041 -13.71278 1.000 40.99187 ? 175 VAL A N 1 ATOM 3296 C CA . VAL A 1 175 ? 13.28969 24.01749 -13.08325 1.000 41.30649 ? 175 VAL A CA 1 ATOM 3297 C C . VAL A 1 175 ? 11.86724 23.95389 -13.62784 1.000 42.56025 ? 175 VAL A C 1 ATOM 3298 O O . VAL A 1 175 ? 10.88952 23.93547 -12.86935 1.000 38.41780 ? 175 VAL A O 1 ATOM 3299 C CB . VAL A 1 175 ? 13.90488 25.41632 -13.28158 1.000 43.48638 ? 175 VAL A CB 1 ATOM 3300 C CG1 . VAL A 1 175 ? 12.91165 26.50918 -12.86298 1.000 46.52660 ? 175 VAL A CG1 1 ATOM 3301 C CG2 . VAL A 1 175 ? 15.21000 25.51737 -12.49981 1.000 47.65817 ? 175 VAL A CG2 1 ATOM 3302 H H . VAL A 1 175 ? 14.77353 23.31903 -14.18956 1.000 49.19025 ? 175 VAL A H 1 ATOM 3303 H HA . VAL A 1 175 ? 13.24914 23.83307 -12.13181 1.000 49.56779 ? 175 VAL A HA 1 ATOM 3304 H HB . VAL A 1 175 ? 14.10304 25.55564 -14.22085 1.000 52.18365 ? 175 VAL A HB 1 ATOM 3305 H HG11 . VAL A 1 175 ? 13.39305 27.34170 -12.73622 1.000 55.83192 ? 175 VAL A HG11 1 ATOM 3306 H HG12 . VAL A 1 175 ? 12.24597 26.61492 -13.56054 1.000 55.83192 ? 175 VAL A HG12 1 ATOM 3307 H HG13 . VAL A 1 175 ? 12.48288 26.24546 -12.03382 1.000 55.83192 ? 175 VAL A HG13 1 ATOM 3308 H HG21 . VAL A 1 175 ? 15.60608 26.38862 -12.65774 1.000 57.18980 ? 175 VAL A HG21 1 ATOM 3309 H HG22 . VAL A 1 175 ? 15.02150 25.40609 -11.55483 1.000 57.18980 ? 175 VAL A HG22 1 ATOM 3310 H HG23 . VAL A 1 175 ? 15.81338 24.82019 -12.80109 1.000 57.18980 ? 175 VAL A HG23 1 ATOM 3311 N N . VAL A 1 176 ? 11.71886 23.92873 -14.95374 1.000 38.22764 ? 176 VAL A N 1 ATOM 3312 C CA . VAL A 1 176 ? 10.36447 23.96780 -15.49457 1.000 34.88470 ? 176 VAL A CA 1 ATOM 3313 C C . VAL A 1 176 ? 9.61921 22.68165 -15.15286 1.000 36.16625 ? 176 VAL A C 1 ATOM 3314 O O . VAL A 1 176 ? 8.42387 22.70911 -14.83219 1.000 36.78314 ? 176 VAL A O 1 ATOM 3315 C CB . VAL A 1 176 ? 10.38983 24.25879 -17.01055 1.000 39.55592 ? 176 VAL A CB 1 ATOM 3316 C CG1 . VAL A 1 176 ? 10.92408 23.10161 -17.79416 1.000 48.49714 ? 176 VAL A CG1 1 ATOM 3317 C CG2 . VAL A 1 176 ? 8.98653 24.62793 -17.49873 1.000 47.89535 ? 176 VAL A CG2 1 ATOM 3318 H H . VAL A 1 176 ? 12.35494 23.89107 -15.53131 1.000 45.87317 ? 176 VAL A H 1 ATOM 3319 H HA . VAL A 1 176 ? 9.88415 24.69966 -15.07676 1.000 41.86164 ? 176 VAL A HA 1 ATOM 3320 H HB . VAL A 1 176 ? 10.98734 25.00775 -17.16202 1.000 47.46711 ? 176 VAL A HB 1 ATOM 3321 H HG11 . VAL A 1 176 ? 11.07793 23.38403 -18.70929 1.000 58.19657 ? 176 VAL A HG11 1 ATOM 3322 H HG12 . VAL A 1 176 ? 11.75737 22.80724 -17.39430 1.000 58.19657 ? 176 VAL A HG12 1 ATOM 3323 H HG13 . VAL A 1 176 ? 10.27525 22.38081 -17.77507 1.000 58.19657 ? 176 VAL A HG13 1 ATOM 3324 H HG21 . VAL A 1 176 ? 9.01556 24.78214 -18.45596 1.000 57.47443 ? 176 VAL A HG21 1 ATOM 3325 H HG22 . VAL A 1 176 ? 8.38051 23.89718 -17.29964 1.000 57.47443 ? 176 VAL A HG22 1 ATOM 3326 H HG23 . VAL A 1 176 ? 8.69511 25.43292 -17.04270 1.000 57.47443 ? 176 VAL A HG23 1 ATOM 3327 N N . ASN A 1 177 ? 10.30831 21.54221 -15.18185 1.000 37.31818 ? 177 ASN A N 1 ATOM 3328 C CA . ASN A 1 177 ? 9.64456 20.28824 -14.84485 1.000 38.64596 ? 177 ASN A CA 1 ATOM 3329 C C . ASN A 1 177 ? 9.25425 20.25205 -13.36856 1.000 39.96010 ? 177 ASN A C 1 ATOM 3330 O O . ASN A 1 177 ? 8.20471 19.69927 -13.02051 1.000 40.24113 ? 177 ASN A O 1 ATOM 3331 C CB . ASN A 1 177 ? 10.54076 19.10729 -15.21139 1.000 43.28342 ? 177 ASN A CB 1 ATOM 3332 C CG . ASN A 1 177 ? 10.57669 18.84198 -16.71627 1.000 40.49017 ? 177 ASN A CG 1 ATOM 3333 O OD1 . ASN A 1 177 ? 9.86992 19.47973 -17.49763 1.000 42.62406 ? 177 ASN A OD1 1 ATOM 3334 N ND2 . ASN A 1 177 ? 11.40965 17.89673 -17.12012 1.000 48.09376 ? 177 ASN A ND2 1 ATOM 3335 H H . ASN A 1 177 ? 11.14010 21.47033 -15.38817 1.000 44.78182 ? 177 ASN A H 1 ATOM 3336 H HA . ASN A 1 177 ? 8.83019 20.20865 -15.36577 1.000 46.37516 ? 177 ASN A HA 1 ATOM 3337 H HB2 . ASN A 1 177 ? 11.44614 19.29356 -14.91729 1.000 51.94011 ? 177 ASN A HB2 1 ATOM 3338 H HB3 . ASN A 1 177 ? 10.20729 18.30871 -14.77324 1.000 51.94011 ? 177 ASN A HB3 1 ATOM 3339 H HD21 . ASN A 1 177 ? 11.47054 17.70585 -17.95646 1.000 57.71251 ? 177 ASN A HD21 1 ATOM 3340 H HD22 . ASN A 1 177 ? 11.89021 17.47319 -16.54630 1.000 57.71251 ? 177 ASN A HD22 1 ATOM 3341 N N . SER A 1 178 ? 10.07346 20.84343 -12.49050 1.000 41.02966 ? 178 SER A N 1 ATOM 3342 C CA . SER A 1 178 ? 9.70689 20.92960 -11.07671 1.000 39.56954 ? 178 SER A CA 1 ATOM 3343 C C . SER A 1 178 ? 8.45172 21.77507 -10.88917 1.000 40.79250 ? 178 SER A C 1 ATOM 3344 O O . SER A 1 178 ? 7.55532 21.41603 -10.12139 1.000 40.13444 ? 178 SER A O 1 ATOM 3345 C CB . SER A 1 178 ? 10.85561 21.53109 -10.26519 1.000 43.41157 ? 178 SER A CB 1 ATOM 3346 O OG . SER A 1 178 ? 11.96729 20.66636 -10.24418 1.000 50.05697 ? 178 SER A OG 1 ATOM 3347 H H . SER A 1 178 ? 10.83324 21.19588 -12.68571 1.000 49.23559 ? 178 SER A H 1 ATOM 3348 H HA . SER A 1 178 ? 9.53573 20.03287 -10.74889 1.000 47.48345 ? 178 SER A HA 1 ATOM 3349 H HB2 . SER A 1 178 ? 11.11908 22.37299 -10.66852 1.000 52.09389 ? 178 SER A HB2 1 ATOM 3350 H HB3 . SER A 1 178 ? 10.55451 21.67909 -9.35506 1.000 52.09389 ? 178 SER A HB3 1 ATOM 3351 H HG . SER A 1 178 ? 12.22999 20.51707 -11.02795 1.000 60.06836 ? 178 SER A HG 1 ATOM 3352 N N . TYR A 1 179 ? 8.37600 22.90235 -11.59192 1.000 37.70685 ? 179 TYR A N 1 ATOM 3353 C CA . TYR A 1 179 ? 7.18564 23.74844 -11.55861 1.000 36.06181 ? 179 TYR A CA 1 ATOM 3354 C C . TYR A 1 179 ? 5.95075 23.00166 -12.04842 1.000 39.09550 ? 179 TYR A C 1 ATOM 3355 O O . TYR A 1 179 ? 4.88857 23.05103 -11.41428 1.000 37.49242 ? 179 TYR A O 1 ATOM 3356 C CB . TYR A 1 179 ? 7.45890 24.98694 -12.40202 1.000 37.85107 ? 179 TYR A CB 1 ATOM 3357 C CG . TYR A 1 179 ? 6.27548 25.86748 -12.64029 1.000 37.84396 ? 179 TYR A CG 1 ATOM 3358 C CD1 . TYR A 1 179 ? 5.74631 26.65030 -11.62456 1.000 37.74181 ? 179 TYR A CD1 1 ATOM 3359 C CD2 . TYR A 1 179 ? 5.68475 25.92441 -13.88944 1.000 40.01799 ? 179 TYR A CD2 1 ATOM 3360 C CE1 . TYR A 1 179 ? 4.67177 27.46965 -11.86426 1.000 38.97529 ? 179 TYR A CE1 1 ATOM 3361 C CE2 . TYR A 1 179 ? 4.62329 26.73372 -14.12857 1.000 40.05913 ? 179 TYR A CE2 1 ATOM 3362 C CZ . TYR A 1 179 ? 4.10670 27.49170 -13.11734 1.000 39.39955 ? 179 TYR A CZ 1 ATOM 3363 O OH . TYR A 1 179 ? 3.03637 28.31085 -13.40012 1.000 43.38245 ? 179 TYR A OH 1 ATOM 3364 H H . TYR A 1 179 ? 9.00247 23.20249 -12.09893 1.000 45.24821 ? 179 TYR A H 1 ATOM 3365 H HA . TYR A 1 179 ? 6.99934 24.02144 -10.64666 1.000 43.27417 ? 179 TYR A HA 1 ATOM 3366 H HB2 . TYR A 1 179 ? 8.13214 25.52129 -11.95245 1.000 45.42129 ? 179 TYR A HB2 1 ATOM 3367 H HB3 . TYR A 1 179 ? 7.78681 24.70094 -13.26896 1.000 45.42129 ? 179 TYR A HB3 1 ATOM 3368 H HD1 . TYR A 1 179 ? 6.12264 26.61962 -10.77465 1.000 45.29018 ? 179 TYR A HD1 1 ATOM 3369 H HD2 . TYR A 1 179 ? 6.02166 25.39798 -14.57810 1.000 48.02159 ? 179 TYR A HD2 1 ATOM 3370 H HE1 . TYR A 1 179 ? 4.32907 28.00497 -11.18537 1.000 46.77035 ? 179 TYR A HE1 1 ATOM 3371 H HE2 . TYR A 1 179 ? 4.24837 26.77232 -14.97878 1.000 48.07095 ? 179 TYR A HE2 1 ATOM 3372 H HH . TYR A 1 179 ? 2.86013 28.79307 -12.73529 1.000 52.05894 ? 179 TYR A HH 1 ATOM 3373 N N . PHE A 1 180 ? 6.06651 22.28966 -13.17361 1.000 37.43404 ? 180 PHE A N 1 ATOM 3374 C CA . PHE A 1 180 ? 4.91438 21.57762 -13.70914 1.000 36.14439 ? 180 PHE A CA 1 ATOM 3375 C C . PHE A 1 180 ? 4.46385 20.46024 -12.77296 1.000 37.53663 ? 180 PHE A C 1 ATOM 3376 O O . PHE A 1 180 ? 3.26311 20.16864 -12.67774 1.000 39.10354 ? 180 PHE A O 1 ATOM 3377 C CB . PHE A 1 180 ? 5.23928 21.00587 -15.09315 1.000 35.44107 ? 180 PHE A CB 1 ATOM 3378 C CG . PHE A 1 180 ? 5.31455 22.03397 -16.19956 1.000 34.85470 ? 180 PHE A CG 1 ATOM 3379 C CD1 . PHE A 1 180 ? 4.63116 23.24524 -16.12675 1.000 37.09584 ? 180 PHE A CD1 1 ATOM 3380 C CD2 . PHE A 1 180 ? 6.04932 21.76303 -17.34026 1.000 41.75597 ? 180 PHE A CD2 1 ATOM 3381 C CE1 . PHE A 1 180 ? 4.69944 24.17142 -17.16073 1.000 39.22319 ? 180 PHE A CE1 1 ATOM 3382 C CE2 . PHE A 1 180 ? 6.11203 22.68535 -18.37743 1.000 40.84692 ? 180 PHE A CE2 1 ATOM 3383 C CZ . PHE A 1 180 ? 5.43514 23.87465 -18.29815 1.000 39.07314 ? 180 PHE A CZ 1 ATOM 3384 H H . PHE A 1 180 ? 6.78815 22.20677 -13.63401 1.000 44.92084 ? 180 PHE A H 1 ATOM 3385 H HA . PHE A 1 180 ? 4.18328 22.20763 -13.80648 1.000 43.37326 ? 180 PHE A HA 1 ATOM 3386 H HB2 . PHE A 1 180 ? 6.10019 20.56117 -15.04862 1.000 42.52928 ? 180 PHE A HB2 1 ATOM 3387 H HB3 . PHE A 1 180 ? 4.54865 20.36846 -15.33324 1.000 42.52928 ? 180 PHE A HB3 1 ATOM 3388 H HD1 . PHE A 1 180 ? 4.12056 23.43758 -15.37362 1.000 44.51501 ? 180 PHE A HD1 1 ATOM 3389 H HD2 . PHE A 1 180 ? 6.50553 20.95592 -17.41341 1.000 50.10716 ? 180 PHE A HD2 1 ATOM 3390 H HE1 . PHE A 1 180 ? 4.25456 24.98506 -17.09027 1.000 47.06782 ? 180 PHE A HE1 1 ATOM 3391 H HE2 . PHE A 1 180 ? 6.61861 22.49380 -19.13346 1.000 49.01630 ? 180 PHE A HE2 1 ATOM 3392 H HZ . PHE A 1 180 ? 5.46912 24.47958 -19.00371 1.000 46.88777 ? 180 PHE A HZ 1 ATOM 3393 N N A SER A 1 181 ? 5.40704 19.82767 -12.07361 0.643 37.65591 ? 181 SER A N 1 ATOM 3394 N N B SER A 1 181 ? 5.41181 19.80698 -12.10049 0.357 37.86735 ? 181 SER A N 1 ATOM 3395 C CA A SER A 1 181 ? 5.06191 18.75808 -11.14339 0.643 41.84404 ? 181 SER A CA 1 ATOM 3396 C CA B SER A 1 181 ? 5.05950 18.76233 -11.14646 0.357 41.89910 ? 181 SER A CA 1 ATOM 3397 C C A SER A 1 181 ? 4.28910 19.28965 -9.94447 0.643 39.20769 ? 181 SER A C 1 ATOM 3398 C C B SER A 1 181 ? 4.24319 19.33384 -9.99557 0.357 39.30842 ? 181 SER A C 1 ATOM 3399 O O A SER A 1 181 ? 3.31771 18.66768 -9.49843 0.643 41.44736 ? 181 SER A O 1 ATOM 3400 O O B SER A 1 181 ? 3.18270 18.80318 -9.64390 0.357 41.70121 ? 181 SER A O 1 ATOM 3401 C CB A SER A 1 181 ? 6.33592 18.05267 -10.68280 0.643 43.42529 ? 181 SER A CB 1 ATOM 3402 C CB B SER A 1 181 ? 6.33003 18.09032 -10.62546 0.357 43.41954 ? 181 SER A CB 1 ATOM 3403 O OG A SER A 1 181 ? 6.88772 17.28761 -11.73559 0.643 49.90260 ? 181 SER A OG 1 ATOM 3404 O OG B SER A 1 181 ? 6.01553 17.03524 -9.73718 0.357 46.58696 ? 181 SER A OG 1 ATOM 3405 H H A SER A 1 181 ? 6.24866 19.99840 -12.11982 0.643 45.18710 ? 181 SER A H 1 ATOM 3406 H H B SER A 1 181 ? 6.25640 19.94906 -12.17850 0.357 45.44082 ? 181 SER A H 1 ATOM 3407 H HA A SER A 1 181 ? 4.49749 18.11443 -11.59952 0.643 50.21285 ? 181 SER A HA 1 ATOM 3408 H HA B SER A 1 181 ? 4.52222 18.08987 -11.59370 0.357 50.27892 ? 181 SER A HA 1 ATOM 3409 H HB2 A SER A 1 181 ? 6.98300 18.71847 -10.40192 0.643 52.11035 ? 181 SER A HB2 1 ATOM 3410 H HB2 B SER A 1 181 ? 6.82829 17.73224 -11.37673 0.357 52.10345 ? 181 SER A HB2 1 ATOM 3411 H HB3 A SER A 1 181 ? 6.12224 17.46438 -9.94174 0.643 52.11035 ? 181 SER A HB3 1 ATOM 3412 H HB3 B SER A 1 181 ? 6.86544 18.74895 -10.15594 0.357 52.10345 ? 181 SER A HB3 1 ATOM 3413 H HG A SER A 1 181 ? 7.07151 17.78542 -12.38676 0.643 59.88312 ? 181 SER A HG 1 ATOM 3414 H HG B SER A 1 181 ? 6.72099 16.67361 -9.45942 0.357 55.90436 ? 181 SER A HG 1 ATOM 3415 N N . VAL A 1 182 ? 4.72943 20.42339 -9.39835 1.000 38.09727 ? 182 VAL A N 1 ATOM 3416 C CA . VAL A 1 182 ? 4.00612 21.08916 -8.31367 1.000 39.47972 ? 182 VAL A CA 1 ATOM 3417 C C . VAL A 1 182 ? 2.58227 21.43969 -8.73468 1.000 42.35542 ? 182 VAL A C 1 ATOM 3418 O O . VAL A 1 182 ? 1.61752 21.13752 -8.02293 1.000 40.82850 ? 182 VAL A O 1 ATOM 3419 C CB . VAL A 1 182 ? 4.77086 22.34864 -7.86886 1.000 42.83631 ? 182 VAL A CB 1 ATOM 3420 C CG1 . VAL A 1 182 ? 3.89813 23.23161 -6.96851 1.000 47.78467 ? 182 VAL A CG1 1 ATOM 3421 C CG2 . VAL A 1 182 ? 6.05092 21.94385 -7.16998 1.000 47.41502 ? 182 VAL A CG2 1 ATOM 3422 H H A VAL A 1 182 ? 5.44788 20.83083 -9.63797 0.643 45.71672 ? 182 VAL A H 1 ATOM 3423 H H B VAL A 1 182 ? 5.47633 20.79793 -9.60198 0.357 45.71672 ? 182 VAL A H 1 ATOM 3424 H HA . VAL A 1 182 ? 3.94869 20.47253 -7.56709 1.000 47.37566 ? 182 VAL A HA 1 ATOM 3425 H HB . VAL A 1 182 ? 5.00074 22.87870 -8.64802 1.000 51.40357 ? 182 VAL A HB 1 ATOM 3426 H HG11 . VAL A 1 182 ? 4.46509 23.86730 -6.50445 1.000 57.34161 ? 182 VAL A HG11 1 ATOM 3427 H HG12 . VAL A 1 182 ? 3.25326 23.70346 -7.51842 1.000 57.34161 ? 182 VAL A HG12 1 ATOM 3428 H HG13 . VAL A 1 182 ? 3.43690 22.66953 -6.32646 1.000 57.34161 ? 182 VAL A HG13 1 ATOM 3429 H HG21 . VAL A 1 182 ? 6.53405 22.74314 -6.90801 1.000 56.89803 ? 182 VAL A HG21 1 ATOM 3430 H HG22 . VAL A 1 182 ? 5.82968 21.41884 -6.38492 1.000 56.89803 ? 182 VAL A HG22 1 ATOM 3431 H HG23 . VAL A 1 182 ? 6.59028 21.41620 -7.77955 1.000 56.89803 ? 182 VAL A HG23 1 ATOM 3432 N N . CYS A 1 183 ? 2.42807 22.12255 -9.87162 1.000 37.86448 ? 183 CYS A N 1 ATOM 3433 C CA . CYS A 1 183 ? 1.08751 22.54808 -10.26695 1.000 36.79178 ? 183 CYS A CA 1 ATOM 3434 C C . CYS A 1 183 ? 0.19056 21.36041 -10.58009 1.000 38.54554 ? 183 CYS A C 1 ATOM 3435 O O . CYS A 1 183 ? -0.98739 21.35857 -10.20487 1.000 38.19087 ? 183 CYS A O 1 ATOM 3436 C CB . CYS A 1 183 ? 1.12500 23.48780 -11.48161 1.000 39.24493 ? 183 CYS A CB 1 ATOM 3437 S SG . CYS A 1 183 ? 2.04678 25.00351 -11.29602 1.000 40.91824 ? 183 CYS A SG 1 ATOM 3438 H H . CYS A 1 183 ? 3.06024 22.34353 -10.41119 1.000 45.43738 ? 183 CYS A H 1 ATOM 3439 H HA . CYS A 1 183 ? 0.71629 23.04084 -9.51843 1.000 44.15014 ? 183 CYS A HA 1 ATOM 3440 H HB2 . CYS A 1 183 ? 1.52143 23.00406 -12.22305 1.000 47.09392 ? 183 CYS A HB2 1 ATOM 3441 H HB3 . CYS A 1 183 ? 0.21239 23.73579 -11.69734 1.000 47.09392 ? 183 CYS A HB3 1 ATOM 3442 H HG . CYS A 1 183 ? 3.17661 24.73874 -10.99045 1.000 49.10189 ? 183 CYS A HG 1 ATOM 3443 N N . THR A 1 184 ? 0.71352 20.36145 -11.30110 1.000 37.09834 ? 184 THR A N 1 ATOM 3444 C CA . THR A 1 184 ? -0.10711 19.22267 -11.68834 1.000 39.17331 ? 184 THR A CA 1 ATOM 3445 C C . THR A 1 184 ? -0.63685 18.48371 -10.46858 1.000 39.34807 ? 184 THR A C 1 ATOM 3446 O O . THR A 1 184 ? -1.80499 18.08595 -10.43040 1.000 38.72848 ? 184 THR A O 1 ATOM 3447 C CB . THR A 1 184 ? 0.69615 18.25805 -12.56436 1.000 41.57540 ? 184 THR A CB 1 ATOM 3448 O OG1 . THR A 1 184 ? 0.92754 18.86337 -13.84056 1.000 44.03978 ? 184 THR A OG1 1 ATOM 3449 C CG2 . THR A 1 184 ? -0.07901 16.97056 -12.76561 1.000 50.72011 ? 184 THR A CG2 1 ATOM 3450 H H . THR A 1 184 ? 1.52881 20.32402 -11.57224 1.000 44.51801 ? 184 THR A H 1 ATOM 3451 H HA . THR A 1 184 ? -0.85890 19.55326 -12.20451 1.000 47.00798 ? 184 THR A HA 1 ATOM 3452 H HB . THR A 1 184 ? 1.54289 18.05210 -12.13831 1.000 49.89049 ? 184 THR A HB 1 ATOM 3453 H HG1 . THR A 1 184 ? 1.33946 19.58902 -13.74390 1.000 52.84774 ? 184 THR A HG1 1 ATOM 3454 H HG21 . THR A 1 184 ? 0.24492 16.50812 -13.55436 1.000 60.86414 ? 184 THR A HG21 1 ATOM 3455 H HG22 . THR A 1 184 ? 0.03148 16.39277 -11.99434 1.000 60.86414 ? 184 THR A HG22 1 ATOM 3456 H HG23 . THR A 1 184 ? -1.02224 17.16566 -12.88024 1.000 60.86414 ? 184 THR A HG23 1 ATOM 3457 N N . ALA A 1 185 ? 0.21807 18.26858 -9.46536 1.000 38.88879 ? 185 ALA A N 1 ATOM 3458 C CA . ALA A 1 185 ? -0.20613 17.50349 -8.29932 1.000 42.99030 ? 185 ALA A CA 1 ATOM 3459 C C . ALA A 1 185 ? -1.36537 18.19028 -7.58608 1.000 40.87016 ? 185 ALA A C 1 ATOM 3460 O O . ALA A 1 185 ? -2.32922 17.53025 -7.17149 1.000 41.03621 ? 185 ALA A O 1 ATOM 3461 C CB . ALA A 1 185 ? 0.98195 17.29161 -7.35694 1.000 42.06266 ? 185 ALA A CB 1 ATOM 3462 H H . ALA A 1 185 ? 1.03044 18.54952 -9.43838 1.000 46.66654 ? 185 ALA A H 1 ATOM 3463 H HA . ALA A 1 185 ? -0.51473 16.62877 -8.58311 1.000 51.58836 ? 185 ALA A HA 1 ATOM 3464 H HB1 . ALA A 1 185 ? 0.67937 16.81141 -6.57033 1.000 50.47519 ? 185 ALA A HB1 1 ATOM 3465 H HB2 . ALA A 1 185 ? 1.66247 16.77631 -7.81765 1.000 50.47519 ? 185 ALA A HB2 1 ATOM 3466 H HB3 . ALA A 1 185 ? 1.33911 18.15602 -7.09976 1.000 50.47519 ? 185 ALA A HB3 1 ATOM 3467 N N . ILE A 1 186 ? -1.30341 19.51492 -7.45753 1.000 38.58855 ? 186 ILE A N 1 ATOM 3468 C CA . ILE A 1 186 ? -2.31806 20.23678 -6.69927 1.000 37.59902 ? 186 ILE A CA 1 ATOM 3469 C C . ILE A 1 186 ? -3.60307 20.39449 -7.50522 1.000 38.65706 ? 186 ILE A C 1 ATOM 3470 O O . ILE A 1 186 ? -4.70534 20.21588 -6.97575 1.000 38.03447 ? 186 ILE A O 1 ATOM 3471 C CB . ILE A 1 186 ? -1.73879 21.58785 -6.25302 1.000 36.81310 ? 186 ILE A CB 1 ATOM 3472 C CG1 . ILE A 1 186 ? -0.68962 21.32743 -5.15469 1.000 44.41353 ? 186 ILE A CG1 1 ATOM 3473 C CG2 . ILE A 1 186 ? -2.85424 22.49459 -5.74588 1.000 43.61951 ? 186 ILE A CG2 1 ATOM 3474 C CD1 . ILE A 1 186 ? 0.14623 22.51938 -4.77841 1.000 45.72576 ? 186 ILE A CD1 1 ATOM 3475 H H . ILE A 1 186 ? -0.68989 20.01313 -7.79663 1.000 46.30627 ? 186 ILE A H 1 ATOM 3476 H HA . ILE A 1 186 ? -2.55021 19.72512 -5.90856 1.000 45.11883 ? 186 ILE A HA 1 ATOM 3477 H HB . ILE A 1 186 ? -1.31462 22.03458 -7.00230 1.000 44.17573 ? 186 ILE A HB 1 ATOM 3478 H HG12 . ILE A 1 186 ? -1.15029 21.03108 -4.35415 1.000 53.29623 ? 186 ILE A HG12 1 ATOM 3479 H HG13 . ILE A 1 186 ? -0.08539 20.63509 -5.46528 1.000 53.29623 ? 186 ILE A HG13 1 ATOM 3480 H HG21 . ILE A 1 186 ? -2.46427 23.21368 -5.22460 1.000 52.34341 ? 186 ILE A HG21 1 ATOM 3481 H HG22 . ILE A 1 186 ? -3.33452 22.85953 -6.50552 1.000 52.34341 ? 186 ILE A HG22 1 ATOM 3482 H HG23 . ILE A 1 186 ? -3.45721 21.97412 -5.19232 1.000 52.34341 ? 186 ILE A HG23 1 ATOM 3483 H HD11 . ILE A 1 186 ? 0.85509 22.23233 -4.18173 1.000 54.87092 ? 186 ILE A HD11 1 ATOM 3484 H HD12 . ILE A 1 186 ? 0.52695 22.90479 -5.58303 1.000 54.87092 ? 186 ILE A HD12 1 ATOM 3485 H HD13 . ILE A 1 186 ? -0.41670 23.17204 -4.33339 1.000 54.87092 ? 186 ILE A HD13 1 ATOM 3486 N N . ILE A 1 187 ? -3.48976 20.72664 -8.78724 1.000 37.18409 ? 187 ILE A N 1 ATOM 3487 C CA . ILE A 1 187 ? -4.68115 20.83723 -9.63400 1.000 38.62113 ? 187 ILE A CA 1 ATOM 3488 C C . ILE A 1 187 ? -5.44120 19.51793 -9.66405 1.000 38.81019 ? 187 ILE A C 1 ATOM 3489 O O . ILE A 1 187 ? -6.67300 19.48183 -9.53951 1.000 40.21553 ? 187 ILE A O 1 ATOM 3490 C CB . ILE A 1 187 ? -4.29158 21.29720 -11.05050 1.000 36.74299 ? 187 ILE A CB 1 ATOM 3491 C CG1 . ILE A 1 187 ? -3.86827 22.77043 -11.02435 1.000 38.46049 ? 187 ILE A CG1 1 ATOM 3492 C CG2 . ILE A 1 187 ? -5.46307 21.06221 -12.02496 1.000 39.93604 ? 187 ILE A CG2 1 ATOM 3493 C CD1 . ILE A 1 187 ? -3.09362 23.20709 -12.27143 1.000 44.20972 ? 187 ILE A CD1 1 ATOM 3494 H H . ILE A 1 187 ? -2.74760 20.89151 -9.18927 1.000 44.62091 ? 187 ILE A H 1 ATOM 3495 H HA . ILE A 1 187 ? -5.26774 21.50769 -9.25021 1.000 46.34535 ? 187 ILE A HA 1 ATOM 3496 H HB . ILE A 1 187 ? -3.53585 20.77397 -11.36034 1.000 44.09159 ? 187 ILE A HB 1 ATOM 3497 H HG12 . ILE A 1 187 ? -4.66292 23.32295 -10.95987 1.000 46.15259 ? 187 ILE A HG12 1 ATOM 3498 H HG13 . ILE A 1 187 ? -3.29800 22.91823 -10.25374 1.000 46.15259 ? 187 ILE A HG13 1 ATOM 3499 H HG21 . ILE A 1 187 ? -5.31978 21.59213 -12.82469 1.000 47.92325 ? 187 ILE A HG21 1 ATOM 3500 H HG22 . ILE A 1 187 ? -5.49904 20.12039 -12.25427 1.000 47.92325 ? 187 ILE A HG22 1 ATOM 3501 H HG23 . ILE A 1 187 ? -6.29025 21.32972 -11.59471 1.000 47.92325 ? 187 ILE A HG23 1 ATOM 3502 H HD11 . ILE A 1 187 ? -2.81481 24.12982 -12.16302 1.000 53.05166 ? 187 ILE A HD11 1 ATOM 3503 H HD12 . ILE A 1 187 ? -2.31604 22.63671 -12.37601 1.000 53.05166 ? 187 ILE A HD12 1 ATOM 3504 H HD13 . ILE A 1 187 ? -3.67084 23.12486 -13.04665 1.000 53.05166 ? 187 ILE A HD13 1 ATOM 3505 N N . THR A 1 188 ? -4.71686 18.40665 -9.83168 1.000 39.18540 ? 188 THR A N 1 ATOM 3506 C CA . THR A 1 188 ? -5.36643 17.10297 -9.89689 1.000 40.59435 ? 188 THR A CA 1 ATOM 3507 C C . THR A 1 188 ? -6.03212 16.75198 -8.56776 1.000 42.20558 ? 188 THR A C 1 ATOM 3508 O O . THR A 1 188 ? -7.14231 16.20451 -8.54627 1.000 40.33292 ? 188 THR A O 1 ATOM 3509 C CB . THR A 1 188 ? -4.33714 16.04345 -10.30580 1.000 42.99247 ? 188 THR A CB 1 ATOM 3510 O OG1 . THR A 1 188 ? -3.79483 16.38005 -11.60063 1.000 46.90715 ? 188 THR A OG1 1 ATOM 3511 C CG2 . THR A 1 188 ? -4.98091 14.66230 -10.38120 1.000 54.72155 ? 188 THR A CG2 1 ATOM 3512 H H . THR A 1 188 ? -3.86063 18.38400 -9.90887 1.000 47.02248 ? 188 THR A H 1 ATOM 3513 H HA . THR A 1 188 ? -6.06276 17.11826 -10.57202 1.000 48.71323 ? 188 THR A HA 1 ATOM 3514 H HB . THR A 1 188 ? -3.62684 16.01360 -9.64589 1.000 51.59097 ? 188 THR A HB 1 ATOM 3515 H HG1 . THR A 1 188 ? -3.42925 17.13575 -11.57137 1.000 56.28858 ? 188 THR A HG1 1 ATOM 3516 H HG21 . THR A 1 188 ? -4.36621 14.03149 -10.78755 1.000 65.66586 ? 188 THR A HG21 1 ATOM 3517 H HG22 . THR A 1 188 ? -5.20666 14.35241 -9.49018 1.000 65.66586 ? 188 THR A HG22 1 ATOM 3518 H HG23 . THR A 1 188 ? -5.78981 14.70201 -10.91505 1.000 65.66586 ? 188 THR A HG23 1 ATOM 3519 N N . ARG A 1 189 ? -5.37857 17.08347 -7.45543 1.000 41.24588 ? 189 ARG A N 1 ATOM 3520 C CA . ARG A 1 189 ? -5.94032 16.83426 -6.12988 1.000 43.25091 ? 189 ARG A CA 1 ATOM 3521 C C . ARG A 1 189 ? -7.25590 17.57078 -5.91057 1.000 43.12741 ? 189 ARG A C 1 ATOM 3522 O O . ARG A 1 189 ? -8.12901 17.07599 -5.18544 1.000 47.59494 ? 189 ARG A O 1 ATOM 3523 C CB . ARG A 1 189 ? -4.90883 17.25083 -5.08383 1.000 47.61506 ? 189 ARG A CB 1 ATOM 3524 C CG . ARG A 1 189 ? -5.23708 16.90645 -3.66032 1.000 59.61849 ? 189 ARG A CG 1 ATOM 3525 C CD . ARG A 1 189 ? -4.02180 17.23225 -2.79775 1.000 58.82509 ? 189 ARG A CD 1 ATOM 3526 N NE . ARG A 1 189 ? -2.88019 16.40530 -3.17531 1.000 48.16366 ? 189 ARG A NE 1 ATOM 3527 C CZ . ARG A 1 189 ? -1.63786 16.84100 -3.33660 1.000 51.10137 ? 189 ARG A CZ 1 ATOM 3528 N NH1 . ARG A 1 189 ? -1.31212 18.10308 -3.12006 1.000 50.43743 ? 189 ARG A NH1 1 ATOM 3529 N NH2 . ARG A 1 189 ? -0.69418 15.98140 -3.71237 1.000 54.31299 ? 189 ARG A NH2 1 ATOM 3530 H H . ARG A 1 189 ? -4.60366 17.45610 -7.43961 1.000 49.49506 ? 189 ARG A H 1 ATOM 3531 H HA . ARG A 1 189 ? -6.13145 15.88835 -6.03178 1.000 51.90110 ? 189 ARG A HA 1 ATOM 3532 H HB2 . ARG A 1 189 ? -4.06854 16.81573 -5.29713 1.000 57.13808 ? 189 ARG A HB2 1 ATOM 3533 H HB3 . ARG A 1 189 ? -4.80433 18.21415 -5.12847 1.000 57.13808 ? 189 ARG A HB3 1 ATOM 3534 H HG2 . ARG A 1 189 ? -5.99363 17.43169 -3.35595 1.000 71.54219 ? 189 ARG A HG2 1 ATOM 3535 H HG3 . ARG A 1 189 ? -5.43760 15.96050 -3.58365 1.000 71.54219 ? 189 ARG A HG3 1 ATOM 3536 H HD2 . ARG A 1 189 ? -3.78012 18.16395 -2.91791 1.000 70.59011 ? 189 ARG A HD2 1 ATOM 3537 H HD3 . ARG A 1 189 ? -4.23102 17.06128 -1.86614 1.000 70.59011 ? 189 ARG A HD3 1 ATOM 3538 H HE . ARG A 1 189 ? -3.02470 15.56730 -3.30366 1.000 57.79639 ? 189 ARG A HE 1 ATOM 3539 H HH11 . ARG A 1 189 ? -1.91242 18.66494 -2.86796 1.000 60.52492 ? 189 ARG A HH11 1 ATOM 3540 H HH12 . ARG A 1 189 ? -0.49981 18.36268 -3.23123 1.000 60.52492 ? 189 ARG A HH12 1 ATOM 3541 H HH21 . ARG A 1 189 ? -0.89361 15.15578 -3.84722 1.000 65.17558 ? 189 ARG A HH21 1 ATOM 3542 H HH22 . ARG A 1 189 ? 0.11514 16.25146 -3.82038 1.000 65.17558 ? 189 ARG A HH22 1 ATOM 3543 N N . GLN A 1 190 ? -7.42040 18.74280 -6.52441 1.000 41.39662 ? 190 GLN A N 1 ATOM 3544 C CA . GLN A 1 190 ? -8.64008 19.52559 -6.41485 1.000 41.96348 ? 190 GLN A CA 1 ATOM 3545 C C . GLN A 1 190 ? -9.63913 19.23771 -7.53163 1.000 43.37661 ? 190 GLN A C 1 ATOM 3546 O O . GLN A 1 190 ? -10.64356 19.94170 -7.63660 1.000 43.58334 ? 190 GLN A O 1 ATOM 3547 C CB . GLN A 1 190 ? -8.32123 21.01697 -6.39555 1.000 44.22372 ? 190 GLN A CB 1 ATOM 3548 C CG . GLN A 1 190 ? -7.57608 21.48015 -5.16782 1.000 45.11998 ? 190 GLN A CG 1 ATOM 3549 C CD . GLN A 1 190 ? -8.45768 21.51814 -3.93592 1.000 48.42556 ? 190 GLN A CD 1 ATOM 3550 O OE1 . GLN A 1 190 ? -9.67240 21.68347 -4.02981 1.000 50.91956 ? 190 GLN A OE1 1 ATOM 3551 N NE2 . GLN A 1 190 ? -7.85294 21.35140 -2.77597 1.000 49.94789 ? 190 GLN A NE2 1 ATOM 3552 H H . GLN A 1 190 ? -6.82217 19.11028 -7.02108 1.000 49.67595 ? 190 GLN A H 1 ATOM 3553 H HA . GLN A 1 190 ? -9.06025 19.29816 -5.57067 1.000 50.35617 ? 190 GLN A HA 1 ATOM 3554 H HB2 . GLN A 1 190 ? -7.77263 21.22584 -7.16775 1.000 53.06846 ? 190 GLN A HB2 1 ATOM 3555 H HB3 . GLN A 1 190 ? -9.15449 21.51182 -6.43693 1.000 53.06846 ? 190 GLN A HB3 1 ATOM 3556 H HG2 . GLN A 1 190 ? -6.84148 20.87103 -4.99389 1.000 54.14397 ? 190 GLN A HG2 1 ATOM 3557 H HG3 . GLN A 1 190 ? -7.23546 22.37516 -5.32223 1.000 54.14397 ? 190 GLN A HG3 1 ATOM 3558 H HE21 . GLN A 1 190 ? -7.00209 21.22937 -2.74825 1.000 59.93747 ? 190 GLN A HE21 1 ATOM 3559 H HE22 . GLN A 1 190 ? -8.30940 21.36469 -2.04723 1.000 59.93747 ? 190 GLN A HE22 1 ATOM 3560 N N . GLY A 1 191 ? -9.41082 18.20414 -8.33684 1.000 42.19951 ? 191 GLY A N 1 ATOM 3561 C CA . GLY A 1 191 ? -10.39990 17.77537 -9.29427 1.000 44.75839 ? 191 GLY A CA 1 ATOM 3562 C C . GLY A 1 191 ? -10.31049 18.46206 -10.63244 1.000 45.15547 ? 191 GLY A C 1 ATOM 3563 O O . GLY A 1 191 ? -11.21795 18.29291 -11.45987 1.000 45.26050 ? 191 GLY A O 1 ATOM 3564 H H . GLY A 1 191 ? -8.68696 17.73981 -8.34121 1.000 50.63941 ? 191 GLY A H 1 ATOM 3565 H HA2 . GLY A 1 191 ? -10.29916 16.82192 -9.44154 1.000 53.71007 ? 191 GLY A HA2 1 ATOM 3566 H HA3 . GLY A 1 191 ? -11.28227 17.94713 -8.92983 1.000 53.71007 ? 191 GLY A HA3 1 ATOM 3567 N N . GLY A 1 192 ? -9.23931 19.23677 -10.86951 1.000 40.96377 ? 192 GLY A N 1 ATOM 3568 C CA . GLY A 1 192 ? -9.00581 19.84364 -12.16183 1.000 41.54189 ? 192 GLY A CA 1 ATOM 3569 C C . GLY A 1 192 ? -8.26684 18.92445 -13.13059 1.000 39.67558 ? 192 GLY A C 1 ATOM 3570 O O . GLY A 1 192 ? -7.73272 17.88517 -12.76791 1.000 40.36625 ? 192 GLY A O 1 ATOM 3571 H H . GLY A 1 192 ? -8.63545 19.42004 -10.28524 1.000 49.15653 ? 192 GLY A H 1 ATOM 3572 H HA2 . GLY A 1 192 ? -9.85767 20.08130 -12.56025 1.000 49.85027 ? 192 GLY A HA2 1 ATOM 3573 H HA3 . GLY A 1 192 ? -8.47662 20.64807 -12.04457 1.000 49.85027 ? 192 GLY A HA3 1 ATOM 3574 N N . GLU A 1 193 ? -8.24128 19.34552 -14.39075 1.000 37.63061 ? 193 GLU A N 1 ATOM 3575 C CA . GLU A 1 193 ? -7.60690 18.61374 -15.48089 1.000 40.34754 ? 193 GLU A CA 1 ATOM 3576 C C . GLU A 1 193 ? -6.51671 19.49458 -16.06952 1.000 40.25834 ? 193 GLU A C 1 ATOM 3577 O O . GLU A 1 193 ? -6.79589 20.60079 -16.53533 1.000 40.35768 ? 193 GLU A O 1 ATOM 3578 C CB . GLU A 1 193 ? -8.65360 18.24773 -16.53712 1.000 44.49824 ? 193 GLU A CB 1 ATOM 3579 C CG . GLU A 1 193 ? -8.12504 17.57644 -17.79223 1.000 62.17316 ? 193 GLU A CG 1 ATOM 3580 C CD . GLU A 1 193 ? -7.79950 16.10594 -17.59183 1.000 67.22411 ? 193 GLU A CD 1 ATOM 3581 O OE1 . GLU A 1 193 ? -7.42880 15.45112 -18.58640 1.000 73.69560 ? 193 GLU A OE1 1 ATOM 3582 O OE2 . GLU A 1 193 ? -7.93899 15.60253 -16.45824 1.000 60.40174 ? 193 GLU A OE2 1 ATOM 3583 H H . GLU A 1 193 ? -8.59989 20.08322 -14.64921 1.000 45.15673 ? 193 GLU A H 1 ATOM 3584 H HA . GLU A 1 193 ? -7.19315 17.79803 -15.15788 1.000 48.41705 ? 193 GLU A HA 1 ATOM 3585 H HB2 . GLU A 1 193 ? -9.29166 17.63881 -16.13339 1.000 53.39789 ? 193 GLU A HB2 1 ATOM 3586 H HB3 . GLU A 1 193 ? -9.10187 19.06195 -16.81462 1.000 53.39789 ? 193 GLU A HB3 1 ATOM 3587 H HG2 . GLU A 1 193 ? -8.79602 17.64093 -18.48975 1.000 74.60780 ? 193 GLU A HG2 1 ATOM 3588 H HG3 . GLU A 1 193 ? -7.31227 18.02646 -18.07111 1.000 74.60780 ? 193 GLU A HG3 1 ATOM 3589 N N . VAL A 1 194 ? -5.27811 19.02078 -16.04748 1.000 36.56226 ? 194 VAL A N 1 ATOM 3590 C CA . VAL A 1 194 ? -4.21052 19.73543 -16.73807 1.000 35.67734 ? 194 VAL A CA 1 ATOM 3591 C C . VAL A 1 194 ? -4.28271 19.31405 -18.19952 1.000 38.92989 ? 194 VAL A C 1 ATOM 3592 O O . VAL A 1 194 ? -4.12179 18.13376 -18.52117 1.000 41.67098 ? 194 VAL A O 1 ATOM 3593 C CB . VAL A 1 194 ? -2.83912 19.42839 -16.12711 1.000 46.64199 ? 194 VAL A CB 1 ATOM 3594 C CG1 . VAL A 1 194 ? -1.74937 20.11964 -16.91148 1.000 47.87393 ? 194 VAL A CG1 1 ATOM 3595 C CG2 . VAL A 1 194 ? -2.80644 19.88747 -14.68374 1.000 43.42234 ? 194 VAL A CG2 1 ATOM 3596 H H . VAL A 1 194 ? -5.03336 18.30016 -15.64697 1.000 43.87471 ? 194 VAL A H 1 ATOM 3597 H HA . VAL A 1 194 ? -4.34229 20.69391 -16.66841 1.000 42.81281 ? 194 VAL A HA 1 ATOM 3598 H HB . VAL A 1 194 ? -2.68220 18.47169 -16.15886 1.000 55.97038 ? 194 VAL A HB 1 ATOM 3599 H HG11 . VAL A 1 194 ? -0.92076 20.07306 -16.40935 1.000 57.44872 ? 194 VAL A HG11 1 ATOM 3600 H HG12 . VAL A 1 194 ? -1.64375 19.67324 -17.76616 1.000 57.44872 ? 194 VAL A HG12 1 ATOM 3601 H HG13 . VAL A 1 194 ? -1.99995 21.04627 -17.05101 1.000 57.44872 ? 194 VAL A HG13 1 ATOM 3602 H HG21 . VAL A 1 194 ? -1.92888 19.70355 -14.31365 1.000 52.10681 ? 194 VAL A HG21 1 ATOM 3603 H HG22 . VAL A 1 194 ? -2.98613 20.84012 -14.65121 1.000 52.10681 ? 194 VAL A HG22 1 ATOM 3604 H HG23 . VAL A 1 194 ? -3.48386 19.40581 -14.18374 1.000 52.10681 ? 194 VAL A HG23 1 ATOM 3605 N N . THR A 1 195 ? -4.56421 20.25940 -19.08199 1.000 36.39153 ? 195 THR A N 1 ATOM 3606 C CA . THR A 1 195 ? -4.79836 19.88657 -20.47231 1.000 37.01614 ? 195 THR A CA 1 ATOM 3607 C C . THR A 1 195 ? -3.63358 20.20053 -21.40344 1.000 41.02688 ? 195 THR A C 1 ATOM 3608 O O . THR A 1 195 ? -3.46262 19.50649 -22.41251 1.000 41.53043 ? 195 THR A O 1 ATOM 3609 C CB . THR A 1 195 ? -6.08297 20.55185 -20.98658 1.000 42.87649 ? 195 THR A CB 1 ATOM 3610 O OG1 . THR A 1 195 ? -6.45465 19.95083 -22.23204 1.000 40.82789 ? 195 THR A OG1 1 ATOM 3611 C CG2 . THR A 1 195 ? -5.93490 22.05861 -21.16248 1.000 40.29027 ? 195 THR A CG2 1 ATOM 3612 H H . THR A 1 195 ? -4.62408 21.09946 -18.90786 1.000 43.66984 ? 195 THR A H 1 ATOM 3613 H HA . THR A 1 195 ? -4.93139 18.92684 -20.51832 1.000 44.41937 ? 195 THR A HA 1 ATOM 3614 H HB . THR A 1 195 ? -6.78341 20.42141 -20.32834 1.000 51.45179 ? 195 THR A HB 1 ATOM 3615 H HG1 . THR A 1 195 ? -6.59302 19.12930 -22.12462 1.000 48.99347 ? 195 THR A HG1 1 ATOM 3616 H HG21 . THR A 1 195 ? -6.80350 22.46141 -21.31801 1.000 48.34833 ? 195 THR A HG21 1 ATOM 3617 H HG22 . THR A 1 195 ? -5.54515 22.44905 -20.36464 1.000 48.34833 ? 195 THR A HG22 1 ATOM 3618 H HG23 . THR A 1 195 ? -5.35936 22.24925 -21.91965 1.000 48.34833 ? 195 THR A HG23 1 ATOM 3619 N N . LYS A 1 196 ? -2.81249 21.19527 -21.10174 1.000 35.81851 ? 196 LYS A N 1 ATOM 3620 C CA . LYS A 1 196 ? -1.71547 21.50932 -22.00147 1.000 36.81664 ? 196 LYS A CA 1 ATOM 3621 C C . LYS A 1 196 ? -0.61985 22.27111 -21.27111 1.000 37.81609 ? 196 LYS A C 1 ATOM 3622 O O . LYS A 1 196 ? -0.89938 23.09711 -20.40127 1.000 37.59310 ? 196 LYS A O 1 ATOM 3623 C CB . LYS A 1 196 ? -2.23434 22.34866 -23.17356 1.000 42.11746 ? 196 LYS A CB 1 ATOM 3624 C CG . LYS A 1 196 ? -1.34215 22.38084 -24.37610 1.000 51.63496 ? 196 LYS A CG 1 ATOM 3625 C CD . LYS A 1 196 ? -1.99112 23.16339 -25.52426 1.000 53.83385 ? 196 LYS A CD 1 ATOM 3626 C CE . LYS A 1 196 ? -3.38379 22.67866 -25.91745 1.000 63.11656 ? 196 LYS A CE 1 ATOM 3627 N NZ . LYS A 1 196 ? -3.30286 21.60214 -26.93144 1.000 44.84419 ? 196 LYS A NZ 1 ATOM 3628 H H . LYS A 1 196 ? -2.86833 21.68993 -20.40046 1.000 42.98221 ? 196 LYS A H 1 ATOM 3629 H HA . LYS A 1 196 ? -1.31904 20.68350 -22.32045 1.000 44.17997 ? 196 LYS A HA 1 ATOM 3630 H HB2 . LYS A 1 196 ? -3.08878 21.98627 -23.45554 1.000 50.54096 ? 196 LYS A HB2 1 ATOM 3631 H HB3 . LYS A 1 196 ? -2.34574 23.26320 -22.87008 1.000 50.54096 ? 196 LYS A HB3 1 ATOM 3632 H HG2 . LYS A 1 196 ? -0.50490 22.81292 -24.14541 1.000 61.96196 ? 196 LYS A HG2 1 ATOM 3633 H HG3 . LYS A 1 196 ? -1.17539 21.47446 -24.67869 1.000 61.96196 ? 196 LYS A HG3 1 ATOM 3634 H HD2 . LYS A 1 196 ? -2.07022 24.09304 -25.25896 1.000 64.60062 ? 196 LYS A HD2 1 ATOM 3635 H HD3 . LYS A 1 196 ? -1.42459 23.08912 -26.30811 1.000 64.60062 ? 196 LYS A HD3 1 ATOM 3636 H HE2 . LYS A 1 196 ? -3.83771 22.32986 -25.13438 1.000 75.73988 ? 196 LYS A HE2 1 ATOM 3637 H HE3 . LYS A 1 196 ? -3.88907 23.41685 -26.29250 1.000 75.73988 ? 196 LYS A HE3 1 ATOM 3638 H HZ1 . LYS A 1 196 ? -4.12004 21.31609 -27.13758 1.000 53.81303 ? 196 LYS A HZ1 1 ATOM 3639 H HZ2 . LYS A 1 196 ? -2.90917 21.90756 -27.66888 1.000 53.81303 ? 196 LYS A HZ2 1 ATOM 3640 H HZ3 . LYS A 1 196 ? -2.82948 20.91903 -26.61304 1.000 53.81303 ? 196 LYS A HZ3 1 ATOM 3641 N N . PHE A 1 197 ? 0.62377 21.99986 -21.65996 1.000 36.69760 ? 197 PHE A N 1 ATOM 3642 C CA . PHE A 1 197 ? 1.77091 22.82269 -21.29723 1.000 35.16457 ? 197 PHE A CA 1 ATOM 3643 C C . PHE A 1 197 ? 2.13921 23.67816 -22.50416 1.000 39.95500 ? 197 PHE A C 1 ATOM 3644 O O . PHE A 1 197 ? 2.23385 23.16965 -23.63031 1.000 37.63750 ? 197 PHE A O 1 ATOM 3645 C CB . PHE A 1 197 ? 2.97126 21.97394 -20.89303 1.000 38.63903 ? 197 PHE A CB 1 ATOM 3646 C CG . PHE A 1 197 ? 2.70632 21.07558 -19.72653 1.000 38.84470 ? 197 PHE A CG 1 ATOM 3647 C CD1 . PHE A 1 197 ? 2.32055 21.60378 -18.51260 1.000 38.59892 ? 197 PHE A CD1 1 ATOM 3648 C CD2 . PHE A 1 197 ? 2.82089 19.70689 -19.85961 1.000 47.34169 ? 197 PHE A CD2 1 ATOM 3649 C CE1 . PHE A 1 197 ? 2.07128 20.77388 -17.42923 1.000 38.24944 ? 197 PHE A CE1 1 ATOM 3650 C CE2 . PHE A 1 197 ? 2.56624 18.86914 -18.78517 1.000 43.43160 ? 197 PHE A CE2 1 ATOM 3651 C CZ . PHE A 1 197 ? 2.19406 19.39993 -17.57875 1.000 40.95417 ? 197 PHE A CZ 1 ATOM 3652 H H A PHE A 1 197 ? 0.83277 21.32403 -22.14901 0.411 44.03712 ? 197 PHE A H 1 ATOM 3653 H H B PHE A 1 197 ? 0.83277 21.32403 -22.14901 0.589 44.03712 ? 197 PHE A H 1 ATOM 3654 H HA . PHE A 1 197 ? 1.54025 23.38647 -20.54235 1.000 42.19748 ? 197 PHE A HA 1 ATOM 3655 H HB2 . PHE A 1 197 ? 3.22660 21.41635 -21.64456 1.000 46.36683 ? 197 PHE A HB2 1 ATOM 3656 H HB3 . PHE A 1 197 ? 3.70357 22.56307 -20.65311 1.000 46.36683 ? 197 PHE A HB3 1 ATOM 3657 H HD1 . PHE A 1 197 ? 2.22666 22.52432 -18.41934 1.000 46.31871 ? 197 PHE A HD1 1 ATOM 3658 H HD2 . PHE A 1 197 ? 3.07136 19.34309 -20.67804 1.000 56.81002 ? 197 PHE A HD2 1 ATOM 3659 H HE1 . PHE A 1 197 ? 1.82377 21.13568 -16.60902 1.000 45.89933 ? 197 PHE A HE1 1 ATOM 3660 H HE2 . PHE A 1 197 ? 2.64798 17.94795 -18.88332 1.000 52.11792 ? 197 PHE A HE2 1 ATOM 3661 H HZ . PHE A 1 197 ? 2.02316 18.83790 -16.85777 1.000 49.14501 ? 197 PHE A HZ 1 ATOM 3662 N N . ILE A 1 198 ? 2.34581 24.96961 -22.27894 1.000 37.86893 ? 198 ILE A N 1 ATOM 3663 C CA . ILE A 1 198 ? 2.62701 25.91510 -23.35831 1.000 37.87021 ? 198 ILE A CA 1 ATOM 3664 C C . ILE A 1 198 ? 3.90835 26.64536 -22.96034 1.000 38.58220 ? 198 ILE A C 1 ATOM 3665 O O . ILE A 1 198 ? 3.87286 27.69933 -22.32062 1.000 40.71854 ? 198 ILE A O 1 ATOM 3666 C CB . ILE A 1 198 ? 1.46749 26.88466 -23.60467 1.000 39.79983 ? 198 ILE A CB 1 ATOM 3667 C CG1 . ILE A 1 198 ? 0.16986 26.10823 -23.84919 1.000 41.16378 ? 198 ILE A CG1 1 ATOM 3668 C CG2 . ILE A 1 198 ? 1.76083 27.77549 -24.79546 1.000 41.40641 ? 198 ILE A CG2 1 ATOM 3669 C CD1 . ILE A 1 198 ? -1.10306 26.92737 -23.68837 1.000 47.28786 ? 198 ILE A CD1 1 ATOM 3670 H H . ILE A 1 198 ? 2.32842 25.32968 -21.49814 1.000 45.44271 ? 198 ILE A H 1 ATOM 3671 H HA . ILE A 1 198 ? 2.79776 25.43549 -24.18398 1.000 45.44425 ? 198 ILE A HA 1 ATOM 3672 H HB . ILE A 1 198 ? 1.36495 27.43783 -22.81449 1.000 47.75980 ? 198 ILE A HB 1 ATOM 3673 H HG12 . ILE A 1 198 ? 0.18292 25.76435 -24.75610 1.000 49.39654 ? 198 ILE A HG12 1 ATOM 3674 H HG13 . ILE A 1 198 ? 0.12631 25.37414 -23.21663 1.000 49.39654 ? 198 ILE A HG13 1 ATOM 3675 H HG21 . ILE A 1 198 ? 0.99242 28.34366 -24.96169 1.000 49.68769 ? 198 ILE A HG21 1 ATOM 3676 H HG22 . ILE A 1 198 ? 2.53865 28.32044 -24.59816 1.000 49.68769 ? 198 ILE A HG22 1 ATOM 3677 H HG23 . ILE A 1 198 ? 1.93476 27.21916 -25.57079 1.000 49.68769 ? 198 ILE A HG23 1 ATOM 3678 H HD11 . ILE A 1 198 ? -1.87006 26.34699 -23.81395 1.000 56.74543 ? 198 ILE A HD11 1 ATOM 3679 H HD12 . ILE A 1 198 ? -1.12110 27.31135 -22.79779 1.000 56.74543 ? 198 ILE A HD12 1 ATOM 3680 H HD13 . ILE A 1 198 ? -1.11025 27.63359 -24.35328 1.000 56.74543 ? 198 ILE A HD13 1 ATOM 3681 N N . GLY A 1 199 ? 5.05675 26.08126 -23.32646 1.000 39.96934 ? 199 GLY A N 1 ATOM 3682 C CA . GLY A 1 199 ? 6.31497 26.66048 -22.89513 1.000 40.02544 ? 199 GLY A CA 1 ATOM 3683 C C . GLY A 1 199 ? 6.48075 26.53887 -21.39274 1.000 38.92710 ? 199 GLY A C 1 ATOM 3684 O O . GLY A 1 199 ? 6.60594 25.42742 -20.87625 1.000 39.74329 ? 199 GLY A O 1 ATOM 3685 H H . GLY A 1 199 ? 5.12778 25.37683 -23.81465 1.000 47.96320 ? 199 GLY A H 1 ATOM 3686 H HA2 . GLY A 1 199 ? 7.05135 26.20130 -23.32849 1.000 48.03053 ? 199 GLY A HA2 1 ATOM 3687 H HA3 . GLY A 1 199 ? 6.34211 27.59943 -23.13706 1.000 48.03053 ? 199 GLY A HA3 1 ATOM 3688 N N . ASP A 1 200 ? 6.47952 27.67134 -20.68455 1.000 34.06780 ? 200 ASP A N 1 ATOM 3689 C CA . ASP A 1 200 ? 6.58519 27.71385 -19.22785 1.000 34.55412 ? 200 ASP A CA 1 ATOM 3690 C C . ASP A 1 200 ? 5.23098 27.91307 -18.55846 1.000 38.48851 ? 200 ASP A C 1 ATOM 3691 O O . ASP A 1 200 ? 5.15767 28.43933 -17.44205 1.000 37.85978 ? 200 ASP A O 1 ATOM 3692 C CB . ASP A 1 200 ? 7.52804 28.83995 -18.81414 1.000 36.13508 ? 200 ASP A CB 1 ATOM 3693 C CG . ASP A 1 200 ? 6.93676 30.22085 -19.08920 1.000 35.64118 ? 200 ASP A CG 1 ATOM 3694 O OD1 . ASP A 1 200 ? 6.07473 30.32010 -19.98134 1.000 37.83857 ? 200 ASP A OD1 1 ATOM 3695 O OD2 . ASP A 1 200 ? 7.33611 31.21526 -18.45696 1.000 36.48599 ? 200 ASP A OD2 1 ATOM 3696 H H . ASP A 1 200 ? 6.41635 28.45214 -21.03947 1.000 40.88137 ? 200 ASP A H 1 ATOM 3697 H HA . ASP A 1 200 ? 6.94991 26.86908 -18.92086 1.000 41.46494 ? 200 ASP A HA 1 ATOM 3698 H HB2 . ASP A 1 200 ? 7.70650 28.77190 -17.86313 1.000 43.36210 ? 200 ASP A HB2 1 ATOM 3699 H HB3 . ASP A 1 200 ? 8.35587 28.76104 -19.31352 1.000 43.36210 ? 200 ASP A HB3 1 ATOM 3700 N N . CYS A 1 201 ? 4.15650 27.50982 -19.22507 1.000 37.24292 ? 201 CYS A N 1 ATOM 3701 C CA . CYS A 1 201 ? 2.80009 27.83627 -18.80566 1.000 35.27516 ? 201 CYS A CA 1 ATOM 3702 C C . CYS A 1 201 ? 1.96897 26.56881 -18.69375 1.000 41.28837 ? 201 CYS A C 1 ATOM 3703 O O . CYS A 1 201 ? 2.08157 25.66628 -19.52730 1.000 36.31538 ? 201 CYS A O 1 ATOM 3704 C CB . CYS A 1 201 ? 2.16241 28.81267 -19.80551 1.000 41.18844 ? 201 CYS A CB 1 ATOM 3705 S SG . CYS A 1 201 ? 0.39073 28.94067 -19.69428 1.000 44.86625 ? 201 CYS A SG 1 ATOM 3706 H H . CYS A 1 201 ? 4.18854 27.03432 -19.94094 1.000 44.69151 ? 201 CYS A H 1 ATOM 3707 H HA . CYS A 1 201 ? 2.80948 28.24698 -17.92695 1.000 42.33019 ? 201 CYS A HA 1 ATOM 3708 H HB2 . CYS A 1 201 ? 2.52952 29.69683 -19.64933 1.000 49.42613 ? 201 CYS A HB2 1 ATOM 3709 H HB3 . CYS A 1 201 ? 2.37812 28.51786 -20.70409 1.000 49.42613 ? 201 CYS A HB3 1 ATOM 3710 H HG . CYS A 1 201 ? 0.00425 29.73195 -20.50946 1.000 53.83950 ? 201 CYS A HG 1 ATOM 3711 N N . VAL A 1 202 ? 1.15418 26.49845 -17.64092 1.000 34.45525 ? 202 VAL A N 1 ATOM 3712 C CA A VAL A 1 202 ? 0.18878 25.42841 -17.39998 0.744 34.59955 ? 202 VAL A CA 1 ATOM 3713 C CA B VAL A 1 202 ? 0.20447 25.40763 -17.48230 0.256 34.81524 ? 202 VAL A CA 1 ATOM 3714 C C . VAL A 1 202 ? -1.19931 25.92855 -17.77556 1.000 35.78050 ? 202 VAL A C 1 ATOM 3715 O O . VAL A 1 202 ? -1.63276 26.96270 -17.25290 1.000 37.22283 ? 202 VAL A O 1 ATOM 3716 C CB A VAL A 1 202 ? 0.18163 25.00707 -15.91551 0.744 37.13028 ? 202 VAL A CB 1 ATOM 3717 C CB B VAL A 1 202 ? 0.30404 24.75327 -16.09276 0.256 38.26775 ? 202 VAL A CB 1 ATOM 3718 C CG1 A VAL A 1 202 ? -0.99896 24.08690 -15.64727 0.744 35.08775 ? 202 VAL A CG1 1 ATOM 3719 C CG1 B VAL A 1 202 ? -0.11270 25.70911 -15.01704 0.256 42.12694 ? 202 VAL A CG1 1 ATOM 3720 C CG2 A VAL A 1 202 ? 1.47338 24.35709 -15.51860 0.744 39.57135 ? 202 VAL A CG2 1 ATOM 3721 C CG2 B VAL A 1 202 ? -0.52451 23.46312 -16.04471 0.256 33.26505 ? 202 VAL A CG2 1 ATOM 3722 H H A VAL A 1 202 ? 1.14232 27.09219 -17.01888 0.744 41.34630 ? 202 VAL A H 1 ATOM 3723 H H B VAL A 1 202 ? 1.13656 27.07643 -17.00434 0.256 41.34630 ? 202 VAL A H 1 ATOM 3724 H HA A VAL A 1 202 ? 0.42572 24.67011 -17.95652 0.744 41.51946 ? 202 VAL A HA 1 ATOM 3725 H HA B VAL A 1 202 ? 0.39998 24.72097 -18.13894 0.256 41.77829 ? 202 VAL A HA 1 ATOM 3726 H HB A VAL A 1 202 ? 0.08828 25.80147 -15.36678 0.744 44.55633 ? 202 VAL A HB 1 ATOM 3727 H HB B VAL A 1 202 ? 1.22993 24.51739 -15.92547 0.256 45.92131 ? 202 VAL A HB 1 ATOM 3728 H HG11 A VAL A 1 202 ? -0.82346 23.57440 -14.84264 0.744 42.10531 ? 202 VAL A HG11 1 ATOM 3729 H HG11 B VAL A 1 202 ? 0.11271 25.33006 -14.15309 0.256 50.55232 ? 202 VAL A HG11 1 ATOM 3730 H HG12 A VAL A 1 202 ? -1.79784 24.62432 -15.52949 0.744 42.10531 ? 202 VAL A HG12 1 ATOM 3731 H HG12 B VAL A 1 202 ? 0.35590 26.54915 -15.14211 0.256 50.55232 ? 202 VAL A HG12 1 ATOM 3732 H HG13 A VAL A 1 202 ? -1.11111 23.48871 -16.40258 0.744 42.10531 ? 202 VAL A HG13 1 ATOM 3733 H HG13 B VAL A 1 202 ? -1.07024 25.85258 -15.07565 0.256 50.55232 ? 202 VAL A HG13 1 ATOM 3734 H HG21 A VAL A 1 202 ? 1.43808 24.13447 -14.57516 0.744 47.48562 ? 202 VAL A HG21 1 ATOM 3735 H HG21 B VAL A 1 202 ? -0.40526 23.04331 -15.17843 0.256 39.91806 ? 202 VAL A HG21 1 ATOM 3736 H HG22 A VAL A 1 202 ? 1.59597 23.55115 -16.04428 0.744 47.48562 ? 202 VAL A HG22 1 ATOM 3737 H HG22 B VAL A 1 202 ? -1.45953 23.68307 -16.17979 0.256 39.91806 ? 202 VAL A HG22 1 ATOM 3738 H HG23 A VAL A 1 202 ? 2.20221 24.97500 -15.68562 0.744 47.48562 ? 202 VAL A HG23 1 ATOM 3739 H HG23 B VAL A 1 202 ? -0.22043 22.86621 -16.74623 0.256 39.91806 ? 202 VAL A HG23 1 ATOM 3740 N N . MET A 1 203 ? -1.90996 25.18877 -18.63456 1.000 34.61361 ? 203 MET A N 1 ATOM 3741 C CA A MET A 1 203 ? -3.31467 25.43110 -18.92028 0.442 35.90567 ? 203 MET A CA 1 ATOM 3742 C CA B MET A 1 203 ? -3.31596 25.42786 -18.93109 0.558 35.86567 ? 203 MET A CA 1 ATOM 3743 C C . MET A 1 203 ? -4.13407 24.27103 -18.37125 1.000 37.43868 ? 203 MET A C 1 ATOM 3744 O O . MET A 1 203 ? -3.87451 23.10363 -18.69304 1.000 36.81855 ? 203 MET A O 1 ATOM 3745 C CB A MET A 1 203 ? -3.55890 25.58785 -20.42374 0.442 37.96273 ? 203 MET A CB 1 ATOM 3746 C CB B MET A 1 203 ? -3.53124 25.56719 -20.43900 0.558 37.95662 ? 203 MET A CB 1 ATOM 3747 C CG A MET A 1 203 ? -5.00347 25.89267 -20.77223 0.442 37.42395 ? 203 MET A CG 1 ATOM 3748 C CG B MET A 1 203 ? -4.98105 25.53914 -20.88226 0.558 38.40411 ? 203 MET A CG 1 ATOM 3749 S SD A MET A 1 203 ? -5.22050 26.21278 -22.53114 0.442 43.17700 ? 203 MET A SD 1 ATOM 3750 S SD B MET A 1 203 ? -5.09069 25.48574 -22.67756 0.558 39.16238 ? 203 MET A SD 1 ATOM 3751 C CE A MET A 1 203 ? -6.97935 25.94687 -22.66221 0.442 40.19715 ? 203 MET A CE 1 ATOM 3752 C CE B MET A 1 203 ? -6.83614 25.16265 -22.86415 0.558 41.79281 ? 203 MET A CE 1 ATOM 3753 H H A MET A 1 203 ? -1.58430 24.52409 -19.07245 0.442 41.53633 ? 203 MET A H 1 ATOM 3754 H H B MET A 1 203 ? -1.58318 24.52235 -19.06895 0.558 41.53633 ? 203 MET A H 1 ATOM 3755 H HA A MET A 1 203 ? -3.59169 26.25620 -18.49207 0.442 43.08680 ? 203 MET A HA 1 ATOM 3756 H HA B MET A 1 203 ? -3.60329 26.25219 -18.50821 0.558 43.03880 ? 203 MET A HA 1 ATOM 3757 H HB2 A MET A 1 203 ? -3.01263 26.31769 -20.75512 0.442 45.55528 ? 203 MET A HB2 1 ATOM 3758 H HB2 B MET A 1 203 ? -3.15521 26.41396 -20.72619 0.558 45.54795 ? 203 MET A HB2 1 ATOM 3759 H HB3 A MET A 1 203 ? -3.31366 24.76143 -20.86847 0.442 45.55528 ? 203 MET A HB3 1 ATOM 3760 H HB3 B MET A 1 203 ? -3.07661 24.83455 -20.88335 0.558 45.54795 ? 203 MET A HB3 1 ATOM 3761 H HG2 A MET A 1 203 ? -5.55665 25.13297 -20.53189 0.442 44.90874 ? 203 MET A HG2 1 ATOM 3762 H HG2 B MET A 1 203 ? -5.41542 24.75013 -20.52214 0.558 46.08493 ? 203 MET A HG2 1 ATOM 3763 H HG3 A MET A 1 203 ? -5.29025 26.67978 -20.28325 0.442 44.90874 ? 203 MET A HG3 1 ATOM 3764 H HG3 B MET A 1 203 ? -5.43201 26.33852 -20.56838 0.558 46.08493 ? 203 MET A HG3 1 ATOM 3765 H HE1 A MET A 1 203 ? -7.25550 26.10666 -23.57824 0.442 48.23658 ? 203 MET A HE1 1 ATOM 3766 H HE1 B MET A 1 203 ? -7.04362 25.08421 -23.80845 0.558 50.15138 ? 203 MET A HE1 1 ATOM 3767 H HE2 A MET A 1 203 ? -7.17995 25.03166 -22.41111 0.442 48.23658 ? 203 MET A HE2 1 ATOM 3768 H HE2 B MET A 1 203 ? -7.05472 24.33519 -22.40761 0.558 50.15138 ? 203 MET A HE2 1 ATOM 3769 H HE3 A MET A 1 203 ? -7.43682 26.56106 -22.06690 0.442 48.23658 ? 203 MET A HE3 1 ATOM 3770 H HE3 B MET A 1 203 ? -7.33657 25.89707 -22.47542 0.558 50.15138 ? 203 MET A HE3 1 ATOM 3771 N N . ALA A 1 204 ? -5.11912 24.58984 -17.53721 1.000 36.65355 ? 204 ALA A N 1 ATOM 3772 C CA . ALA A 1 204 ? -5.93027 23.56905 -16.89669 1.000 33.77798 ? 204 ALA A CA 1 ATOM 3773 C C . ALA A 1 204 ? -7.37089 24.04447 -16.85268 1.000 33.98279 ? 204 ALA A C 1 ATOM 3774 O O . ALA A 1 204 ? -7.66181 25.21753 -17.09691 1.000 36.31539 ? 204 ALA A O 1 ATOM 3775 C CB . ALA A 1 204 ? -5.42672 23.27082 -15.47459 1.000 37.20797 ? 204 ALA A CB 1 ATOM 3776 H H . ALA A 1 204 ? -5.33545 25.39535 -17.32753 1.000 43.98426 ? 204 ALA A H 1 ATOM 3777 H HA . ALA A 1 204 ? -5.89075 22.75185 -17.41777 1.000 40.53358 ? 204 ALA A HA 1 ATOM 3778 H HB1 . ALA A 1 204 ? -6.00471 22.60651 -15.06775 1.000 44.64956 ? 204 ALA A HB1 1 ATOM 3779 H HB2 . ALA A 1 204 ? -4.51892 22.93286 -15.52540 1.000 44.64956 ? 204 ALA A HB2 1 ATOM 3780 H HB3 . ALA A 1 204 ? -5.44632 24.08937 -14.95450 1.000 44.64956 ? 204 ALA A HB3 1 ATOM 3781 N N . TYR A 1 205 ? -8.28322 23.13123 -16.52623 1.000 37.04896 ? 205 TYR A N 1 ATOM 3782 C CA . TYR A 1 205 ? -9.65894 23.55861 -16.34721 1.000 38.83465 ? 205 TYR A CA 1 ATOM 3783 C C . TYR A 1 205 ? -10.36972 22.73240 -15.28666 1.000 39.02163 ? 205 TYR A C 1 ATOM 3784 O O . TYR A 1 205 ? -9.97637 21.60801 -14.95206 1.000 39.69055 ? 205 TYR A O 1 ATOM 3785 C CB . TYR A 1 205 ? -10.44503 23.53186 -17.67379 1.000 39.39300 ? 205 TYR A CB 1 ATOM 3786 C CG . TYR A 1 205 ? -10.50788 22.21848 -18.42951 1.000 39.84438 ? 205 TYR A CG 1 ATOM 3787 C CD1 . TYR A 1 205 ? -11.48437 21.26740 -18.14765 1.000 45.02875 ? 205 TYR A CD1 1 ATOM 3788 C CD2 . TYR A 1 205 ? -9.64332 21.97241 -19.48414 1.000 45.32312 ? 205 TYR A CD2 1 ATOM 3789 C CE1 . TYR A 1 205 ? -11.55680 20.08393 -18.86964 1.000 47.67958 ? 205 TYR A CE1 1 ATOM 3790 C CE2 . TYR A 1 205 ? -9.70314 20.79946 -20.20464 1.000 44.48411 ? 205 TYR A CE2 1 ATOM 3791 C CZ . TYR A 1 205 ? -10.66389 19.86235 -19.90424 1.000 51.59472 ? 205 TYR A CZ 1 ATOM 3792 O OH . TYR A 1 205 ? -10.72075 18.69647 -20.63445 1.000 52.83738 ? 205 TYR A OH 1 ATOM 3793 H H . TYR A 1 205 ? -8.13188 22.29287 -16.40855 1.000 44.45875 ? 205 TYR A H 1 ATOM 3794 H HA . TYR A 1 205 ? -9.63747 24.46892 -16.01288 1.000 46.60158 ? 205 TYR A HA 1 ATOM 3795 H HB2 . TYR A 1 205 ? -11.36080 23.78696 -17.48094 1.000 47.27160 ? 205 TYR A HB2 1 ATOM 3796 H HB3 . TYR A 1 205 ? -10.03935 24.17885 -18.27190 1.000 47.27160 ? 205 TYR A HB3 1 ATOM 3797 H HD1 . TYR A 1 205 ? -12.09677 21.42702 -17.46619 1.000 54.03450 ? 205 TYR A HD1 1 ATOM 3798 H HD2 . TYR A 1 205 ? -9.00856 22.61324 -19.71066 1.000 54.38775 ? 205 TYR A HD2 1 ATOM 3799 H HE1 . TYR A 1 205 ? -12.19965 19.44538 -18.66013 1.000 57.21550 ? 205 TYR A HE1 1 ATOM 3800 H HE2 . TYR A 1 205 ? -9.09616 20.64206 -20.89145 1.000 53.38093 ? 205 TYR A HE2 1 ATOM 3801 H HH . TYR A 1 205 ? -11.34787 18.21262 -20.35479 1.000 63.40486 ? 205 TYR A HH 1 ATOM 3802 N N . PHE A 1 206 ? -11.42752 23.34786 -14.75079 1.000 38.41302 ? 206 PHE A N 1 ATOM 3803 C CA . PHE A 1 206 ? -12.30499 22.78118 -13.73768 1.000 40.03826 ? 206 PHE A CA 1 ATOM 3804 C C . PHE A 1 206 ? -13.73903 22.84945 -14.25305 1.000 42.48223 ? 206 PHE A C 1 ATOM 3805 O O . PHE A 1 206 ? -14.05760 23.65123 -15.13545 1.000 42.62668 ? 206 PHE A O 1 ATOM 3806 C CB . PHE A 1 206 ? -12.21591 23.55771 -12.40686 1.000 39.18808 ? 206 PHE A CB 1 ATOM 3807 C CG . PHE A 1 206 ? -10.85701 23.51118 -11.73873 1.000 39.25718 ? 206 PHE A CG 1 ATOM 3808 C CD1 . PHE A 1 206 ? -9.78920 24.24384 -12.24040 1.000 39.24843 ? 206 PHE A CD1 1 ATOM 3809 C CD2 . PHE A 1 206 ? -10.66320 22.76475 -10.58104 1.000 44.06162 ? 206 PHE A CD2 1 ATOM 3810 C CE1 . PHE A 1 206 ? -8.54155 24.20810 -11.62109 1.000 40.55079 ? 206 PHE A CE1 1 ATOM 3811 C CE2 . PHE A 1 206 ? -9.42027 22.72799 -9.95721 1.000 40.18139 ? 206 PHE A CE2 1 ATOM 3812 C CZ . PHE A 1 206 ? -8.36370 23.45073 -10.47337 1.000 39.89927 ? 206 PHE A CZ 1 ATOM 3813 H H . PHE A 1 206 ? -11.66738 24.14267 -14.97515 1.000 46.09563 ? 206 PHE A H 1 ATOM 3814 H HA . PHE A 1 206 ? -12.05812 21.85792 -13.57168 1.000 48.04592 ? 206 PHE A HA 1 ATOM 3815 H HB2 . PHE A 1 206 ? -12.42558 24.48910 -12.57847 1.000 47.02570 ? 206 PHE A HB2 1 ATOM 3816 H HB3 . PHE A 1 206 ? -12.85975 23.18157 -11.78647 1.000 47.02570 ? 206 PHE A HB3 1 ATOM 3817 H HD1 . PHE A 1 206 ? -9.90862 24.76590 -13.00072 1.000 47.09812 ? 206 PHE A HD1 1 ATOM 3818 H HD2 . PHE A 1 206 ? -11.37299 22.28455 -10.21976 1.000 52.87395 ? 206 PHE A HD2 1 ATOM 3819 H HE1 . PHE A 1 206 ? -7.83038 24.69070 -11.97640 1.000 48.66095 ? 206 PHE A HE1 1 ATOM 3820 H HE2 . PHE A 1 206 ? -9.30100 22.21522 -9.19057 1.000 48.21767 ? 206 PHE A HE2 1 ATOM 3821 H HZ . PHE A 1 206 ? -7.53467 23.42975 -10.05244 1.000 47.87913 ? 206 PHE A HZ 1 ATOM 3822 N N . ASP A 1 207 ? -14.61266 22.02031 -13.67981 1.000 43.40517 ? 207 ASP A N 1 ATOM 3823 C CA . ASP A 1 207 ? -16.03791 22.14741 -13.95647 1.000 44.65855 ? 207 ASP A CA 1 ATOM 3824 C C . ASP A 1 207 ? -16.51535 23.55539 -13.61812 1.000 42.09392 ? 207 ASP A C 1 ATOM 3825 O O . ASP A 1 207 ? -15.95490 24.23736 -12.75584 1.000 44.02526 ? 207 ASP A O 1 ATOM 3826 C CB . ASP A 1 207 ? -16.85344 21.13630 -13.14742 1.000 45.56734 ? 207 ASP A CB 1 ATOM 3827 C CG . ASP A 1 207 ? -16.74123 19.72755 -13.67651 1.000 63.13169 ? 207 ASP A CG 1 ATOM 3828 O OD1 . ASP A 1 207 ? -16.30030 19.54800 -14.82828 1.000 55.61053 ? 207 ASP A OD1 1 ATOM 3829 O OD2 . ASP A 1 207 ? -17.11412 18.79521 -12.93347 1.000 58.88781 ? 207 ASP A OD2 1 ATOM 3830 H H . ASP A 1 207 ? -14.40670 21.38671 -13.13599 1.000 52.08620 ? 207 ASP A H 1 ATOM 3831 H HA . ASP A 1 207 ? -16.18833 21.97076 -14.89832 1.000 53.59026 ? 207 ASP A HA 1 ATOM 3832 H HB2 . ASP A 1 207 ? -16.53612 21.13719 -12.23079 1.000 54.68081 ? 207 ASP A HB2 1 ATOM 3833 H HB3 . ASP A 1 207 ? -17.78873 21.39202 -13.17497 1.000 54.68081 ? 207 ASP A HB3 1 ATOM 3834 N N . GLY A 1 208 ? -17.58877 23.97846 -14.29013 1.000 44.52682 ? 208 GLY A N 1 ATOM 3835 C CA . GLY A 1 208 ? -18.05261 25.34917 -14.17138 1.000 42.61109 ? 208 GLY A CA 1 ATOM 3836 C C . GLY A 1 208 ? -18.56672 25.71841 -12.79795 1.000 47.11062 ? 208 GLY A C 1 ATOM 3837 O O . GLY A 1 208 ? -18.57680 26.90204 -12.44459 1.000 51.24367 ? 208 GLY A O 1 ATOM 3838 H H . GLY A 1 208 ? -18.06001 23.48927 -14.81760 1.000 53.43218 ? 208 GLY A H 1 ATOM 3839 H HA2 . GLY A 1 208 ? -17.31923 25.94698 -14.38508 1.000 51.13330 ? 208 GLY A HA2 1 ATOM 3840 H HA3 . GLY A 1 208 ? -18.77176 25.49196 -14.80647 1.000 51.13330 ? 208 GLY A HA3 1 ATOM 3841 N N . ASP A 1 209 ? -18.99425 24.73957 -12.01499 1.000 46.11231 ? 209 ASP A N 1 ATOM 3842 C CA . ASP A 1 209 ? -19.47371 25.00178 -10.66548 1.000 50.42902 ? 209 ASP A CA 1 ATOM 3843 C C . ASP A 1 209 ? -18.41453 24.69948 -9.61028 1.000 47.20078 ? 209 ASP A C 1 ATOM 3844 O O . ASP A 1 209 ? -18.74748 24.54753 -8.43033 1.000 48.69408 ? 209 ASP A O 1 ATOM 3845 C CB . ASP A 1 209 ? -20.75291 24.20362 -10.40046 1.000 52.32577 ? 209 ASP A CB 1 ATOM 3846 C CG . ASP A 1 209 ? -20.54536 22.70980 -10.49673 1.000 59.18518 ? 209 ASP A CG 1 ATOM 3847 O OD1 . ASP A 1 209 ? -19.46792 22.28125 -10.95767 1.000 61.83654 ? 209 ASP A OD1 1 ATOM 3848 O OD2 . ASP A 1 209 ? -21.46663 21.95826 -10.11910 1.000 72.80198 ? 209 ASP A OD2 1 ATOM 3849 H H . ASP A 1 209 ? -19.01667 23.91078 -12.24347 1.000 55.33477 ? 209 ASP A H 1 ATOM 3850 H HA . ASP A 1 209 ? -19.69685 25.94263 -10.58865 1.000 60.51483 ? 209 ASP A HA 1 ATOM 3851 H HB2 . ASP A 1 209 ? -21.07054 24.40456 -9.50624 1.000 62.79093 ? 209 ASP A HB2 1 ATOM 3852 H HB3 . ASP A 1 209 ? -21.42310 24.45538 -11.05496 1.000 62.79093 ? 209 ASP A HB3 1 ATOM 3853 N N . CYS A 1 210 ? -17.14393 24.63636 -10.00273 1.000 41.64650 ? 210 CYS A N 1 ATOM 3854 C CA . CYS A 1 210 ? -16.04858 24.32652 -9.08510 1.000 45.07785 ? 210 CYS A CA 1 ATOM 3855 C C . CYS A 1 210 ? -15.10258 25.51385 -8.89364 1.000 44.56246 ? 210 CYS A C 1 ATOM 3856 O O . CYS A 1 210 ? -13.88223 25.35964 -8.81555 1.000 42.59806 ? 210 CYS A O 1 ATOM 3857 C CB . CYS A 1 210 ? -15.29891 23.09245 -9.58217 1.000 42.49146 ? 210 CYS A CB 1 ATOM 3858 S SG . CYS A 1 210 ? -16.32136 21.61436 -9.40197 1.000 50.26931 ? 210 CYS A SG 1 ATOM 3859 H H . CYS A 1 210 ? -16.88644 24.77197 -10.81199 1.000 49.97580 ? 210 CYS A H 1 ATOM 3860 H HA . CYS A 1 210 ? -16.41613 24.12936 -8.20935 1.000 54.09343 ? 210 CYS A HA 1 ATOM 3861 H HB2 . CYS A 1 210 ? -15.07766 23.20361 -10.52004 1.000 50.98976 ? 210 CYS A HB2 1 ATOM 3862 H HB3 . CYS A 1 210 ? -14.48880 22.97404 -9.06197 1.000 50.98976 ? 210 CYS A HB3 1 ATOM 3863 H HG . CYS A 1 210 ? -17.32955 21.75693 -10.03698 1.000 60.32318 ? 210 CYS A HG 1 ATOM 3864 N N . ALA A 1 211 ? -15.66081 26.71658 -8.76563 1.000 44.51876 ? 211 ALA A N 1 ATOM 3865 C CA . ALA A 1 211 ? -14.82052 27.88639 -8.54055 1.000 40.79089 ? 211 ALA A CA 1 ATOM 3866 C C . ALA A 1 211 ? -14.07312 27.78184 -7.21832 1.000 39.79402 ? 211 ALA A C 1 ATOM 3867 O O . ALA A 1 211 ? -12.91094 28.19548 -7.12242 1.000 40.93115 ? 211 ALA A O 1 ATOM 3868 C CB . ALA A 1 211 ? -15.66448 29.16101 -8.55625 1.000 47.13684 ? 211 ALA A CB 1 ATOM 3869 H H . ALA A 1 211 ? -16.50467 26.87782 -8.80438 1.000 53.42251 ? 211 ALA A H 1 ATOM 3870 H HA . ALA A 1 211 ? -14.17362 27.93886 -9.26143 1.000 48.94906 ? 211 ALA A HA 1 ATOM 3871 H HB1 . ALA A 1 211 ? -15.08504 29.92524 -8.41101 1.000 56.56421 ? 211 ALA A HB1 1 ATOM 3872 H HB2 . ALA A 1 211 ? -16.10404 29.23812 -9.41750 1.000 56.56421 ? 211 ALA A HB2 1 ATOM 3873 H HB3 . ALA A 1 211 ? -16.32738 29.10956 -7.84999 1.000 56.56421 ? 211 ALA A HB3 1 ATOM 3874 N N . ASP A 1 212 ? -14.73463 27.26625 -6.17680 1.000 44.31590 ? 212 ASP A N 1 ATOM 3875 C CA . ASP A 1 212 ? -14.07201 27.15345 -4.88092 1.000 43.14392 ? 212 ASP A CA 1 ATOM 3876 C C . ASP A 1 212 ? -12.82151 26.29048 -4.98770 1.000 47.30715 ? 212 ASP A C 1 ATOM 3877 O O . ASP A 1 212 ? -11.76789 26.63280 -4.42719 1.000 43.06056 ? 212 ASP A O 1 ATOM 3878 C CB . ASP A 1 212 ? -15.02480 26.57322 -3.83252 1.000 45.46467 ? 212 ASP A CB 1 ATOM 3879 C CG . ASP A 1 212 ? -16.15917 27.51604 -3.48335 1.000 49.00292 ? 212 ASP A CG 1 ATOM 3880 O OD1 . ASP A 1 212 ? -15.88776 28.68878 -3.17533 1.000 47.18883 ? 212 ASP A OD1 1 ATOM 3881 O OD2 . ASP A 1 212 ? -17.32900 27.08150 -3.50173 1.000 55.88715 ? 212 ASP A OD2 1 ATOM 3882 H H . ASP A 1 212 ? -15.54628 26.98260 -6.19609 1.000 53.17908 ? 212 ASP A H 1 ATOM 3883 H HA . ASP A 1 212 ? -13.81683 28.04208 -4.58744 1.000 51.77271 ? 212 ASP A HA 1 ATOM 3884 H HB2 . ASP A 1 212 ? -15.41191 25.75320 -4.17692 1.000 54.55760 ? 212 ASP A HB2 1 ATOM 3885 H HB3 . ASP A 1 212 ? -14.52700 26.38961 -3.02049 1.000 54.55760 ? 212 ASP A HB3 1 ATOM 3886 N N . GLN A 1 213 ? -12.91740 25.16596 -5.70503 1.000 41.47827 ? 213 GLN A N 1 ATOM 3887 C CA . GLN A 1 213 ? -11.75069 24.29596 -5.86010 1.000 40.77835 ? 213 GLN A CA 1 ATOM 3888 C C . GLN A 1 213 ? -10.66634 24.95459 -6.70165 1.000 38.69093 ? 213 GLN A C 1 ATOM 3889 O O . GLN A 1 213 ? -9.47394 24.78129 -6.42858 1.000 40.06102 ? 213 GLN A O 1 ATOM 3890 C CB . GLN A 1 213 ? -12.15158 22.94626 -6.46539 1.000 41.17121 ? 213 GLN A CB 1 ATOM 3891 C CG . GLN A 1 213 ? -13.09455 22.04279 -5.64340 1.000 46.98148 ? 213 GLN A CG 1 ATOM 3892 C CD . GLN A 1 213 ? -14.48900 22.60261 -5.36822 1.000 62.58326 ? 213 GLN A CD 1 ATOM 3893 O OE1 . GLN A 1 213 ? -15.01785 23.41570 -6.11838 1.000 53.87988 ? 213 GLN A OE1 1 ATOM 3894 N NE2 . GLN A 1 213 ? -15.10551 22.12045 -4.29622 1.000 95.57123 ? 213 GLN A NE2 1 ATOM 3895 H H . GLN A 1 213 ? -13.62915 24.89135 -6.10202 1.000 49.77393 ? 213 GLN A H 1 ATOM 3896 H HA . GLN A 1 213 ? -11.38666 24.12637 -4.97713 1.000 48.93402 ? 213 GLN A HA 1 ATOM 3897 H HB2 . GLN A 1 213 ? -12.59737 23.12057 -7.30907 1.000 49.40546 ? 213 GLN A HB2 1 ATOM 3898 H HB3 . GLN A 1 213 ? -11.34012 22.43718 -6.61791 1.000 49.40546 ? 213 GLN A HB3 1 ATOM 3899 H HG2 . GLN A 1 213 ? -13.21129 21.20872 -6.12464 1.000 56.37778 ? 213 GLN A HG2 1 ATOM 3900 H HG3 . GLN A 1 213 ? -12.67940 21.87413 -4.78310 1.000 56.37778 ? 213 GLN A HG3 1 ATOM 3901 H HE21 . GLN A 1 213 ? -14.71742 21.52970 -3.80632 1.000 114.68548 ? 213 GLN A HE21 1 ATOM 3902 H HE22 . GLN A 1 213 ? -15.89306 22.39880 -4.09154 1.000 114.68548 ? 213 GLN A HE22 1 ATOM 3903 N N . ALA A 1 214 ? -11.04827 25.70062 -7.74160 1.000 40.16710 ? 214 ALA A N 1 ATOM 3904 C CA . ALA A 1 214 ? -10.05581 26.40273 -8.55069 1.000 41.04090 ? 214 ALA A CA 1 ATOM 3905 C C . ALA A 1 214 ? -9.31590 27.45471 -7.72827 1.000 38.29344 ? 214 ALA A C 1 ATOM 3906 O O . ALA A 1 214 ? -8.09405 27.62412 -7.86444 1.000 37.18337 ? 214 ALA A O 1 ATOM 3907 C CB . ALA A 1 214 ? -10.73609 27.05375 -9.75624 1.000 38.92323 ? 214 ALA A CB 1 ATOM 3908 H H . ALA A 1 214 ? -11.86242 25.81393 -7.99443 1.000 48.20052 ? 214 ALA A H 1 ATOM 3909 H HA . ALA A 1 214 ? -9.40515 25.76087 -8.87558 1.000 49.24908 ? 214 ALA A HA 1 ATOM 3910 H HB1 . ALA A 1 214 ? -10.06545 27.50739 -10.29041 1.000 46.70788 ? 214 ALA A HB1 1 ATOM 3911 H HB2 . ALA A 1 214 ? -11.16933 26.36507 -10.28438 1.000 46.70788 ? 214 ALA A HB2 1 ATOM 3912 H HB3 . ALA A 1 214 ? -11.39482 27.69198 -9.44059 1.000 46.70788 ? 214 ALA A HB3 1 ATOM 3913 N N . ILE A 1 215 ? -10.04489 28.18941 -6.89378 1.000 36.27549 ? 215 ILE A N 1 ATOM 3914 C CA . ILE A 1 215 ? -9.41368 29.18805 -6.03250 1.000 34.14468 ? 215 ILE A CA 1 ATOM 3915 C C . ILE A 1 215 ? -8.47991 28.50655 -5.04473 1.000 38.23503 ? 215 ILE A C 1 ATOM 3916 O O . ILE A 1 215 ? -7.34234 28.94596 -4.83164 1.000 37.22107 ? 215 ILE A O 1 ATOM 3917 C CB . ILE A 1 215 ? -10.48533 30.03825 -5.32949 1.000 37.29930 ? 215 ILE A CB 1 ATOM 3918 C CG1 . ILE A 1 215 ? -11.21246 30.93486 -6.34790 1.000 40.22846 ? 215 ILE A CG1 1 ATOM 3919 C CG2 . ILE A 1 215 ? -9.87101 30.91065 -4.22021 1.000 41.16461 ? 215 ILE A CG2 1 ATOM 3920 C CD1 . ILE A 1 215 ? -12.43790 31.66170 -5.79283 1.000 42.07356 ? 215 ILE A CD1 1 ATOM 3921 H H . ILE A 1 215 ? -10.89846 28.13153 -6.80621 1.000 43.53059 ? 215 ILE A H 1 ATOM 3922 H HA . ILE A 1 215 ? -8.87873 29.78609 -6.57754 1.000 40.97361 ? 215 ILE A HA 1 ATOM 3923 H HB . ILE A 1 215 ? -11.12086 29.42710 -4.92515 1.000 44.75915 ? 215 ILE A HB 1 ATOM 3924 H HG12 . ILE A 1 215 ? -10.59111 31.60883 -6.66504 1.000 48.27415 ? 215 ILE A HG12 1 ATOM 3925 H HG13 . ILE A 1 215 ? -11.50979 30.38313 -7.08823 1.000 48.27415 ? 215 ILE A HG13 1 ATOM 3926 H HG21 . ILE A 1 215 ? -10.54689 31.52247 -3.88891 1.000 49.39753 ? 215 ILE A HG21 1 ATOM 3927 H HG22 . ILE A 1 215 ? -9.56326 30.33686 -3.50122 1.000 49.39753 ? 215 ILE A HG22 1 ATOM 3928 H HG23 . ILE A 1 215 ? -9.12476 31.40960 -4.58771 1.000 49.39753 ? 215 ILE A HG23 1 ATOM 3929 H HD11 . ILE A 1 215 ? -12.95469 32.01911 -6.53181 1.000 50.48827 ? 215 ILE A HD11 1 ATOM 3930 H HD12 . ILE A 1 215 ? -12.97571 31.03282 -5.28670 1.000 50.48827 ? 215 ILE A HD12 1 ATOM 3931 H HD13 . ILE A 1 215 ? -12.14258 32.38352 -5.21607 1.000 50.48827 ? 215 ILE A HD13 1 ATOM 3932 N N . GLN A 1 216 ? -8.94538 27.41513 -4.43015 1.000 40.06346 ? 216 GLN A N 1 ATOM 3933 C CA . GLN A 1 216 ? -8.13749 26.72603 -3.42804 1.000 38.26606 ? 216 GLN A CA 1 ATOM 3934 C C . GLN A 1 216 ? -6.86707 26.15444 -4.04461 1.000 40.06704 ? 216 GLN A C 1 ATOM 3935 O O . GLN A 1 216 ? -5.78672 26.24717 -3.45389 1.000 39.56455 ? 216 GLN A O 1 ATOM 3936 C CB . GLN A 1 216 ? -8.95268 25.61519 -2.76745 1.000 39.38994 ? 216 GLN A CB 1 ATOM 3937 C CG . GLN A 1 216 ? -8.23390 24.93552 -1.60403 1.000 44.86107 ? 216 GLN A CG 1 ATOM 3938 C CD . GLN A 1 216 ? -8.03237 25.86887 -0.43776 1.000 45.01644 ? 216 GLN A CD 1 ATOM 3939 O OE1 . GLN A 1 216 ? -8.98901 26.27548 0.22013 1.000 48.29952 ? 216 GLN A OE1 1 ATOM 3940 N NE2 . GLN A 1 216 ? -6.78199 26.22796 -0.18168 1.000 49.06727 ? 216 GLN A NE2 1 ATOM 3941 H H . GLN A 1 216 ? -9.71507 27.05969 -4.57450 1.000 48.07616 ? 216 GLN A H 1 ATOM 3942 H HA . GLN A 1 216 ? -7.88338 27.36285 -2.74191 1.000 45.91927 ? 216 GLN A HA 1 ATOM 3943 H HB2 . GLN A 1 216 ? -9.77734 25.99450 -2.42546 1.000 47.26793 ? 216 GLN A HB2 1 ATOM 3944 H HB3 . GLN A 1 216 ? -9.15013 24.93607 -3.43131 1.000 47.26793 ? 216 GLN A HB3 1 ATOM 3945 H HG2 . GLN A 1 216 ? -8.76257 24.18120 -1.30004 1.000 53.83328 ? 216 GLN A HG2 1 ATOM 3946 H HG3 . GLN A 1 216 ? -7.36244 24.63123 -1.90214 1.000 53.83328 ? 216 GLN A HG3 1 ATOM 3947 H HE21 . GLN A 1 216 ? -6.14027 25.92967 -0.67037 1.000 58.88072 ? 216 GLN A HE21 1 ATOM 3948 H HE22 . GLN A 1 216 ? -6.61268 26.75917 0.47311 1.000 58.88072 ? 216 GLN A HE22 1 ATOM 3949 N N . ALA A 1 217 ? -6.98457 25.53238 -5.21916 1.000 38.41213 ? 217 ALA A N 1 ATOM 3950 C CA . ALA A 1 217 ? -5.80309 25.04124 -5.91599 1.000 37.00056 ? 217 ALA A CA 1 ATOM 3951 C C . ALA A 1 217 ? -4.79926 26.15886 -6.15056 1.000 36.94299 ? 217 ALA A C 1 ATOM 3952 O O . ALA A 1 217 ? -3.58560 25.96577 -5.98521 1.000 37.65039 ? 217 ALA A O 1 ATOM 3953 C CB . ALA A 1 217 ? -6.20591 24.41778 -7.25413 1.000 38.87144 ? 217 ALA A CB 1 ATOM 3954 H H . ALA A 1 217 ? -7.72758 25.38521 -5.62645 1.000 46.09456 ? 217 ALA A H 1 ATOM 3955 H HA . ALA A 1 217 ? -5.38351 24.35826 -5.36975 1.000 44.40068 ? 217 ALA A HA 1 ATOM 3956 H HB1 . ALA A 1 217 ? -5.41207 24.07763 -7.69574 1.000 46.64573 ? 217 ALA A HB1 1 ATOM 3957 H HB2 . ALA A 1 217 ? -6.82929 23.69299 -7.08991 1.000 46.64573 ? 217 ALA A HB2 1 ATOM 3958 H HB3 . ALA A 1 217 ? -6.62574 25.09671 -7.80520 1.000 46.64573 ? 217 ALA A HB3 1 ATOM 3959 N N . SER A 1 218 ? -5.28042 27.31653 -6.59408 1.000 36.49075 ? 218 SER A N 1 ATOM 3960 C CA . SER A 1 218 ? -4.38685 28.43440 -6.86898 1.000 37.30504 ? 218 SER A CA 1 ATOM 3961 C C . SER A 1 218 ? -3.66212 28.87315 -5.60859 1.000 38.78978 ? 218 SER A C 1 ATOM 3962 O O . SER A 1 218 ? -2.45147 29.12954 -5.63106 1.000 36.90398 ? 218 SER A O 1 ATOM 3963 C CB . SER A 1 218 ? -5.18005 29.60699 -7.45082 1.000 39.62282 ? 218 SER A CB 1 ATOM 3964 O OG . SER A 1 218 ? -5.85765 29.21718 -8.62488 1.000 38.60765 ? 218 SER A OG 1 ATOM 3965 H H . SER A 1 218 ? -6.11174 27.47916 -6.74262 1.000 43.78890 ? 218 SER A H 1 ATOM 3966 H HA . SER A 1 218 ? -3.72788 28.15485 -7.52359 1.000 44.76604 ? 218 SER A HA 1 ATOM 3967 H HB2 . SER A 1 218 ? -5.82950 29.90582 -6.79522 1.000 47.54738 ? 218 SER A HB2 1 ATOM 3968 H HB3 . SER A 1 218 ? -4.56762 30.32842 -7.66382 1.000 47.54738 ? 218 SER A HB3 1 ATOM 3969 H HG . SER A 1 218 ? -6.39292 28.59282 -8.45380 1.000 46.32918 ? 218 SER A HG 1 ATOM 3970 N N . LEU A 1 219 ? -4.39492 28.98700 -4.50443 1.000 36.25789 ? 219 LEU A N 1 ATOM 3971 C CA . LEU A 1 219 ? -3.79270 29.41339 -3.24977 1.000 37.95431 ? 219 LEU A CA 1 ATOM 3972 C C . LEU A 1 219 ? -2.76492 28.39367 -2.77655 1.000 40.23252 ? 219 LEU A C 1 ATOM 3973 O O . LEU A 1 219 ? -1.68859 28.75940 -2.28793 1.000 39.21769 ? 219 LEU A O 1 ATOM 3974 C CB . LEU A 1 219 ? -4.89349 29.59754 -2.20903 1.000 38.58207 ? 219 LEU A CB 1 ATOM 3975 C CG . LEU A 1 219 ? -5.70864 30.88537 -2.35790 1.000 39.59302 ? 219 LEU A CG 1 ATOM 3976 C CD1 . LEU A 1 219 ? -6.84618 30.88920 -1.33344 1.000 42.46556 ? 219 LEU A CD1 1 ATOM 3977 C CD2 . LEU A 1 219 ? -4.88319 32.18326 -2.28615 1.000 49.24821 ? 219 LEU A CD2 1 ATOM 3978 H H . LEU A 1 219 ? -5.23797 28.82412 -4.45610 1.000 43.50947 ? 219 LEU A H 1 ATOM 3979 H HA . LEU A 1 219 ? -3.33886 30.26231 -3.36924 1.000 45.54517 ? 219 LEU A HA 1 ATOM 3980 H HB2 . LEU A 1 219 ? -5.50977 28.85170 -2.27850 1.000 46.29848 ? 219 LEU A HB2 1 ATOM 3981 H HB3 . LEU A 1 219 ? -4.48539 29.60984 -1.32914 1.000 46.29848 ? 219 LEU A HB3 1 ATOM 3982 H HG . LEU A 1 219 ? -6.07374 30.88993 -3.25656 1.000 47.51163 ? 219 LEU A HG 1 ATOM 3983 H HD11 . LEU A 1 219 ? -7.35513 31.70932 -1.42973 1.000 50.95867 ? 219 LEU A HD11 1 ATOM 3984 H HD12 . LEU A 1 219 ? -7.41922 30.12340 -1.49496 1.000 50.95867 ? 219 LEU A HD12 1 ATOM 3985 H HD13 . LEU A 1 219 ? -6.46820 30.83724 -0.44163 1.000 50.95867 ? 219 LEU A HD13 1 ATOM 3986 H HD21 . LEU A 1 219 ? -5.48754 32.94196 -2.28007 1.000 59.09785 ? 219 LEU A HD21 1 ATOM 3987 H HD22 . LEU A 1 219 ? -4.35325 32.17598 -1.47375 1.000 59.09785 ? 219 LEU A HD22 1 ATOM 3988 H HD23 . LEU A 1 219 ? -4.30090 32.23041 -3.06051 1.000 59.09785 ? 219 LEU A HD23 1 ATOM 3989 N N . ASP A 1 220 ? -3.06944 27.10491 -2.94585 1.000 38.06995 ? 220 ASP A N 1 ATOM 3990 C CA . ASP A 1 220 ? -2.17038 26.05745 -2.47135 1.000 36.46122 ? 220 ASP A CA 1 ATOM 3991 C C . ASP A 1 220 ? -0.91115 25.98229 -3.32626 1.000 39.75526 ? 220 ASP A C 1 ATOM 3992 O O . ASP A 1 220 ? 0.16435 25.65193 -2.80843 1.000 38.54944 ? 220 ASP A O 1 ATOM 3993 C CB . ASP A 1 220 ? -2.89476 24.70064 -2.43871 1.000 40.11263 ? 220 ASP A CB 1 ATOM 3994 C CG . ASP A 1 220 ? -3.92810 24.59654 -1.30631 1.000 44.00626 ? 220 ASP A CG 1 ATOM 3995 O OD1 . ASP A 1 220 ? -3.81724 25.32492 -0.30638 1.000 44.58644 ? 220 ASP A OD1 1 ATOM 3996 O OD2 . ASP A 1 220 ? -4.84673 23.76104 -1.39628 1.000 48.58731 ? 220 ASP A OD2 1 ATOM 3997 H H . ASP A 1 220 ? -3.78305 26.81498 -3.32833 1.000 45.68394 ? 220 ASP A H 1 ATOM 3998 H HA . ASP A 1 220 ? -1.90255 26.26011 -1.56135 1.000 43.75346 ? 220 ASP A HA 1 ATOM 3999 H HB2 . ASP A 1 220 ? -3.35989 24.57173 -3.28010 1.000 48.13516 ? 220 ASP A HB2 1 ATOM 4000 H HB3 . ASP A 1 220 ? -2.23956 23.99693 -2.31062 1.000 48.13516 ? 220 ASP A HB3 1 ATOM 4001 N N . ILE A 1 221 ? -1.02026 26.28421 -4.62413 1.000 36.17483 ? 221 ILE A N 1 ATOM 4002 C CA . ILE A 1 221 ? 0.16291 26.35331 -5.48094 1.000 35.05270 ? 221 ILE A CA 1 ATOM 4003 C C . ILE A 1 221 ? 1.07296 27.48851 -5.02230 1.000 37.05428 ? 221 ILE A C 1 ATOM 4004 O O . ILE A 1 221 ? 2.29159 27.31927 -4.88263 1.000 36.28308 ? 221 ILE A O 1 ATOM 4005 C CB . ILE A 1 221 ? -0.25159 26.52111 -6.95824 1.000 36.29290 ? 221 ILE A CB 1 ATOM 4006 C CG1 . ILE A 1 221 ? -0.73995 25.20162 -7.55965 1.000 37.66322 ? 221 ILE A CG1 1 ATOM 4007 C CG2 . ILE A 1 221 ? 0.90131 27.11696 -7.76772 1.000 40.36845 ? 221 ILE A CG2 1 ATOM 4008 C CD1 . ILE A 1 221 ? -1.47916 25.41055 -8.91413 1.000 38.97819 ? 221 ILE A CD1 1 ATOM 4009 H H . ILE A 1 221 ? -1.76099 26.45144 -5.02780 1.000 43.40980 ? 221 ILE A H 1 ATOM 4010 H HA . ILE A 1 221 ? 0.65452 25.52081 -5.40244 1.000 42.06324 ? 221 ILE A HA 1 ATOM 4011 H HB . ILE A 1 221 ? -0.99913 27.13832 -6.99212 1.000 43.55148 ? 221 ILE A HB 1 ATOM 4012 H HG12 . ILE A 1 221 ? 0.02220 24.62257 -7.71693 1.000 45.19586 ? 221 ILE A HG12 1 ATOM 4013 H HG13 . ILE A 1 221 ? -1.35572 24.77881 -6.94082 1.000 45.19586 ? 221 ILE A HG13 1 ATOM 4014 H HG21 . ILE A 1 221 ? 0.72771 26.98038 -8.71223 1.000 48.44214 ? 221 ILE A HG21 1 ATOM 4015 H HG22 . ILE A 1 221 ? 0.96391 28.06592 -7.57675 1.000 48.44214 ? 221 ILE A HG22 1 ATOM 4016 H HG23 . ILE A 1 221 ? 1.72642 26.67367 -7.51556 1.000 48.44214 ? 221 ILE A HG23 1 ATOM 4017 H HD11 . ILE A 1 221 ? -1.92656 24.58582 -9.16022 1.000 46.77383 ? 221 ILE A HD11 1 ATOM 4018 H HD12 . ILE A 1 221 ? -2.13020 26.12233 -8.81208 1.000 46.77383 ? 221 ILE A HD12 1 ATOM 4019 H HD13 . ILE A 1 221 ? -0.83047 25.65060 -9.59418 1.000 46.77383 ? 221 ILE A HD13 1 ATOM 4020 N N . LEU A 1 222 ? 0.49417 28.66615 -4.76737 1.000 36.56140 ? 222 LEU A N 1 ATOM 4021 C CA . LEU A 1 222 ? 1.30127 29.78861 -4.31231 1.000 38.06002 ? 222 LEU A CA 1 ATOM 4022 C C . LEU A 1 222 ? 2.00381 29.47395 -2.99171 1.000 41.09795 ? 222 LEU A C 1 ATOM 4023 O O . LEU A 1 222 ? 3.15779 29.86696 -2.79520 1.000 39.73290 ? 222 LEU A O 1 ATOM 4024 C CB . LEU A 1 222 ? 0.44718 31.05317 -4.18129 1.000 39.82062 ? 222 LEU A CB 1 ATOM 4025 C CG . LEU A 1 222 ? -0.15297 31.63170 -5.46931 1.000 42.16326 ? 222 LEU A CG 1 ATOM 4026 C CD1 . LEU A 1 222 ? -1.06745 32.82139 -5.17320 1.000 49.31994 ? 222 LEU A CD1 1 ATOM 4027 C CD2 . LEU A 1 222 ? 0.95211 32.03111 -6.42898 1.000 40.97393 ? 222 LEU A CD2 1 ATOM 4028 H H . LEU A 1 222 ? -0.34544 28.83324 -4.84942 1.000 43.87369 ? 222 LEU A H 1 ATOM 4029 H HA . LEU A 1 222 ? 1.98206 29.96247 -4.98104 1.000 45.67202 ? 222 LEU A HA 1 ATOM 4030 H HB2 . LEU A 1 222 ? -0.29511 30.85095 -3.59052 1.000 47.78474 ? 222 LEU A HB2 1 ATOM 4031 H HB3 . LEU A 1 222 ? 1.00143 31.74752 -3.79194 1.000 47.78474 ? 222 LEU A HB3 1 ATOM 4032 H HG . LEU A 1 222 ? -0.69666 30.94888 -5.89246 1.000 50.59591 ? 222 LEU A HG 1 ATOM 4033 H HD11 . LEU A 1 222 ? -1.41564 33.16793 -6.00960 1.000 59.18393 ? 222 LEU A HD11 1 ATOM 4034 H HD12 . LEU A 1 222 ? -1.79811 32.52511 -4.60817 1.000 59.18393 ? 222 LEU A HD12 1 ATOM 4035 H HD13 . LEU A 1 222 ? -0.55505 33.50805 -4.71839 1.000 59.18393 ? 222 LEU A HD13 1 ATOM 4036 H HD21 . LEU A 1 222 ? 0.56558 32.52965 -7.16583 1.000 49.16872 ? 222 LEU A HD21 1 ATOM 4037 H HD22 . LEU A 1 222 ? 1.59553 32.58311 -5.95758 1.000 49.16872 ? 222 LEU A HD22 1 ATOM 4038 H HD23 . LEU A 1 222 ? 1.38532 31.22999 -6.76280 1.000 49.16872 ? 222 LEU A HD23 1 ATOM 4039 N N A MET A 1 223 ? 1.31480 28.79182 -2.06504 0.444 39.90704 ? 223 MET A N 1 ATOM 4040 N N B MET A 1 223 ? 1.32881 28.76273 -2.08095 0.556 39.86602 ? 223 MET A N 1 ATOM 4041 C CA A MET A 1 223 ? 1.94887 28.39146 -0.80941 0.444 40.56428 ? 223 MET A CA 1 ATOM 4042 C CA B MET A 1 223 ? 1.95039 28.40969 -0.80526 0.556 40.50558 ? 223 MET A CA 1 ATOM 4043 C C A MET A 1 223 ? 3.09116 27.42301 -1.06777 0.444 40.21520 ? 223 MET A C 1 ATOM 4044 C C B MET A 1 223 ? 3.05272 27.37503 -0.99559 0.556 40.17450 ? 223 MET A C 1 ATOM 4045 O O A MET A 1 223 ? 4.19201 27.57314 -0.52446 0.444 41.64220 ? 223 MET A O 1 ATOM 4046 O O B MET A 1 223 ? 4.10398 27.45228 -0.34630 0.556 41.24925 ? 223 MET A O 1 ATOM 4047 C CB A MET A 1 223 ? 0.93588 27.72058 0.12268 0.444 43.92209 ? 223 MET A CB 1 ATOM 4048 C CB B MET A 1 223 ? 0.88513 27.88633 0.16445 0.556 43.79898 ? 223 MET A CB 1 ATOM 4049 C CG A MET A 1 223 ? 0.40013 28.57476 1.25118 0.444 54.87145 ? 223 MET A CG 1 ATOM 4050 C CG B MET A 1 223 ? 1.42043 27.25484 1.44290 0.556 44.29863 ? 223 MET A CG 1 ATOM 4051 S SD A MET A 1 223 ? 1.43535 28.85672 2.71855 0.444 61.51097 ? 223 MET A SD 1 ATOM 4052 S SD B MET A 1 223 ? 0.07654 26.71949 2.53185 0.556 62.22178 ? 223 MET A SD 1 ATOM 4053 C CE A MET A 1 223 ? 3.13675 28.90630 2.15840 0.444 40.34742 ? 223 MET A CE 1 ATOM 4054 C CE B MET A 1 223 ? -0.56280 25.29773 1.64463 0.556 55.25708 ? 223 MET A CE 1 ATOM 4055 H H A MET A 1 223 ? 0.49189 28.55377 -2.14089 0.444 47.88845 ? 223 MET A H 1 ATOM 4056 H H B MET A 1 223 ? 0.52307 28.47790 -2.17717 0.556 47.83922 ? 223 MET A H 1 ATOM 4057 H HA A MET A 1 223 ? 2.27681 29.19628 -0.37858 0.444 48.67713 ? 223 MET A HA 1 ATOM 4058 H HA B MET A 1 223 ? 2.33983 29.20967 -0.41889 0.556 48.60669 ? 223 MET A HA 1 ATOM 4059 H HB2 A MET A 1 223 ? 0.17497 27.43987 -0.40941 0.444 52.70651 ? 223 MET A HB2 1 ATOM 4060 H HB2 B MET A 1 223 ? 0.31734 28.62863 0.42426 0.556 52.55878 ? 223 MET A HB2 1 ATOM 4061 H HB3 A MET A 1 223 ? 1.36161 26.94804 0.52623 0.444 52.70651 ? 223 MET A HB3 1 ATOM 4062 H HB3 B MET A 1 223 ? 0.36007 27.21151 -0.29363 0.556 52.55878 ? 223 MET A HB3 1 ATOM 4063 H HG2 A MET A 1 223 ? 0.20335 29.45102 0.88464 0.444 65.84574 ? 223 MET A HG2 1 ATOM 4064 H HG2 B MET A 1 223 ? 1.95772 26.47942 1.21718 0.556 53.15836 ? 223 MET A HG2 1 ATOM 4065 H HG3 A MET A 1 223 ? -0.41557 28.15762 1.56981 0.444 65.84574 ? 223 MET A HG3 1 ATOM 4066 H HG3 B MET A 1 223 ? 1.95973 27.90456 1.92029 0.556 53.15836 ? 223 MET A HG3 1 ATOM 4067 H HE1 A MET A 1 223 ? 3.33453 28.08804 1.67648 0.444 48.41690 ? 223 MET A HE1 1 ATOM 4068 H HE1 B MET A 1 223 ? -1.31697 24.93322 2.13377 0.556 66.30849 ? 223 MET A HE1 1 ATOM 4069 H HE2 A MET A 1 223 ? 3.25456 29.67125 1.57371 0.444 48.41690 ? 223 MET A HE2 1 ATOM 4070 H HE2 B MET A 1 223 ? -0.84648 25.57857 0.76057 0.556 66.30849 ? 223 MET A HE2 1 ATOM 4071 H HE3 A MET A 1 223 ? 3.72069 28.98580 2.92885 0.444 48.41690 ? 223 MET A HE3 1 ATOM 4072 H HE3 B MET A 1 223 ? 0.13736 24.63046 1.57092 0.556 66.30849 ? 223 MET A HE3 1 ATOM 4073 N N . GLU A 1 224 ? 2.82690 26.39314 -1.87468 1.000 37.42662 ? 224 GLU A N 1 ATOM 4074 C CA . GLU A 1 224 ? 3.84181 25.38277 -2.13122 1.000 39.14297 ? 224 GLU A CA 1 ATOM 4075 C C . GLU A 1 224 ? 5.09154 26.00116 -2.75208 1.000 39.86915 ? 224 GLU A C 1 ATOM 4076 O O . GLU A 1 224 ? 6.21864 25.61525 -2.40309 1.000 40.41283 ? 224 GLU A O 1 ATOM 4077 C CB . GLU A 1 224 ? 3.25948 24.28530 -3.02221 1.000 40.46045 ? 224 GLU A CB 1 ATOM 4078 C CG . GLU A 1 224 ? 4.04579 22.99868 -2.98416 1.000 41.78366 ? 224 GLU A CG 1 ATOM 4079 C CD . GLU A 1 224 ? 3.96162 22.27689 -1.63818 1.000 47.71710 ? 224 GLU A CD 1 ATOM 4080 O OE1 . GLU A 1 224 ? 3.00212 22.49147 -0.85740 1.000 49.21680 ? 224 GLU A OE1 1 ATOM 4081 O OE2 . GLU A 1 224 ? 4.89031 21.50411 -1.35727 1.000 55.03344 ? 224 GLU A OE2 1 ATOM 4082 H H A GLU A 1 224 ? 2.07872 26.26154 -2.27780 0.444 44.91194 ? 224 GLU A H 1 ATOM 4083 H H B GLU A 1 224 ? 2.10232 26.29488 -2.32737 0.556 44.91194 ? 224 GLU A H 1 ATOM 4084 H HA . GLU A 1 224 ? 4.10859 24.97288 -1.29354 1.000 46.97157 ? 224 GLU A HA 1 ATOM 4085 H HB2 . GLU A 1 224 ? 2.35600 24.09021 -2.72801 1.000 48.55254 ? 224 GLU A HB2 1 ATOM 4086 H HB3 . GLU A 1 224 ? 3.24894 24.60009 -3.93965 1.000 48.55254 ? 224 GLU A HB3 1 ATOM 4087 H HG2 . GLU A 1 224 ? 3.70102 22.39986 -3.66494 1.000 50.14039 ? 224 GLU A HG2 1 ATOM 4088 H HG3 . GLU A 1 224 ? 4.97944 23.19615 -3.15798 1.000 50.14039 ? 224 GLU A HG3 1 ATOM 4089 N N . LEU A 1 225 ? 4.92194 26.97853 -3.64987 1.000 38.15245 ? 225 LEU A N 1 ATOM 4090 C CA . LEU A 1 225 ? 6.08745 27.62765 -4.25110 1.000 37.02038 ? 225 LEU A CA 1 ATOM 4091 C C . LEU A 1 225 ? 6.86180 28.44663 -3.22022 1.000 40.11810 ? 225 LEU A C 1 ATOM 4092 O O . LEU A 1 225 ? 8.09446 28.53176 -3.28787 1.000 40.98231 ? 225 LEU A O 1 ATOM 4093 C CB . LEU A 1 225 ? 5.65266 28.50154 -5.43206 1.000 35.91182 ? 225 LEU A CB 1 ATOM 4094 C CG . LEU A 1 225 ? 5.09003 27.71481 -6.61948 1.000 41.55995 ? 225 LEU A CG 1 ATOM 4095 C CD1 . LEU A 1 225 ? 4.59606 28.70018 -7.67157 1.000 47.02050 ? 225 LEU A CD1 1 ATOM 4096 C CD2 . LEU A 1 225 ? 6.11802 26.76997 -7.20928 1.000 46.28690 ? 225 LEU A CD2 1 ATOM 4097 H H . LEU A 1 225 ? 4.16168 27.27596 -3.92034 1.000 45.78294 ? 225 LEU A H 1 ATOM 4098 H HA . LEU A 1 225 ? 6.68466 26.94412 -4.59317 1.000 44.42445 ? 225 LEU A HA 1 ATOM 4099 H HB2 . LEU A 1 225 ? 4.96226 29.11146 -5.12833 1.000 43.09418 ? 225 LEU A HB2 1 ATOM 4100 H HB3 . LEU A 1 225 ? 6.42188 29.00150 -5.74707 1.000 43.09418 ? 225 LEU A HB3 1 ATOM 4101 H HG . LEU A 1 225 ? 4.35173 27.16275 -6.31776 1.000 49.87194 ? 225 LEU A HG 1 ATOM 4102 H HD11 . LEU A 1 225 ? 4.25407 28.20490 -8.43226 1.000 56.42460 ? 225 LEU A HD11 1 ATOM 4103 H HD12 . LEU A 1 225 ? 3.89132 29.24508 -7.28773 1.000 56.42460 ? 225 LEU A HD12 1 ATOM 4104 H HD13 . LEU A 1 225 ? 5.33565 29.26322 -7.94887 1.000 56.42460 ? 225 LEU A HD13 1 ATOM 4105 H HD21 . LEU A 1 225 ? 5.79486 26.44557 -8.06440 1.000 55.54428 ? 225 LEU A HD21 1 ATOM 4106 H HD22 . LEU A 1 225 ? 6.95319 27.24805 -7.33105 1.000 55.54428 ? 225 LEU A HD22 1 ATOM 4107 H HD23 . LEU A 1 225 ? 6.24856 26.02572 -6.60105 1.000 55.54428 ? 225 LEU A HD23 1 ATOM 4108 N N . GLU A 1 226 ? 6.17399 29.07196 -2.26403 1.000 38.85617 ? 226 GLU A N 1 ATOM 4109 C CA A GLU A 1 226 ? 6.89909 29.80151 -1.22579 0.565 42.65352 ? 226 GLU A CA 1 ATOM 4110 C CA B GLU A 1 226 ? 6.89408 29.79870 -1.22283 0.435 42.68127 ? 226 GLU A CA 1 ATOM 4111 C C . GLU A 1 226 ? 7.72842 28.84613 -0.37660 1.000 40.01563 ? 226 GLU A C 1 ATOM 4112 O O . GLU A 1 226 ? 8.87900 29.14651 -0.03854 1.000 43.46081 ? 226 GLU A O 1 ATOM 4113 C CB A GLU A 1 226 ? 5.93735 30.60745 -0.34505 0.565 44.00675 ? 226 GLU A CB 1 ATOM 4114 C CB B GLU A 1 226 ? 5.92517 30.58307 -0.33610 0.435 44.02787 ? 226 GLU A CB 1 ATOM 4115 C CG A GLU A 1 226 ? 6.57853 31.17219 0.92876 0.565 49.15802 ? 226 GLU A CG 1 ATOM 4116 C CG B GLU A 1 226 ? 6.64230 31.44406 0.69215 0.435 48.63378 ? 226 GLU A CG 1 ATOM 4117 C CD A GLU A 1 226 ? 7.21690 32.53803 0.73462 0.565 55.03697 ? 226 GLU A CD 1 ATOM 4118 C CD B GLU A 1 226 ? 5.70540 32.12282 1.66999 0.435 54.88413 ? 226 GLU A CD 1 ATOM 4119 O OE1 A GLU A 1 226 ? 7.38031 32.96305 -0.42957 0.565 48.51749 ? 226 GLU A OE1 1 ATOM 4120 O OE1 B GLU A 1 226 ? 4.47920 31.92166 1.56530 0.435 60.67801 ? 226 GLU A OE1 1 ATOM 4121 O OE2 A GLU A 1 226 ? 7.58642 33.17152 1.75095 0.565 63.24719 ? 226 GLU A OE2 1 ATOM 4122 O OE2 B GLU A 1 226 ? 6.20092 32.85571 2.55062 0.435 66.11395 ? 226 GLU A OE2 1 ATOM 4123 H H A GLU A 1 226 ? 5.31686 29.08873 -2.19594 0.565 46.62740 ? 226 GLU A H 1 ATOM 4124 H H B GLU A 1 226 ? 5.31671 29.08984 -2.19807 0.435 46.62740 ? 226 GLU A H 1 ATOM 4125 H HA A GLU A 1 226 ? 7.49459 30.43602 -1.65436 0.565 51.18422 ? 226 GLU A HA 1 ATOM 4126 H HA B GLU A 1 226 ? 7.48503 30.43911 -1.64893 0.435 51.21753 ? 226 GLU A HA 1 ATOM 4127 H HB2 A GLU A 1 226 ? 5.59746 31.35560 -0.86045 0.565 52.80811 ? 226 GLU A HB2 1 ATOM 4128 H HB2 B GLU A 1 226 ? 5.38667 31.16582 -0.89406 0.435 52.83344 ? 226 GLU A HB2 1 ATOM 4129 H HB3 A GLU A 1 226 ? 5.20563 30.03044 -0.07571 0.565 52.80811 ? 226 GLU A HB3 1 ATOM 4130 H HB3 B GLU A 1 226 ? 5.35481 29.95865 0.13897 0.435 52.83344 ? 226 GLU A HB3 1 ATOM 4131 H HG2 A GLU A 1 226 ? 5.89470 31.25898 1.61122 0.565 58.98963 ? 226 GLU A HG2 1 ATOM 4132 H HG2 B GLU A 1 226 ? 7.24841 30.88393 1.20183 0.435 58.36054 ? 226 GLU A HG2 1 ATOM 4133 H HG3 A GLU A 1 226 ? 7.27027 30.56159 1.22800 0.565 58.98963 ? 226 GLU A HG3 1 ATOM 4134 H HG3 B GLU A 1 226 ? 7.14013 32.13588 0.22905 0.435 58.36054 ? 226 GLU A HG3 1 ATOM 4135 N N . ILE A 1 227 ? 7.15511 27.69215 -0.01007 1.000 41.16852 ? 227 ILE A N 1 ATOM 4136 C CA . ILE A 1 227 ? 7.90800 26.69701 0.75004 1.000 42.31757 ? 227 ILE A CA 1 ATOM 4137 C C . ILE A 1 227 ? 9.10535 26.20875 -0.05405 1.000 43.41090 ? 227 ILE A C 1 ATOM 4138 O O . ILE A 1 227 ? 10.20336 26.02533 0.48572 1.000 44.20307 ? 227 ILE A O 1 ATOM 4139 C CB . ILE A 1 227 ? 6.98766 25.52732 1.15731 1.000 46.59075 ? 227 ILE A CB 1 ATOM 4140 C CG1 . ILE A 1 227 ? 5.95918 26.01826 2.18480 1.000 51.51429 ? 227 ILE A CG1 1 ATOM 4141 C CG2 . ILE A 1 227 ? 7.81209 24.37279 1.71778 1.000 53.02775 ? 227 ILE A CG2 1 ATOM 4142 C CD1 . ILE A 1 227 ? 4.80414 25.05636 2.42229 1.000 54.72689 ? 227 ILE A CD1 1 ATOM 4143 H H . ILE A 1 227 ? 6.34416 27.46768 -0.18776 1.000 49.40222 ? 227 ILE A H 1 ATOM 4144 H HA . ILE A 1 227 ? 8.24039 27.11533 1.55962 1.000 50.78108 ? 227 ILE A HA 1 ATOM 4145 H HB . ILE A 1 227 ? 6.51596 25.20500 0.37340 1.000 55.90890 ? 227 ILE A HB 1 ATOM 4146 H HG12 . ILE A 1 227 ? 6.40898 26.15263 3.03364 1.000 61.81715 ? 227 ILE A HG12 1 ATOM 4147 H HG13 . ILE A 1 227 ? 5.58411 26.85626 1.87178 1.000 61.81715 ? 227 ILE A HG13 1 ATOM 4148 H HG21 . ILE A 1 227 ? 7.22610 23.77503 2.20787 1.000 63.63330 ? 227 ILE A HG21 1 ATOM 4149 H HG22 . ILE A 1 227 ? 8.23007 23.89727 0.98288 1.000 63.63330 ? 227 ILE A HG22 1 ATOM 4150 H HG23 . ILE A 1 227 ? 8.49215 24.72899 2.31068 1.000 63.63330 ? 227 ILE A HG23 1 ATOM 4151 H HD11 . ILE A 1 227 ? 4.14985 25.48420 2.99653 1.000 65.67227 ? 227 ILE A HD11 1 ATOM 4152 H HD12 . ILE A 1 227 ? 4.39958 24.83205 1.56970 1.000 65.67227 ? 227 ILE A HD12 1 ATOM 4153 H HD13 . ILE A 1 227 ? 5.14392 24.25399 2.84850 1.000 65.67227 ? 227 ILE A HD13 1 ATOM 4154 N N . LEU A 1 228 ? 8.91221 25.99216 -1.35487 1.000 38.74505 ? 228 LEU A N 1 ATOM 4155 C CA . LEU A 1 228 ? 9.98315 25.48676 -2.20835 1.000 39.06321 ? 228 LEU A CA 1 ATOM 4156 C C . LEU A 1 228 ? 11.13401 26.47956 -2.28342 1.000 43.28884 ? 228 LEU A C 1 ATOM 4157 O O . LEU A 1 228 ? 12.30729 26.09937 -2.17489 1.000 42.52717 ? 228 LEU A O 1 ATOM 4158 C CB . LEU A 1 228 ? 9.42571 25.21424 -3.60413 1.000 40.40476 ? 228 LEU A CB 1 ATOM 4159 C CG . LEU A 1 228 ? 10.32912 24.51240 -4.60753 1.000 50.03408 ? 228 LEU A CG 1 ATOM 4160 C CD1 . LEU A 1 228 ? 10.55440 23.07488 -4.18768 1.000 60.61531 ? 228 LEU A CD1 1 ATOM 4161 C CD2 . LEU A 1 228 ? 9.67933 24.56833 -5.99001 1.000 49.77252 ? 228 LEU A CD2 1 ATOM 4162 H H . LEU A 1 228 ? 8.17035 26.12989 -1.76752 1.000 46.49406 ? 228 LEU A H 1 ATOM 4163 H HA . LEU A 1 228 ? 10.32395 24.65721 -1.83875 1.000 46.87585 ? 228 LEU A HA 1 ATOM 4164 H HB2 . LEU A 1 228 ? 8.63669 24.65912 -3.50329 1.000 48.48572 ? 228 LEU A HB2 1 ATOM 4165 H HB3 . LEU A 1 228 ? 9.18308 26.06753 -3.99649 1.000 48.48572 ? 228 LEU A HB3 1 ATOM 4166 H HG . LEU A 1 228 ? 11.19259 24.95268 -4.64590 1.000 60.04090 ? 228 LEU A HG 1 ATOM 4167 H HD11 . LEU A 1 228 ? 11.07098 22.62295 -4.87310 1.000 72.73837 ? 228 LEU A HD11 1 ATOM 4168 H HD12 . LEU A 1 228 ? 11.03854 23.06353 -3.34721 1.000 72.73837 ? 228 LEU A HD12 1 ATOM 4169 H HD13 . LEU A 1 228 ? 9.69463 22.63887 -4.08006 1.000 72.73837 ? 228 LEU A HD13 1 ATOM 4170 H HD21 . LEU A 1 228 ? 10.25410 24.11667 -6.62761 1.000 59.72702 ? 228 LEU A HD21 1 ATOM 4171 H HD22 . LEU A 1 228 ? 8.81661 24.12659 -5.95157 1.000 59.72702 ? 228 LEU A HD22 1 ATOM 4172 H HD23 . LEU A 1 228 ? 9.56455 25.49641 -6.24769 1.000 59.72702 ? 228 LEU A HD23 1 ATOM 4173 N N . ARG A 1 229 ? 10.80364 27.76115 -2.48166 1.000 39.53854 ? 229 ARG A N 1 ATOM 4174 C CA . ARG A 1 229 ? 11.80933 28.81621 -2.54916 1.000 40.71094 ? 229 ARG A CA 1 ATOM 4175 C C . ARG A 1 229 ? 12.60455 28.92195 -1.25010 1.000 42.20313 ? 229 ARG A C 1 ATOM 4176 O O . ARG A 1 229 ? 13.83203 29.06792 -1.27318 1.000 43.32819 ? 229 ARG A O 1 ATOM 4177 C CB . ARG A 1 229 ? 11.12909 30.15385 -2.83713 1.000 43.26170 ? 229 ARG A CB 1 ATOM 4178 C CG . ARG A 1 229 ? 10.65177 30.33043 -4.27097 1.000 38.54748 ? 229 ARG A CG 1 ATOM 4179 C CD . ARG A 1 229 ? 10.31022 31.78135 -4.53730 1.000 40.93487 ? 229 ARG A CD 1 ATOM 4180 N NE . ARG A 1 229 ? 9.21374 32.28039 -3.71080 1.000 40.65851 ? 229 ARG A NE 1 ATOM 4181 C CZ . ARG A 1 229 ? 7.93510 32.24948 -4.06941 1.000 41.79848 ? 229 ARG A CZ 1 ATOM 4182 N NH1 . ARG A 1 229 ? 7.55130 31.73670 -5.23327 1.000 38.24904 ? 229 ARG A NH1 1 ATOM 4183 N NH2 . ARG A 1 229 ? 7.02344 32.78918 -3.26385 1.000 41.43616 ? 229 ARG A NH2 1 ATOM 4184 H H . ARG A 1 229 ? 9.99782 28.04489 -2.58043 1.000 47.44625 ? 229 ARG A H 1 ATOM 4185 H HA . ARG A 1 229 ? 12.42532 28.60652 -3.26853 1.000 48.85312 ? 229 ARG A HA 1 ATOM 4186 H HB2 . ARG A 1 229 ? 10.35424 30.23589 -2.25940 1.000 51.91404 ? 229 ARG A HB2 1 ATOM 4187 H HB3 . ARG A 1 229 ? 11.75971 30.86663 -2.64960 1.000 51.91404 ? 229 ARG A HB3 1 ATOM 4188 H HG2 . ARG A 1 229 ? 11.35361 30.06002 -4.88350 1.000 46.25697 ? 229 ARG A HG2 1 ATOM 4189 H HG3 . ARG A 1 229 ? 9.85766 29.79325 -4.41835 1.000 46.25697 ? 229 ARG A HG3 1 ATOM 4190 H HD2 . ARG A 1 229 ? 11.09162 32.32631 -4.35473 1.000 49.12185 ? 229 ARG A HD2 1 ATOM 4191 H HD3 . ARG A 1 229 ? 10.04896 31.87678 -5.46656 1.000 49.12185 ? 229 ARG A HD3 1 ATOM 4192 H HE . ARG A 1 229 ? 9.40855 32.61555 -2.94313 1.000 48.79021 ? 229 ARG A HE 1 ATOM 4193 H HH11 . ARG A 1 229 ? 8.13632 31.41438 -5.77500 1.000 45.89885 ? 229 ARG A HH11 1 ATOM 4194 H HH12 . ARG A 1 229 ? 6.71782 31.72705 -5.44499 1.000 45.89885 ? 229 ARG A HH12 1 ATOM 4195 H HH21 . ARG A 1 229 ? 7.26538 33.15157 -2.52241 1.000 49.72339 ? 229 ARG A HH21 1 ATOM 4196 H HH22 . ARG A 1 229 ? 6.19241 32.77552 -3.48477 1.000 49.72339 ? 229 ARG A HH22 1 ATOM 4197 N N . ASN A 1 230 ? 11.91642 28.85448 -0.11049 1.000 41.32510 ? 230 ASN A N 1 ATOM 4198 C CA . ASN A 1 230 ? 12.58152 29.03452 1.17474 1.000 43.18389 ? 230 ASN A CA 1 ATOM 4199 C C . ASN A 1 230 ? 13.44196 27.83338 1.55331 1.000 47.52334 ? 230 ASN A C 1 ATOM 4200 O O . ASN A 1 230 ? 14.48685 28.00081 2.19265 1.000 45.06137 ? 230 ASN A O 1 ATOM 4201 C CB . ASN A 1 230 ? 11.53745 29.29557 2.26928 1.000 44.17886 ? 230 ASN A CB 1 ATOM 4202 C CG . ASN A 1 230 ? 10.83495 30.64238 2.11202 1.000 51.48163 ? 230 ASN A CG 1 ATOM 4203 O OD1 . ASN A 1 230 ? 11.21840 31.47007 1.28263 1.000 57.20084 ? 230 ASN A OD1 1 ATOM 4204 N ND2 . ASN A 1 230 ? 9.79077 30.85296 2.89302 1.000 57.01339 ? 230 ASN A ND2 1 ATOM 4205 H H . ASN A 1 230 ? 11.07097 28.70686 -0.05554 1.000 49.59012 ? 230 ASN A H 1 ATOM 4206 H HA . ASN A 1 230 ? 13.16456 29.80710 1.11088 1.000 51.82067 ? 230 ASN A HA 1 ATOM 4207 H HB2 . ASN A 1 230 ? 10.86235 28.59996 2.23364 1.000 53.01463 ? 230 ASN A HB2 1 ATOM 4208 H HB3 . ASN A 1 230 ? 11.97758 29.28676 3.13364 1.000 53.01463 ? 230 ASN A HB3 1 ATOM 4209 H HD21 . ASN A 1 230 ? 9.54183 30.24744 3.45068 1.000 68.41607 ? 230 ASN A HD21 1 ATOM 4210 H HD22 . ASN A 1 230 ? 9.35984 31.59558 2.84388 1.000 68.41607 ? 230 ASN A HD22 1 ATOM 4211 N N A SER A 1 231 ? 13.04075 26.62384 1.16913 0.534 46.13063 ? 231 SER A N 1 ATOM 4212 N N B SER A 1 231 ? 13.02388 26.62663 1.17142 0.466 46.14379 ? 231 SER A N 1 ATOM 4213 C CA A SER A 1 231 ? 13.72496 25.41443 1.60713 0.534 46.15841 ? 231 SER A CA 1 ATOM 4214 C CA B SER A 1 231 ? 13.69984 25.40955 1.59528 0.466 46.16375 ? 231 SER A CA 1 ATOM 4215 C C A SER A 1 231 ? 14.72379 24.87687 0.58878 0.534 46.47022 ? 231 SER A C 1 ATOM 4216 C C B SER A 1 231 ? 14.84981 25.00481 0.68135 0.466 46.53961 ? 231 SER A C 1 ATOM 4217 O O A SER A 1 231 ? 15.32259 23.82331 0.82547 0.534 48.76569 ? 231 SER A O 1 ATOM 4218 O O B SER A 1 231 ? 15.68557 24.19137 1.09090 0.466 48.00804 ? 231 SER A O 1 ATOM 4219 C CB A SER A 1 231 ? 12.69943 24.32478 1.92989 0.534 48.24955 ? 231 SER A CB 1 ATOM 4220 C CB B SER A 1 231 ? 12.69160 24.25404 1.67147 0.466 48.09770 ? 231 SER A CB 1 ATOM 4221 O OG A SER A 1 231 ? 12.14888 23.80524 0.73610 0.534 45.85153 ? 231 SER A OG 1 ATOM 4222 O OG B SER A 1 231 ? 11.63410 24.55179 2.56431 0.466 50.80270 ? 231 SER A OG 1 ATOM 4223 H H A SER A 1 231 ? 12.36966 26.47906 0.65118 0.534 55.35676 ? 231 SER A H 1 ATOM 4224 H H B SER A 1 231 ? 12.34463 26.48859 0.66234 0.466 55.37255 ? 231 SER A H 1 ATOM 4225 H HA A SER A 1 231 ? 14.21815 25.62385 2.41571 0.534 55.39009 ? 231 SER A HA 1 ATOM 4226 H HA B SER A 1 231 ? 14.06806 25.55466 2.48086 0.466 55.39650 ? 231 SER A HA 1 ATOM 4227 H HB2 A SER A 1 231 ? 13.13755 23.60910 2.41647 0.534 57.89946 ? 231 SER A HB2 1 ATOM 4228 H HB2 B SER A 1 231 ? 12.32242 24.10084 0.78765 0.466 57.71724 ? 231 SER A HB2 1 ATOM 4229 H HB3 A SER A 1 231 ? 11.98873 24.70586 2.46896 0.534 57.89946 ? 231 SER A HB3 1 ATOM 4230 H HB3 B SER A 1 231 ? 13.14988 23.45760 1.98221 0.466 57.71724 ? 231 SER A HB3 1 ATOM 4231 H HG A SER A 1 231 ? 11.76328 24.41635 0.30779 0.534 55.02184 ? 231 SER A HG 1 ATOM 4232 H HG B SER A 1 231 ? 11.20047 25.21483 2.28513 0.466 60.96324 ? 231 SER A HG 1 ATOM 4233 N N . ALA A 1 232 ? 14.92424 25.56576 -0.52246 1.000 44.26173 ? 232 ALA A N 1 ATOM 4234 C CA . ALA A 1 232 ? 15.87208 25.08626 -1.51910 1.000 45.29236 ? 232 ALA A CA 1 ATOM 4235 C C . ALA A 1 232 ? 17.31634 25.25598 -1.04561 1.000 46.92303 ? 232 ALA A C 1 ATOM 4236 O O . ALA A 1 232 ? 17.61974 26.11424 -0.21054 1.000 50.23348 ? 232 ALA A O 1 ATOM 4237 C CB . ALA A 1 232 ? 15.67140 25.83250 -2.83907 1.000 50.34865 ? 232 ALA A CB 1 ATOM 4238 H H A ALA A 1 232 ? 14.53113 26.30379 -0.72340 0.534 53.11407 ? 232 ALA A H 1 ATOM 4239 H H B ALA A 1 232 ? 14.43771 26.22413 -0.78598 0.466 53.11407 ? 232 ALA A H 1 ATOM 4240 H HA . ALA A 1 232 ? 15.72058 24.13917 -1.66391 1.000 54.35083 ? 232 ALA A HA 1 ATOM 4241 H HB1 . ALA A 1 232 ? 16.30038 25.49092 -3.49374 1.000 60.41837 ? 232 ALA A HB1 1 ATOM 4242 H HB2 . ALA A 1 232 ? 14.76285 25.68993 -3.14748 1.000 60.41837 ? 232 ALA A HB2 1 ATOM 4243 H HB3 . ALA A 1 232 ? 15.82666 26.77887 -2.69358 1.000 60.41837 ? 232 ALA A HB3 1 ATOM 4244 N N . PRO A 1 233 ? 18.23253 24.43877 -1.56051 1.000 52.53273 ? 233 PRO A N 1 ATOM 4245 C CA . PRO A 1 233 ? 19.63421 24.55801 -1.15122 1.000 56.45713 ? 233 PRO A CA 1 ATOM 4246 C C . PRO A 1 233 ? 20.23671 25.89027 -1.56997 1.000 52.46582 ? 233 PRO A C 1 ATOM 4247 O O . PRO A 1 233 ? 19.78105 26.54652 -2.51237 1.000 49.15898 ? 233 PRO A O 1 ATOM 4248 C CB . PRO A 1 233 ? 20.32901 23.39678 -1.87875 1.000 53.88820 ? 233 PRO A CB 1 ATOM 4249 C CG . PRO A 1 233 ? 19.28674 22.68716 -2.65759 1.000 57.35223 ? 233 PRO A CG 1 ATOM 4250 C CD . PRO A 1 233 ? 17.94619 23.15690 -2.22696 1.000 54.54756 ? 233 PRO A CD 1 ATOM 4251 H HA . PRO A 1 233 ? 19.71265 24.44572 -0.19093 1.000 67.74855 ? 233 PRO A HA 1 ATOM 4252 H HB2 . PRO A 1 233 ? 21.01281 23.74996 -2.46915 1.000 64.66584 ? 233 PRO A HB2 1 ATOM 4253 H HB3 . PRO A 1 233 ? 20.72950 22.80154 -1.22591 1.000 64.66584 ? 233 PRO A HB3 1 ATOM 4254 H HG2 . PRO A 1 233 ? 19.41672 22.87725 -3.59986 1.000 68.82268 ? 233 PRO A HG2 1 ATOM 4255 H HG3 . PRO A 1 233 ? 19.37058 21.73427 -2.49674 1.000 68.82268 ? 233 PRO A HG3 1 ATOM 4256 H HD2 . PRO A 1 233 ? 17.36449 23.28822 -2.99199 1.000 65.45707 ? 233 PRO A HD2 1 ATOM 4257 H HD3 . PRO A 1 233 ? 17.54302 22.52860 -1.60761 1.000 65.45707 ? 233 PRO A HD3 1 ATOM 4258 N N . GLU A 1 234 ? 21.30867 26.26882 -0.87902 1.000 50.74370 ? 234 GLU A N 1 ATOM 4259 C CA . GLU A 1 234 ? 22.03674 27.47450 -1.24602 1.000 48.01555 ? 234 GLU A CA 1 ATOM 4260 C C . GLU A 1 234 ? 22.41900 27.42041 -2.71632 1.000 52.26748 ? 234 GLU A C 1 ATOM 4261 O O . GLU A 1 234 ? 22.92162 26.40369 -3.20007 1.000 53.78928 ? 234 GLU A O 1 ATOM 4262 C CB . GLU A 1 234 ? 23.30361 27.63385 -0.40286 1.000 57.62670 ? 234 GLU A CB 1 ATOM 4263 C CG . GLU A 1 234 ? 23.17300 27.22553 1.03736 1.000 73.27926 ? 234 GLU A CG 1 ATOM 4264 C CD . GLU A 1 234 ? 24.23411 27.87362 1.90090 1.000 94.27434 ? 234 GLU A CD 1 ATOM 4265 O OE1 . GLU A 1 234 ? 25.22138 28.39554 1.33383 1.000 71.63462 ? 234 GLU A OE1 1 ATOM 4266 O OE2 . GLU A 1 234 ? 24.08446 27.85392 3.14066 1.000 118.10738 ? 234 GLU A OE2 1 ATOM 4267 H H . GLU A 1 234 ? 21.62992 25.84824 -0.20115 1.000 60.89244 ? 234 GLU A H 1 ATOM 4268 H HA . GLU A 1 234 ? 21.46835 28.24247 -1.07850 1.000 57.61865 ? 234 GLU A HA 1 ATOM 4269 H HB2 . GLU A 1 234 ? 24.00298 27.08863 -0.79595 1.000 69.15204 ? 234 GLU A HB2 1 ATOM 4270 H HB3 . GLU A 1 234 ? 23.56423 28.56808 -0.41630 1.000 69.15204 ? 234 GLU A HB3 1 ATOM 4271 H HG2 . GLU A 1 234 ? 22.30285 27.49660 1.36940 1.000 87.93511 ? 234 GLU A HG2 1 ATOM 4272 H HG3 . GLU A 1 234 ? 23.26965 26.26290 1.10730 1.000 87.93511 ? 234 GLU A HG3 1 ATOM 4273 N N . GLY A 1 235 ? 22.19071 28.52337 -3.41906 1.000 50.75655 ? 235 GLY A N 1 ATOM 4274 C CA . GLY A 1 235 ? 22.55650 28.62598 -4.81120 1.000 56.78603 ? 235 GLY A CA 1 ATOM 4275 C C . GLY A 1 235 ? 21.59017 27.98539 -5.77862 1.000 49.84320 ? 235 GLY A C 1 ATOM 4276 O O . GLY A 1 235 ? 21.81637 28.06703 -6.99168 1.000 52.25005 ? 235 GLY A O 1 ATOM 4277 H H . GLY A 1 235 ? 21.81996 29.23151 -3.10174 1.000 60.90786 ? 235 GLY A H 1 ATOM 4278 H HA2 . GLY A 1 235 ? 22.62708 29.56499 -5.04395 1.000 68.14324 ? 235 GLY A HA2 1 ATOM 4279 H HA3 . GLY A 1 235 ? 23.42095 28.20393 -4.93567 1.000 68.14324 ? 235 GLY A HA3 1 ATOM 4280 N N . SER A 1 236 ? 20.51821 27.36226 -5.29300 1.000 45.65686 ? 236 SER A N 1 ATOM 4281 C CA . SER A 1 236 ? 19.57854 26.69632 -6.18577 1.000 45.26965 ? 236 SER A CA 1 ATOM 4282 C C . SER A 1 236 ? 18.74820 27.70726 -6.97494 1.000 46.75940 ? 236 SER A C 1 ATOM 4283 O O . SER A 1 236 ? 18.27205 28.70652 -6.42459 1.000 41.91340 ? 236 SER A O 1 ATOM 4284 C CB . SER A 1 236 ? 18.63784 25.78087 -5.39343 1.000 45.86515 ? 236 SER A CB 1 ATOM 4285 O OG . SER A 1 236 ? 17.56466 25.34275 -6.22495 1.000 47.01357 ? 236 SER A OG 1 ATOM 4286 H H . SER A 1 236 ? 20.31511 27.31157 -4.45887 1.000 54.78823 ? 236 SER A H 1 ATOM 4287 H HA . SER A 1 236 ? 20.08447 26.16213 -6.81789 1.000 54.32358 ? 236 SER A HA 1 ATOM 4288 H HB2 . SER A 1 236 ? 19.13398 25.00852 -5.08003 1.000 55.03819 ? 236 SER A HB2 1 ATOM 4289 H HB3 . SER A 1 236 ? 18.27645 26.27160 -4.63879 1.000 55.03819 ? 236 SER A HB3 1 ATOM 4290 H HG . SER A 1 236 ? 17.03911 24.85793 -5.78411 1.000 56.41629 ? 236 SER A HG 1 ATOM 4291 N N . PRO A 1 237 ? 18.51192 27.45701 -8.26467 1.000 44.64082 ? 237 PRO A N 1 ATOM 4292 C CA . PRO A 1 237 ? 17.63265 28.35261 -9.02414 1.000 43.23809 ? 237 PRO A CA 1 ATOM 4293 C C . PRO A 1 237 ? 16.17793 28.29913 -8.57885 1.000 44.18473 ? 237 PRO A C 1 ATOM 4294 O O . PRO A 1 237 ? 15.42840 29.24078 -8.87054 1.000 44.04869 ? 237 PRO A O 1 ATOM 4295 C CB . PRO A 1 237 ? 17.80784 27.86493 -10.47303 1.000 48.29959 ? 237 PRO A CB 1 ATOM 4296 C CG . PRO A 1 237 ? 18.24531 26.46407 -10.34211 1.000 54.92194 ? 237 PRO A CG 1 ATOM 4297 C CD . PRO A 1 237 ? 19.11236 26.42149 -9.12650 1.000 51.21870 ? 237 PRO A CD 1 ATOM 4298 H HA . PRO A 1 237 ? 17.94519 29.26866 -8.96028 1.000 51.88571 ? 237 PRO A HA 1 ATOM 4299 H HB2 . PRO A 1 237 ? 16.96380 27.92380 -10.94739 1.000 57.95950 ? 237 PRO A HB2 1 ATOM 4300 H HB3 . PRO A 1 237 ? 18.47992 28.39943 -10.92416 1.000 57.95950 ? 237 PRO A HB3 1 ATOM 4301 H HG2 . PRO A 1 237 ? 17.47224 25.88835 -10.23340 1.000 65.90633 ? 237 PRO A HG2 1 ATOM 4302 H HG3 . PRO A 1 237 ? 18.74571 26.20218 -11.13072 1.000 65.90633 ? 237 PRO A HG3 1 ATOM 4303 H HD2 . PRO A 1 237 ? 19.07318 25.55023 -8.70191 1.000 61.46243 ? 237 PRO A HD2 1 ATOM 4304 H HD3 . PRO A 1 237 ? 20.03087 26.64221 -9.34674 1.000 61.46243 ? 237 PRO A HD3 1 ATOM 4305 N N . LEU A 1 238 ? 15.76266 27.24945 -7.86085 1.000 42.84215 ? 238 LEU A N 1 ATOM 4306 C CA . LEU A 1 238 ? 14.39612 27.18383 -7.35833 1.000 39.26358 ? 238 LEU A CA 1 ATOM 4307 C C . LEU A 1 238 ? 14.09118 28.30787 -6.37337 1.000 39.65557 ? 238 LEU A C 1 ATOM 4308 O O . LEU A 1 238 ? 12.91493 28.61992 -6.13757 1.000 39.61358 ? 238 LEU A O 1 ATOM 4309 C CB . LEU A 1 238 ? 14.16159 25.83335 -6.69296 1.000 43.83568 ? 238 LEU A CB 1 ATOM 4310 C CG . LEU A 1 238 ? 14.28387 24.60948 -7.60980 1.000 47.12740 ? 238 LEU A CG 1 ATOM 4311 C CD1 . LEU A 1 238 ? 14.04083 23.34421 -6.80985 1.000 53.63372 ? 238 LEU A CD1 1 ATOM 4312 C CD2 . LEU A 1 238 ? 13.33403 24.70953 -8.78306 1.000 49.94384 ? 238 LEU A CD2 1 ATOM 4313 H H . LEU A 1 238 ? 16.25050 26.57168 -7.65531 1.000 51.41058 ? 238 LEU A H 1 ATOM 4314 H HA . LEU A 1 238 ? 13.78086 27.26800 -8.10349 1.000 47.11630 ? 238 LEU A HA 1 ATOM 4315 H HB2 . LEU A 1 238 ? 14.81346 25.72776 -5.98246 1.000 52.60281 ? 238 LEU A HB2 1 ATOM 4316 H HB3 . LEU A 1 238 ? 13.26465 25.82862 -6.32367 1.000 52.60281 ? 238 LEU A HB3 1 ATOM 4317 H HG . LEU A 1 238 ? 15.18080 24.57051 -7.97709 1.000 56.55289 ? 238 LEU A HG 1 ATOM 4318 H HD11 . LEU A 1 238 ? 14.11881 22.57793 -7.39946 1.000 64.36046 ? 238 LEU A HD11 1 ATOM 4319 H HD12 . LEU A 1 238 ? 14.70199 23.28592 -6.10248 1.000 64.36046 ? 238 LEU A HD12 1 ATOM 4320 H HD13 . LEU A 1 238 ? 13.14987 23.37834 -6.42786 1.000 64.36046 ? 238 LEU A HD13 1 ATOM 4321 H HD21 . LEU A 1 238 ? 13.31323 23.85744 -9.24610 1.000 59.93261 ? 238 LEU A HD21 1 ATOM 4322 H HD22 . LEU A 1 238 ? 12.44821 24.92910 -8.45440 1.000 59.93261 ? 238 LEU A HD22 1 ATOM 4323 H HD23 . LEU A 1 238 ? 13.64581 25.40471 -9.38340 1.000 59.93261 ? 238 LEU A HD23 1 ATOM 4324 N N . ARG A 1 239 ? 15.12171 28.93421 -5.80890 1.000 39.80644 ? 239 ARG A N 1 ATOM 4325 C CA . ARG A 1 239 ? 14.90474 30.06021 -4.89952 1.000 40.95469 ? 239 ARG A CA 1 ATOM 4326 C C . ARG A 1 239 ? 14.19792 31.23040 -5.58292 1.000 42.35496 ? 239 ARG A C 1 ATOM 4327 O O . ARG A 1 239 ? 13.54302 32.03309 -4.90131 1.000 37.59271 ? 239 ARG A O 1 ATOM 4328 C CB . ARG A 1 239 ? 16.24927 30.51044 -4.31379 1.000 42.29043 ? 239 ARG A CB 1 ATOM 4329 C CG . ARG A 1 239 ? 16.16816 31.73508 -3.40288 1.000 41.92761 ? 239 ARG A CG 1 ATOM 4330 C CD . ARG A 1 239 ? 17.25314 31.71485 -2.31702 1.000 45.42517 ? 239 ARG A CD 1 ATOM 4331 N NE . ARG A 1 239 ? 16.88080 30.77506 -1.26871 1.000 42.41010 ? 239 ARG A NE 1 ATOM 4332 C CZ . ARG A 1 239 ? 17.33095 29.53055 -1.15791 1.000 43.53744 ? 239 ARG A CZ 1 ATOM 4333 N NH1 . ARG A 1 239 ? 18.40938 29.11887 -1.80297 1.000 46.48190 ? 239 ARG A NH1 1 ATOM 4334 N NH2 . ARG A 1 239 ? 16.65665 28.66551 -0.40971 1.000 46.34255 ? 239 ARG A NH2 1 ATOM 4335 H H . ARG A 1 239 ? 15.94793 28.73056 -5.93331 1.000 47.76773 ? 239 ARG A H 1 ATOM 4336 H HA . ARG A 1 239 ? 14.33894 29.77341 -4.16568 1.000 49.14562 ? 239 ARG A HA 1 ATOM 4337 H HB2 . ARG A 1 239 ? 16.61794 29.78107 -3.79129 1.000 50.74852 ? 239 ARG A HB2 1 ATOM 4338 H HB3 . ARG A 1 239 ? 16.84691 30.72935 -5.04578 1.000 50.74852 ? 239 ARG A HB3 1 ATOM 4339 H HG2 . ARG A 1 239 ? 16.28670 32.53753 -3.93479 1.000 50.31313 ? 239 ARG A HG2 1 ATOM 4340 H HG3 . ARG A 1 239 ? 15.30233 31.75163 -2.96587 1.000 50.31313 ? 239 ARG A HG3 1 ATOM 4341 H HD2 . ARG A 1 239 ? 18.09788 31.43446 -2.70264 1.000 54.51020 ? 239 ARG A HD2 1 ATOM 4342 H HD3 . ARG A 1 239 ? 17.34345 32.59844 -1.92713 1.000 54.51020 ? 239 ARG A HD3 1 ATOM 4343 H HE . ARG A 1 239 ? 16.32407 31.04823 -0.67286 1.000 50.89212 ? 239 ARG A HE 1 ATOM 4344 H HH11 . ARG A 1 239 ? 18.84004 29.66255 -2.31144 1.000 55.77828 ? 239 ARG A HH11 1 ATOM 4345 H HH12 . ARG A 1 239 ? 18.68009 28.30745 -1.71401 1.000 55.77828 ? 239 ARG A HH12 1 ATOM 4346 H HH21 . ARG A 1 239 ? 15.93950 28.91422 -0.00543 1.000 55.61106 ? 239 ARG A HH21 1 ATOM 4347 H HH22 . ARG A 1 239 ? 16.93703 27.85648 -0.32935 1.000 55.61106 ? 239 ARG A HH22 1 ATOM 4348 N N . VAL A 1 240 ? 14.29473 31.35526 -6.90796 1.000 40.47557 ? 240 VAL A N 1 ATOM 4349 C CA . VAL A 1 240 ? 13.68052 32.50509 -7.56515 1.000 40.21467 ? 240 VAL A CA 1 ATOM 4350 C C . VAL A 1 240 ? 12.63875 32.04312 -8.58162 1.000 42.03767 ? 240 VAL A C 1 ATOM 4351 O O . VAL A 1 240 ? 12.41706 32.70091 -9.59610 1.000 43.47110 ? 240 VAL A O 1 ATOM 4352 C CB . VAL A 1 240 ? 14.73779 33.41709 -8.22571 1.000 42.31142 ? 240 VAL A CB 1 ATOM 4353 C CG1 . VAL A 1 240 ? 15.55563 34.13395 -7.15201 1.000 47.85646 ? 240 VAL A CG1 1 ATOM 4354 C CG2 . VAL A 1 240 ? 15.65467 32.63721 -9.17947 1.000 45.69961 ? 240 VAL A CG2 1 ATOM 4355 H H . VAL A 1 240 ? 14.69853 30.80368 -7.42979 1.000 48.57068 ? 240 VAL A H 1 ATOM 4356 H HA . VAL A 1 240 ? 13.21732 33.02191 -6.88747 1.000 48.25760 ? 240 VAL A HA 1 ATOM 4357 H HB . VAL A 1 240 ? 14.27426 34.07963 -8.76152 1.000 50.77370 ? 240 VAL A HB 1 ATOM 4358 H HG11 . VAL A 1 240 ? 16.21021 34.70565 -7.58281 1.000 57.42776 ? 240 VAL A HG11 1 ATOM 4359 H HG12 . VAL A 1 240 ? 14.95900 34.66822 -6.60476 1.000 57.42776 ? 240 VAL A HG12 1 ATOM 4360 H HG13 . VAL A 1 240 ? 16.00468 33.47237 -6.60286 1.000 57.42776 ? 240 VAL A HG13 1 ATOM 4361 H HG21 . VAL A 1 240 ? 16.28841 33.25185 -9.58133 1.000 54.83953 ? 240 VAL A HG21 1 ATOM 4362 H HG22 . VAL A 1 240 ? 16.12792 31.95627 -8.67622 1.000 54.83953 ? 240 VAL A HG22 1 ATOM 4363 H HG23 . VAL A 1 240 ? 15.11331 32.22239 -9.86922 1.000 54.83953 ? 240 VAL A HG23 1 ATOM 4364 N N . LEU A 1 241 ? 11.94984 30.95330 -8.26943 1.000 38.75989 ? 241 LEU A N 1 ATOM 4365 C CA . LEU A 1 241 ? 10.82250 30.46259 -9.06225 1.000 40.53712 ? 241 LEU A CA 1 ATOM 4366 C C . LEU A 1 241 ? 9.53583 31.11579 -8.55645 1.000 39.15117 ? 241 LEU A C 1 ATOM 4367 O O . LEU A 1 241 ? 9.06512 30.81223 -7.45246 1.000 40.16703 ? 241 LEU A O 1 ATOM 4368 C CB . LEU A 1 241 ? 10.73839 28.94337 -8.96503 1.000 38.46683 ? 241 LEU A CB 1 ATOM 4369 C CG . LEU A 1 241 ? 9.55610 28.23023 -9.62991 1.000 39.37313 ? 241 LEU A CG 1 ATOM 4370 C CD1 . LEU A 1 241 ? 9.53220 28.58298 -11.08507 1.000 41.19196 ? 241 LEU A CD1 1 ATOM 4371 C CD2 . LEU A 1 241 ? 9.64664 26.72344 -9.45215 1.000 45.25530 ? 241 LEU A CD2 1 ATOM 4372 H H . LEU A 1 241 ? 12.11866 30.46372 -7.58284 1.000 46.51187 ? 241 LEU A H 1 ATOM 4373 H HA . LEU A 1 241 ? 10.94468 30.71365 -9.99119 1.000 48.64454 ? 241 LEU A HA 1 ATOM 4374 H HB2 . LEU A 1 241 ? 11.54216 28.57987 -9.36842 1.000 46.16019 ? 241 LEU A HB2 1 ATOM 4375 H HB3 . LEU A 1 241 ? 10.70600 28.71223 -8.02353 1.000 46.16019 ? 241 LEU A HB3 1 ATOM 4376 H HG . LEU A 1 241 ? 8.72938 28.51722 -9.21150 1.000 47.24775 ? 241 LEU A HG 1 ATOM 4377 H HD11 . LEU A 1 241 ? 8.85279 28.05083 -11.52790 1.000 49.43035 ? 241 LEU A HD11 1 ATOM 4378 H HD12 . LEU A 1 241 ? 9.32618 29.52629 -11.17800 1.000 49.43035 ? 241 LEU A HD12 1 ATOM 4379 H HD13 . LEU A 1 241 ? 10.40253 28.39501 -11.46992 1.000 49.43035 ? 241 LEU A HD13 1 ATOM 4380 H HD21 . LEU A 1 241 ? 8.87292 26.30961 -9.86566 1.000 54.30636 ? 241 LEU A HD21 1 ATOM 4381 H HD22 . LEU A 1 241 ? 10.45865 26.40372 -9.87562 1.000 54.30636 ? 241 LEU A HD22 1 ATOM 4382 H HD23 . LEU A 1 241 ? 9.66480 26.51778 -8.50438 1.000 54.30636 ? 241 LEU A HD23 1 ATOM 4383 N N . TYR A 1 242 ? 8.96532 31.99323 -9.37615 1.000 37.73355 ? 242 TYR A N 1 ATOM 4384 C CA . TYR A 1 242 ? 7.71020 32.67628 -9.11191 1.000 37.92336 ? 242 TYR A CA 1 ATOM 4385 C C . TYR A 1 242 ? 6.74884 32.43997 -10.27575 1.000 40.46472 ? 242 TYR A C 1 ATOM 4386 O O . TYR A 1 242 ? 7.16687 32.20485 -11.41550 1.000 37.93249 ? 242 TYR A O 1 ATOM 4387 C CB . TYR A 1 242 ? 7.92493 34.17181 -8.93279 1.000 38.68416 ? 242 TYR A CB 1 ATOM 4388 C CG . TYR A 1 242 ? 8.71841 34.55523 -7.70346 1.000 40.05844 ? 242 TYR A CG 1 ATOM 4389 C CD1 . TYR A 1 242 ? 10.10294 34.65798 -7.74617 1.000 42.84158 ? 242 TYR A CD1 1 ATOM 4390 C CD2 . TYR A 1 242 ? 8.07484 34.84081 -6.51124 1.000 43.16435 ? 242 TYR A CD2 1 ATOM 4391 C CE1 . TYR A 1 242 ? 10.83148 35.01651 -6.62657 1.000 46.40645 ? 242 TYR A CE1 1 ATOM 4392 C CE2 . TYR A 1 242 ? 8.79143 35.20470 -5.39560 1.000 40.78717 ? 242 TYR A CE2 1 ATOM 4393 C CZ . TYR A 1 242 ? 10.17022 35.28521 -5.45150 1.000 47.02816 ? 242 TYR A CZ 1 ATOM 4394 O OH . TYR A 1 242 ? 10.89999 35.64431 -4.32289 1.000 51.61362 ? 242 TYR A OH 1 ATOM 4395 H H . TYR A 1 242 ? 9.30718 32.21980 -10.13206 1.000 45.28026 ? 242 TYR A H 1 ATOM 4396 H HA . TYR A 1 242 ? 7.30963 32.32110 -8.30303 1.000 45.50803 ? 242 TYR A HA 1 ATOM 4397 H HB2 . TYR A 1 242 ? 8.40383 34.50894 -9.70603 1.000 46.42099 ? 242 TYR A HB2 1 ATOM 4398 H HB3 . TYR A 1 242 ? 7.05790 34.60160 -8.86620 1.000 46.42099 ? 242 TYR A HB3 1 ATOM 4399 H HD1 . TYR A 1 242 ? 10.54877 34.48226 -8.54320 1.000 51.40989 ? 242 TYR A HD1 1 ATOM 4400 H HD2 . TYR A 1 242 ? 7.14764 34.78590 -6.46453 1.000 51.79722 ? 242 TYR A HD2 1 ATOM 4401 H HE1 . TYR A 1 242 ? 11.75869 35.07521 -6.66813 1.000 55.68774 ? 242 TYR A HE1 1 ATOM 4402 H HE2 . TYR A 1 242 ? 8.34736 35.39712 -4.60145 1.000 48.94460 ? 242 TYR A HE2 1 ATOM 4403 H HH . TYR A 1 242 ? 10.38003 35.79640 -3.68094 1.000 61.93634 ? 242 TYR A HH 1 ATOM 4404 N N . SER A 1 243 ? 5.45476 32.52289 -9.97877 1.000 39.16368 ? 243 SER A N 1 ATOM 4405 C CA . SER A 1 243 ? 4.40779 32.29646 -10.96321 1.000 37.82291 ? 243 SER A CA 1 ATOM 4406 C C . SER A 1 243 ? 3.31050 33.33303 -10.80004 1.000 46.16507 ? 243 SER A C 1 ATOM 4407 O O . SER A 1 243 ? 3.11053 33.88115 -9.71717 1.000 41.41021 ? 243 SER A O 1 ATOM 4408 C CB . SER A 1 243 ? 3.79595 30.90221 -10.80624 1.000 41.48090 ? 243 SER A CB 1 ATOM 4409 O OG . SER A 1 243 ? 2.83584 30.62005 -11.81168 1.000 41.46241 ? 243 SER A OG 1 ATOM 4410 H H . SER A 1 243 ? 5.15392 32.71323 -9.19592 1.000 46.99642 ? 243 SER A H 1 ATOM 4411 H HA . SER A 1 243 ? 4.78491 32.38724 -11.85228 1.000 45.38750 ? 243 SER A HA 1 ATOM 4412 H HB2 . SER A 1 243 ? 4.50615 30.24389 -10.86227 1.000 49.77708 ? 243 SER A HB2 1 ATOM 4413 H HB3 . SER A 1 243 ? 3.36242 30.84962 -9.94010 1.000 49.77708 ? 243 SER A HB3 1 ATOM 4414 H HG . SER A 1 243 ? 2.17497 31.13203 -11.72963 1.000 49.75489 ? 243 SER A HG 1 ATOM 4415 N N . GLY A 1 244 ? 2.60044 33.58911 -11.89688 1.000 37.45790 ? 244 GLY A N 1 ATOM 4416 C CA . GLY A 1 244 ? 1.29967 34.21958 -11.85135 1.000 37.96273 ? 244 GLY A CA 1 ATOM 4417 C C . GLY A 1 244 ? 0.21673 33.18192 -12.10296 1.000 38.97905 ? 244 GLY A C 1 ATOM 4418 O O . GLY A 1 244 ? 0.48610 32.08802 -12.59477 1.000 40.48352 ? 244 GLY A O 1 ATOM 4419 H H . GLY A 1 244 ? 2.86297 33.40003 -12.69370 1.000 44.94948 ? 244 GLY A H 1 ATOM 4420 H HA2 . GLY A 1 244 ? 1.15682 34.62188 -10.98035 1.000 45.55528 ? 244 GLY A HA2 1 ATOM 4421 H HA3 . GLY A 1 244 ? 1.24180 34.90919 -12.53105 1.000 45.55528 ? 244 GLY A HA3 1 ATOM 4422 N N . ILE A 1 245 ? -1.01898 33.52934 -11.74102 1.000 33.61319 ? 245 ILE A N 1 ATOM 4423 C CA . ILE A 1 245 ? -2.17022 32.66279 -11.96912 1.000 32.99756 ? 245 ILE A CA 1 ATOM 4424 C C . ILE A 1 245 ? -3.35225 33.53263 -12.35130 1.000 34.72168 ? 245 ILE A C 1 ATOM 4425 O O . ILE A 1 245 ? -3.62252 34.54481 -11.69372 1.000 36.23736 ? 245 ILE A O 1 ATOM 4426 C CB . ILE A 1 245 ? -2.54108 31.81391 -10.73472 1.000 33.82875 ? 245 ILE A CB 1 ATOM 4427 C CG1 . ILE A 1 245 ? -1.37173 30.94482 -10.28511 1.000 37.72842 ? 245 ILE A CG1 1 ATOM 4428 C CG2 . ILE A 1 245 ? -3.74574 30.94029 -11.06118 1.000 38.84681 ? 245 ILE A CG2 1 ATOM 4429 C CD1 . ILE A 1 245 ? -1.63408 30.20846 -8.97385 1.000 43.59319 ? 245 ILE A CD1 1 ATOM 4430 H H . ILE A 1 245 ? -1.21580 34.27296 -11.35646 1.000 40.33582 ? 245 ILE A H 1 ATOM 4431 H HA . ILE A 1 245 ? -1.95593 32.06170 -12.69966 1.000 39.59707 ? 245 ILE A HA 1 ATOM 4432 H HB . ILE A 1 245 ? -2.75898 32.41750 -10.00733 1.000 40.59450 ? 245 ILE A HB 1 ATOM 4433 H HG12 . ILE A 1 245 ? -1.19371 30.28055 -10.96918 1.000 45.27410 ? 245 ILE A HG12 1 ATOM 4434 H HG13 . ILE A 1 245 ? -0.59244 31.50854 -10.15928 1.000 45.27410 ? 245 ILE A HG13 1 ATOM 4435 H HG21 . ILE A 1 245 ? -3.86987 30.29435 -10.34826 1.000 46.61617 ? 245 ILE A HG21 1 ATOM 4436 H HG22 . ILE A 1 245 ? -4.53215 31.50286 -11.13845 1.000 46.61617 ? 245 ILE A HG22 1 ATOM 4437 H HG23 . ILE A 1 245 ? -3.58432 30.48039 -11.89983 1.000 46.61617 ? 245 ILE A HG23 1 ATOM 4438 H HD11 . ILE A 1 245 ? -0.78910 29.90170 -8.60940 1.000 52.31183 ? 245 ILE A HD11 1 ATOM 4439 H HD12 . ILE A 1 245 ? -2.06203 30.81613 -8.35056 1.000 52.31183 ? 245 ILE A HD12 1 ATOM 4440 H HD13 . ILE A 1 245 ? -2.21391 29.45055 -9.14782 1.000 52.31183 ? 245 ILE A HD13 1 ATOM 4441 N N . GLY A 1 246 ? -4.04415 33.14198 -13.41134 1.000 33.40682 ? 246 GLY A N 1 ATOM 4442 C CA . GLY A 1 246 ? -5.27663 33.80397 -13.81116 1.000 34.42989 ? 246 GLY A CA 1 ATOM 4443 C C . GLY A 1 246 ? -6.37070 32.77365 -13.98518 1.000 38.22386 ? 246 GLY A C 1 ATOM 4444 O O . GLY A 1 246 ? -6.12605 31.67575 -14.47771 1.000 37.55206 ? 246 GLY A O 1 ATOM 4445 H H . GLY A 1 246 ? -3.81857 32.48798 -13.92222 1.000 40.08818 ? 246 GLY A H 1 ATOM 4446 H HA2 . GLY A 1 246 ? -5.54653 34.44207 -13.13228 1.000 41.31586 ? 246 GLY A HA2 1 ATOM 4447 H HA3 . GLY A 1 246 ? -5.14522 34.27233 -14.65037 1.000 41.31586 ? 246 GLY A HA3 1 ATOM 4448 N N . LEU A 1 247 ? -7.58978 33.13526 -13.54996 1.000 35.47730 ? 247 LEU A N 1 ATOM 4449 C CA . LEU A 1 247 ? -8.75696 32.26972 -13.69347 1.000 34.88334 ? 247 LEU A CA 1 ATOM 4450 C C . LEU A 1 247 ? -9.88842 33.02579 -14.37317 1.000 39.45557 ? 247 LEU A C 1 ATOM 4451 O O . LEU A 1 247 ? -10.12671 34.19581 -14.06347 1.000 37.93492 ? 247 LEU A O 1 ATOM 4452 C CB . LEU A 1 247 ? -9.29090 31.76162 -12.35027 1.000 36.14991 ? 247 LEU A CB 1 ATOM 4453 C CG . LEU A 1 247 ? -8.32799 31.20862 -11.30137 1.000 39.99043 ? 247 LEU A CG 1 ATOM 4454 C CD1 . LEU A 1 247 ? -9.07716 31.01746 -9.99359 1.000 41.47457 ? 247 LEU A CD1 1 ATOM 4455 C CD2 . LEU A 1 247 ? -7.73903 29.90835 -11.76476 1.000 40.11827 ? 247 LEU A CD2 1 ATOM 4456 H H . LEU A 1 247 ? -7.75981 33.88561 -13.16569 1.000 42.57276 ? 247 LEU A H 1 ATOM 4457 H HA . LEU A 1 247 ? -8.48702 31.51193 -14.23550 1.000 41.86000 ? 247 LEU A HA 1 ATOM 4458 H HB2 . LEU A 1 247 ? -9.75275 32.50247 -11.92749 1.000 43.37989 ? 247 LEU A HB2 1 ATOM 4459 H HB3 . LEU A 1 247 ? -9.91756 31.04690 -12.54361 1.000 43.37989 ? 247 LEU A HB3 1 ATOM 4460 H HG . LEU A 1 247 ? -7.59653 31.83001 -11.16089 1.000 47.98851 ? 247 LEU A HG 1 ATOM 4461 H HD11 . LEU A 1 247 ? -8.46978 30.65011 -9.33249 1.000 49.76949 ? 247 LEU A HD11 1 ATOM 4462 H HD12 . LEU A 1 247 ? -9.41262 31.87664 -9.69331 1.000 49.76949 ? 247 LEU A HD12 1 ATOM 4463 H HD13 . LEU A 1 247 ? -9.81624 30.40641 -10.13943 1.000 49.76949 ? 247 LEU A HD13 1 ATOM 4464 H HD21 . LEU A 1 247 ? -7.12377 29.58193 -11.08963 1.000 48.14193 ? 247 LEU A HD21 1 ATOM 4465 H HD22 . LEU A 1 247 ? -8.45461 29.26716 -11.89789 1.000 48.14193 ? 247 LEU A HD22 1 ATOM 4466 H HD23 . LEU A 1 247 ? -7.26690 30.05512 -12.59930 1.000 48.14193 ? 247 LEU A HD23 1 ATOM 4467 N N . ALA A 1 248 ? -10.60772 32.34420 -15.27109 1.000 36.68886 ? 248 ALA A N 1 ATOM 4468 C CA . ALA A 1 248 ? -11.78450 32.90760 -15.92360 1.000 37.35063 ? 248 ALA A CA 1 ATOM 4469 C C . ALA A 1 248 ? -12.82157 31.80640 -16.09538 1.000 41.52780 ? 248 ALA A C 1 ATOM 4470 O O . ALA A 1 248 ? -12.51059 30.61846 -16.01604 1.000 43.93015 ? 248 ALA A O 1 ATOM 4471 C CB . ALA A 1 248 ? -11.42288 33.53962 -17.28114 1.000 41.91377 ? 248 ALA A CB 1 ATOM 4472 H H . ALA A 1 248 ? -10.42793 31.54096 -15.52026 1.000 44.02663 ? 248 ALA A H 1 ATOM 4473 H HA . ALA A 1 248 ? -12.17464 33.60094 -15.36865 1.000 44.82075 ? 248 ALA A HA 1 ATOM 4474 H HB1 . ALA A 1 248 ? -12.22405 33.91631 -17.67755 1.000 50.29653 ? 248 ALA A HB1 1 ATOM 4475 H HB2 . ALA A 1 248 ? -10.76446 34.23763 -17.13915 1.000 50.29653 ? 248 ALA A HB2 1 ATOM 4476 H HB3 . ALA A 1 248 ? -11.05774 32.85360 -17.86162 1.000 50.29653 ? 248 ALA A HB3 1 ATOM 4477 N N . LYS A 1 249 ? -14.06623 32.20729 -16.33686 1.000 39.86705 ? 249 LYS A N 1 ATOM 4478 C CA A LYS A 1 249 ? -15.16981 31.27271 -16.49576 0.461 40.64658 ? 249 LYS A CA 1 ATOM 4479 C CA B LYS A 1 249 ? -15.16392 31.26800 -16.50081 0.539 40.62246 ? 249 LYS A CA 1 ATOM 4480 C C . LYS A 1 249 ? -15.92773 31.57379 -17.77852 1.000 44.69485 ? 249 LYS A C 1 ATOM 4481 O O . LYS A 1 249 ? -16.16423 32.73658 -18.11155 1.000 44.76852 ? 249 LYS A O 1 ATOM 4482 C CB A LYS A 1 249 ? -16.12011 31.34900 -15.29793 0.461 43.24676 ? 249 LYS A CB 1 ATOM 4483 C CB B LYS A 1 249 ? -16.12280 31.31748 -15.30838 0.539 43.23260 ? 249 LYS A CB 1 ATOM 4484 C CG A LYS A 1 249 ? -17.31071 30.42836 -15.39628 0.461 44.94111 ? 249 LYS A CG 1 ATOM 4485 C CG B LYS A 1 249 ? -17.25583 30.32451 -15.41209 0.539 44.93856 ? 249 LYS A CG 1 ATOM 4486 C CD A LYS A 1 249 ? -18.08900 30.42573 -14.09724 0.461 49.26918 ? 249 LYS A CD 1 ATOM 4487 C CD B LYS A 1 249 ? -18.23276 30.48391 -14.27371 0.539 49.78470 ? 249 LYS A CD 1 ATOM 4488 C CE A LYS A 1 249 ? -19.20125 29.39624 -14.12783 0.461 50.18115 ? 249 LYS A CE 1 ATOM 4489 C CE B LYS A 1 249 ? -19.42671 29.57137 -14.47122 0.539 49.30711 ? 249 LYS A CE 1 ATOM 4490 N NZ A LYS A 1 249 ? -20.45354 29.97593 -14.67886 0.461 51.87389 ? 249 LYS A NZ 1 ATOM 4491 N NZ B LYS A 1 249 ? -20.29576 29.53966 -13.27071 0.539 52.44064 ? 249 LYS A NZ 1 ATOM 4492 H H A LYS A 1 249 ? -14.29823 33.03181 -16.41395 0.461 47.84046 ? 249 LYS A H 1 ATOM 4493 H H B LYS A 1 249 ? -14.30032 33.03152 -16.41066 0.539 47.84046 ? 249 LYS A H 1 ATOM 4494 H HA A LYS A 1 249 ? -14.82360 30.36917 -16.56395 0.461 48.77589 ? 249 LYS A HA 1 ATOM 4495 H HA B LYS A 1 249 ? -14.80253 30.37069 -16.57250 0.539 48.74695 ? 249 LYS A HA 1 ATOM 4496 H HB2 A LYS A 1 249 ? -15.62880 31.11064 -14.49625 0.461 51.89611 ? 249 LYS A HB2 1 ATOM 4497 H HB2 B LYS A 1 249 ? -15.62665 31.12026 -14.49854 0.539 51.87913 ? 249 LYS A HB2 1 ATOM 4498 H HB3 A LYS A 1 249 ? -16.45471 32.25650 -15.22447 0.461 51.89611 ? 249 LYS A HB3 1 ATOM 4499 H HB3 B LYS A 1 249 ? -16.50881 32.20564 -15.25296 0.539 51.87913 ? 249 LYS A HB3 1 ATOM 4500 H HG2 A LYS A 1 249 ? -17.89733 30.73057 -16.10722 0.461 53.92933 ? 249 LYS A HG2 1 ATOM 4501 H HG2 B LYS A 1 249 ? -17.73212 30.46566 -16.24523 0.539 53.92627 ? 249 LYS A HG2 1 ATOM 4502 H HG3 A LYS A 1 249 ? -17.00854 29.52455 -15.57716 0.461 53.92933 ? 249 LYS A HG3 1 ATOM 4503 H HG3 B LYS A 1 249 ? -16.89769 29.42351 -15.38322 0.539 53.92627 ? 249 LYS A HG3 1 ATOM 4504 H HD2 A LYS A 1 249 ? -17.49193 30.20986 -13.36389 0.461 59.12302 ? 249 LYS A HD2 1 ATOM 4505 H HD2 B LYS A 1 249 ? -17.79957 30.25040 -13.43781 0.539 59.74165 ? 249 LYS A HD2 1 ATOM 4506 H HD3 A LYS A 1 249 ? -18.48473 31.30008 -13.95650 0.461 59.12302 ? 249 LYS A HD3 1 ATOM 4507 H HD3 B LYS A 1 249 ? -18.54643 31.40117 -14.23989 0.539 59.74165 ? 249 LYS A HD3 1 ATOM 4508 H HE2 A LYS A 1 249 ? -18.93555 28.65108 -14.68912 0.461 60.21738 ? 249 LYS A HE2 1 ATOM 4509 H HE2 B LYS A 1 249 ? -19.95385 29.89086 -15.22018 0.539 59.16853 ? 249 LYS A HE2 1 ATOM 4510 H HE3 A LYS A 1 249 ? -19.37812 29.08576 -13.22604 0.461 60.21738 ? 249 LYS A HE3 1 ATOM 4511 H HE3 B LYS A 1 249 ? -19.11535 28.66938 -14.64546 0.539 59.16853 ? 249 LYS A HE3 1 ATOM 4512 H HZ1 A LYS A 1 249 ? -21.09513 29.35922 -14.69037 0.461 62.24866 ? 249 LYS A HZ1 1 ATOM 4513 H HZ1 B LYS A 1 249 ? -20.60124 30.35679 -13.09438 0.539 62.92877 ? 249 LYS A HZ1 1 ATOM 4514 H HZ2 A LYS A 1 249 ? -20.71951 30.66005 -14.17554 0.461 62.24866 ? 249 LYS A HZ2 1 ATOM 4515 H HZ2 B LYS A 1 249 ? -19.83435 29.24606 -12.56857 0.539 62.92877 ? 249 LYS A HZ2 1 ATOM 4516 H HZ3 A LYS A 1 249 ? -20.31561 30.26477 -15.50930 0.461 62.24866 ? 249 LYS A HZ3 1 ATOM 4517 H HZ3 B LYS A 1 249 ? -20.98706 28.99661 -13.40961 0.539 62.92877 ? 249 LYS A HZ3 1 ATOM 4518 N N . GLY A 1 250 ? -16.31659 30.52703 -18.49124 1.000 41.84425 ? 250 GLY A N 1 ATOM 4519 C CA . GLY A 1 250 ? -17.14593 30.74867 -19.65955 1.000 45.09985 ? 250 GLY A CA 1 ATOM 4520 C C . GLY A 1 250 ? -17.45327 29.46118 -20.38530 1.000 44.97314 ? 250 GLY A C 1 ATOM 4521 O O . GLY A 1 250 ? -17.00592 28.37517 -20.00669 1.000 44.41753 ? 250 GLY A O 1 ATOM 4522 H H . GLY A 1 250 ? -16.11966 29.70679 -18.32384 1.000 50.21311 ? 250 GLY A H 1 ATOM 4523 H HA2 . GLY A 1 250 ? -17.98362 31.15607 -19.38898 1.000 54.11982 ? 250 GLY A HA2 1 ATOM 4524 H HA3 . GLY A 1 250 ? -16.68828 31.34497 -20.27265 1.000 54.11982 ? 250 GLY A HA3 1 ATOM 4525 N N . LYS A 1 251 ? -18.23898 29.60842 -21.44721 1.000 45.41291 ? 251 LYS A N 1 ATOM 4526 C CA . LYS A 1 251 ? -18.65329 28.47216 -22.26128 1.000 45.86914 ? 251 LYS A CA 1 ATOM 4527 C C . LYS A 1 251 ? -17.55115 28.16539 -23.26299 1.000 46.55831 ? 251 LYS A C 1 ATOM 4528 O O . LYS A 1 251 ? -17.15725 29.04342 -24.03760 1.000 50.46183 ? 251 LYS A O 1 ATOM 4529 C CB . LYS A 1 251 ? -19.96776 28.78378 -22.97311 1.000 49.70136 ? 251 LYS A CB 1 ATOM 4530 C CG . LYS A 1 251 ? -20.41206 27.73387 -23.98416 1.000 60.75981 ? 251 LYS A CG 1 ATOM 4531 C CD . LYS A 1 251 ? -21.28155 28.33868 -25.08769 1.000 107.14215 ? 251 LYS A CD 1 ATOM 4532 C CE . LYS A 1 251 ? -20.45287 28.79365 -26.28866 1.000 125.19438 ? 251 LYS A CE 1 ATOM 4533 N NZ . LYS A 1 251 ? -21.05287 28.36315 -27.58695 1.000 107.80865 ? 251 LYS A NZ 1 ATOM 4534 H H . LYS A 1 251 ? -18.54826 30.36334 -21.71932 1.000 54.49550 ? 251 LYS A H 1 ATOM 4535 H HA . LYS A 1 251 ? -18.79517 27.69270 -21.70163 1.000 55.04297 ? 251 LYS A HA 1 ATOM 4536 H HB2 . LYS A 1 251 ? -20.66795 28.86118 -22.30628 1.000 59.64163 ? 251 LYS A HB2 1 ATOM 4537 H HB3 . LYS A 1 251 ? -19.86851 29.62322 -23.44892 1.000 59.64163 ? 251 LYS A HB3 1 ATOM 4538 H HG2 . LYS A 1 251 ? -19.62972 27.33663 -24.39773 1.000 72.91177 ? 251 LYS A HG2 1 ATOM 4539 H HG3 . LYS A 1 251 ? -20.92993 27.05104 -23.52980 1.000 72.91177 ? 251 LYS A HG3 1 ATOM 4540 H HD2 . LYS A 1 251 ? -21.91721 27.67300 -25.39380 1.000 128.57057 ? 251 LYS A HD2 1 ATOM 4541 H HD3 . LYS A 1 251 ? -21.75264 29.11015 -24.73581 1.000 128.57057 ? 251 LYS A HD3 1 ATOM 4542 H HE2 . LYS A 1 251 ? -20.39743 29.76206 -26.28835 1.000 150.23326 ? 251 LYS A HE2 1 ATOM 4543 H HE3 . LYS A 1 251 ? -19.56402 28.41044 -26.22532 1.000 150.23326 ? 251 LYS A HE3 1 ATOM 4544 H HZ1 . LYS A 1 251 ? -20.54792 28.64434 -28.26375 1.000 129.37038 ? 251 LYS A HZ1 1 ATOM 4545 H HZ2 . LYS A 1 251 ? -21.10816 27.47538 -27.61722 1.000 129.37038 ? 251 LYS A HZ2 1 ATOM 4546 H HZ3 . LYS A 1 251 ? -21.86938 28.70652 -27.67365 1.000 129.37038 ? 251 LYS A HZ3 1 ATOM 4547 N N . VAL A 1 252 ? -17.06664 26.92431 -23.26949 1.000 41.80881 ? 252 VAL A N 1 ATOM 4548 C CA . VAL A 1 252 ? -16.00573 26.51137 -24.17714 1.000 40.13466 ? 252 VAL A CA 1 ATOM 4549 C C . VAL A 1 252 ? -16.45018 25.25101 -24.91100 1.000 45.07368 ? 252 VAL A C 1 ATOM 4550 O O . VAL A 1 252 ? -17.40615 24.57981 -24.52136 1.000 44.63544 ? 252 VAL A O 1 ATOM 4551 C CB . VAL A 1 252 ? -14.66449 26.27210 -23.44981 1.000 41.30097 ? 252 VAL A CB 1 ATOM 4552 C CG1 . VAL A 1 252 ? -14.18060 27.55983 -22.76040 1.000 46.20812 ? 252 VAL A CG1 1 ATOM 4553 C CG2 . VAL A 1 252 ? -14.76701 25.12074 -22.44050 1.000 42.36292 ? 252 VAL A CG2 1 ATOM 4554 H H . VAL A 1 252 ? -17.34222 26.29751 -22.74913 1.000 50.17057 ? 252 VAL A H 1 ATOM 4555 H HA . VAL A 1 252 ? -15.86539 27.20931 -24.83599 1.000 48.16159 ? 252 VAL A HA 1 ATOM 4556 H HB . VAL A 1 252 ? -14.00531 26.01698 -24.11411 1.000 49.56117 ? 252 VAL A HB 1 ATOM 4557 H HG11 . VAL A 1 252 ? -13.34140 27.37988 -22.30845 1.000 55.44975 ? 252 VAL A HG11 1 ATOM 4558 H HG12 . VAL A 1 252 ? -14.05387 28.24877 -23.43136 1.000 55.44975 ? 252 VAL A HG12 1 ATOM 4559 H HG13 . VAL A 1 252 ? -14.84862 27.84369 -22.11691 1.000 55.44975 ? 252 VAL A HG13 1 ATOM 4560 H HG21 . VAL A 1 252 ? -13.95426 25.09086 -21.91188 1.000 50.83551 ? 252 VAL A HG21 1 ATOM 4561 H HG22 . VAL A 1 252 ? -15.53150 25.27380 -21.86341 1.000 50.83551 ? 252 VAL A HG22 1 ATOM 4562 H HG23 . VAL A 1 252 ? -14.87858 24.28673 -22.92308 1.000 50.83551 ? 252 VAL A HG23 1 ATOM 4563 N N . ILE A 1 253 ? -15.76166 24.95268 -26.01288 1.000 39.15893 ? 253 ILE A N 1 ATOM 4564 C CA . ILE A 1 253 ? -15.98102 23.70612 -26.74043 1.000 38.63928 ? 253 ILE A CA 1 ATOM 4565 C C . ILE A 1 253 ? -14.98526 22.68343 -26.21115 1.000 41.02795 ? 253 ILE A C 1 ATOM 4566 O O . ILE A 1 253 ? -13.78776 22.96538 -26.11827 1.000 43.56605 ? 253 ILE A O 1 ATOM 4567 C CB . ILE A 1 253 ? -15.82659 23.90663 -28.25756 1.000 40.80588 ? 253 ILE A CB 1 ATOM 4568 C CG1 . ILE A 1 253 ? -16.91089 24.85064 -28.75489 1.000 46.95201 ? 253 ILE A CG1 1 ATOM 4569 C CG2 . ILE A 1 253 ? -15.97175 22.58450 -28.97472 1.000 45.19786 ? 253 ILE A CG2 1 ATOM 4570 C CD1 . ILE A 1 253 ? -16.68968 25.37465 -30.16288 1.000 55.03711 ? 253 ILE A CD1 1 ATOM 4571 H H . ILE A 1 253 ? -15.15948 25.45969 -26.35919 1.000 46.99072 ? 253 ILE A H 1 ATOM 4572 H HA . ILE A 1 253 ? -16.88217 23.38485 -26.58040 1.000 46.36714 ? 253 ILE A HA 1 ATOM 4573 H HB . ILE A 1 253 ? -14.94833 24.27904 -28.43327 1.000 48.96706 ? 253 ILE A HB 1 ATOM 4574 H HG12 . ILE A 1 253 ? -17.75866 24.37936 -28.74724 1.000 56.34241 ? 253 ILE A HG12 1 ATOM 4575 H HG13 . ILE A 1 253 ? -16.95135 25.61590 -28.16021 1.000 56.34241 ? 253 ILE A HG13 1 ATOM 4576 H HG21 . ILE A 1 253 ? -16.02143 22.74704 -29.92971 1.000 54.23743 ? 253 ILE A HG21 1 ATOM 4577 H HG22 . ILE A 1 253 ? -15.20198 22.02974 -28.77321 1.000 54.23743 ? 253 ILE A HG22 1 ATOM 4578 H HG23 . ILE A 1 253 ? -16.78284 22.14780 -28.67087 1.000 54.23743 ? 253 ILE A HG23 1 ATOM 4579 H HD11 . ILE A 1 253 ? -17.33168 26.07938 -30.34206 1.000 66.04453 ? 253 ILE A HD11 1 ATOM 4580 H HD12 . ILE A 1 253 ? -15.78735 25.72386 -30.23175 1.000 66.04453 ? 253 ILE A HD12 1 ATOM 4581 H HD13 . ILE A 1 253 ? -16.81202 24.64764 -30.79326 1.000 66.04453 ? 253 ILE A HD13 1 ATOM 4582 N N . GLU A 1 254 ? -15.47922 21.50800 -25.83415 1.000 39.48715 ? 254 GLU A N 1 ATOM 4583 C CA . GLU A 1 254 ? -14.64403 20.42213 -25.34082 1.000 40.79495 ? 254 GLU A CA 1 ATOM 4584 C C . GLU A 1 254 ? -14.75127 19.26671 -26.32260 1.000 45.69499 ? 254 GLU A C 1 ATOM 4585 O O . GLU A 1 254 ? -15.85740 18.81542 -26.63167 1.000 46.16066 ? 254 GLU A O 1 ATOM 4586 C CB . GLU A 1 254 ? -15.08072 19.98207 -23.94372 1.000 44.34137 ? 254 GLU A CB 1 ATOM 4587 C CG . GLU A 1 254 ? -14.20596 18.90099 -23.34148 1.000 44.49001 ? 254 GLU A CG 1 ATOM 4588 C CD . GLU A 1 254 ? -14.57128 18.60292 -21.90219 1.000 59.95220 ? 254 GLU A CD 1 ATOM 4589 O OE1 . GLU A 1 254 ? -15.72812 18.85196 -21.51968 1.000 55.44542 ? 254 GLU A OE1 1 ATOM 4590 O OE2 . GLU A 1 254 ? -13.68027 18.18580 -21.13972 1.000 59.80472 ? 254 GLU A OE2 1 ATOM 4591 H H . GLU A 1 254 ? -16.31647 21.31278 -25.85635 1.000 47.38458 ? 254 GLU A H 1 ATOM 4592 H HA . GLU A 1 254 ? -13.71796 20.70507 -25.28378 1.000 48.95394 ? 254 GLU A HA 1 ATOM 4593 H HB2 . GLU A 1 254 ? -15.05173 20.75004 -23.35188 1.000 53.20965 ? 254 GLU A HB2 1 ATOM 4594 H HB3 . GLU A 1 254 ? -15.98560 19.63638 -23.99456 1.000 53.20965 ? 254 GLU A HB3 1 ATOM 4595 H HG2 . GLU A 1 254 ? -14.31044 18.08466 -23.85490 1.000 53.38801 ? 254 GLU A HG2 1 ATOM 4596 H HG3 . GLU A 1 254 ? -13.28066 19.19117 -23.36436 1.000 53.38801 ? 254 GLU A HG3 1 ATOM 4597 N N . GLY A 1 255 ? -13.62193 18.79135 -26.82981 1.000 39.51152 ? 255 GLY A N 1 ATOM 4598 C CA . GLY A 1 255 ? -13.68198 17.66743 -27.74444 1.000 42.54030 ? 255 GLY A CA 1 ATOM 4599 C C . GLY A 1 255 ? -12.32134 17.36388 -28.33266 1.000 39.65152 ? 255 GLY A C 1 ATOM 4600 O O . GLY A 1 255 ? -11.30219 17.88822 -27.88708 1.000 37.87057 ? 255 GLY A O 1 ATOM 4601 H H . GLY A 1 255 ? -12.83406 19.09372 -26.66419 1.000 47.41383 ? 255 GLY A H 1 ATOM 4602 H HA2 . GLY A 1 255 ? -13.99832 16.88068 -27.27343 1.000 51.04836 ? 255 GLY A HA2 1 ATOM 4603 H HA3 . GLY A 1 255 ? -14.29457 17.86937 -28.46891 1.000 51.04836 ? 255 GLY A HA3 1 ATOM 4604 N N . ASN A 1 256 ? -12.32978 16.48885 -29.33423 1.000 39.37057 ? 256 ASN A N 1 ATOM 4605 C CA . ASN A 1 256 ? -11.11246 16.08019 -30.02320 1.000 40.64302 ? 256 ASN A CA 1 ATOM 4606 C C . ASN A 1 256 ? -10.79406 17.08216 -31.11849 1.000 39.84112 ? 256 ASN A C 1 ATOM 4607 O O . ASN A 1 256 ? -11.57253 17.24926 -32.06662 1.000 41.47701 ? 256 ASN A O 1 ATOM 4608 C CB . ASN A 1 256 ? -11.25615 14.68553 -30.62301 1.000 40.04066 ? 256 ASN A CB 1 ATOM 4609 C CG . ASN A 1 256 ? -11.28368 13.60214 -29.56536 1.000 43.04625 ? 256 ASN A CG 1 ATOM 4610 O OD1 . ASN A 1 256 ? -10.33430 13.43322 -28.79401 1.000 42.77508 ? 256 ASN A OD1 1 ATOM 4611 N ND2 . ASN A 1 256 ? -12.38998 12.88878 -29.49713 1.000 47.28629 ? 256 ASN A ND2 1 ATOM 4612 H H . ASN A 1 256 ? -13.04099 16.11209 -29.63728 1.000 47.24469 ? 256 ASN A H 1 ATOM 4613 H HA . ASN A 1 256 ? -10.38392 16.06484 -29.38297 1.000 48.77163 ? 256 ASN A HA 1 ATOM 4614 H HB2 . ASN A 1 256 ? -12.08572 14.63921 -31.12357 1.000 48.04879 ? 256 ASN A HB2 1 ATOM 4615 H HB3 . ASN A 1 256 ? -10.50393 14.51379 -31.21087 1.000 48.04879 ? 256 ASN A HB3 1 ATOM 4616 H HD21 . ASN A 1 256 ? -12.46086 12.25987 -28.91486 1.000 56.74355 ? 256 ASN A HD21 1 ATOM 4617 H HD22 . ASN A 1 256 ? -13.04089 13.05227 -30.03489 1.000 56.74355 ? 256 ASN A HD22 1 ATOM 4618 N N A ILE A 1 257 ? -9.62234 17.70754 -31.01864 0.580 38.09985 ? 257 ILE A N 1 ATOM 4619 N N B ILE A 1 257 ? -9.65555 17.74206 -30.98489 0.420 38.27569 ? 257 ILE A N 1 ATOM 4620 C CA A ILE A 1 257 ? -9.21551 18.80273 -31.89255 0.580 41.75095 ? 257 ILE A CA 1 ATOM 4621 C CA B ILE A 1 257 ? -9.21557 18.76443 -31.91736 0.420 41.75954 ? 257 ILE A CA 1 ATOM 4622 C C A ILE A 1 257 ? -7.80219 18.51982 -32.38546 0.580 41.44229 ? 257 ILE A C 1 ATOM 4623 C C B ILE A 1 257 ? -7.83621 18.36205 -32.41007 0.420 41.48475 ? 257 ILE A C 1 ATOM 4624 O O A ILE A 1 257 ? -6.88465 18.36085 -31.56987 0.580 43.51245 ? 257 ILE A O 1 ATOM 4625 O O B ILE A 1 257 ? -6.98718 17.93786 -31.61904 0.420 43.46631 ? 257 ILE A O 1 ATOM 4626 C CB A ILE A 1 257 ? -9.27143 20.15487 -31.15387 0.580 43.57424 ? 257 ILE A CB 1 ATOM 4627 C CB B ILE A 1 257 ? -9.18174 20.16121 -31.26293 0.420 43.48839 ? 257 ILE A CB 1 ATOM 4628 C CG1 A ILE A 1 257 ? -10.72998 20.52475 -30.83548 0.580 41.82912 ? 257 ILE A CG1 1 ATOM 4629 C CG1 B ILE A 1 257 ? -10.42139 20.39139 -30.38338 0.420 41.37654 ? 257 ILE A CG1 1 ATOM 4630 C CG2 A ILE A 1 257 ? -8.55386 21.22549 -31.95922 0.580 42.89980 ? 257 ILE A CG2 1 ATOM 4631 C CG2 B ILE A 1 257 ? -9.06381 21.22829 -32.33289 0.420 44.79639 ? 257 ILE A CG2 1 ATOM 4632 C CD1 A ILE A 1 257 ? -10.90350 21.31751 -29.55483 0.580 49.28605 ? 257 ILE A CD1 1 ATOM 4633 C CD1 B ILE A 1 257 ? -11.65574 20.82776 -31.13601 0.420 45.51208 ? 257 ILE A CD1 1 ATOM 4634 H H A ILE A 1 257 ? -9.02678 17.50705 -30.43152 0.580 45.71982 ? 257 ILE A H 1 ATOM 4635 H H B ILE A 1 257 ? -9.10234 17.61029 -30.33975 0.420 45.93083 ? 257 ILE A H 1 ATOM 4636 H HA A ILE A 1 257 ? -9.79980 18.83945 -32.66597 0.580 50.10114 ? 257 ILE A HA 1 ATOM 4637 H HA B ILE A 1 257 ? -9.82333 18.80982 -32.67200 0.420 50.11144 ? 257 ILE A HA 1 ATOM 4638 H HB A ILE A 1 257 ? -8.80650 20.07983 -30.30587 0.580 52.28909 ? 257 ILE A HB 1 ATOM 4639 H HB B ILE A 1 257 ? -8.40431 20.21150 -30.68504 0.420 52.18607 ? 257 ILE A HB 1 ATOM 4640 H HG12 A ILE A 1 257 ? -11.08010 21.06147 -31.56367 0.580 50.19495 ? 257 ILE A HG12 1 ATOM 4641 H HG12 B ILE A 1 257 ? -10.63478 19.56190 -29.92807 0.420 49.65185 ? 257 ILE A HG12 1 ATOM 4642 H HG13 A ILE A 1 257 ? -11.24536 19.70766 -30.74800 0.580 50.19495 ? 257 ILE A HG13 1 ATOM 4643 H HG13 B ILE A 1 257 ? -10.21520 21.08241 -29.73463 0.420 49.65185 ? 257 ILE A HG13 1 ATOM 4644 H HG21 A ILE A 1 257 ? -8.85790 22.09852 -31.66547 0.580 51.47976 ? 257 ILE A HG21 1 ATOM 4645 H HG21 B ILE A 1 257 ? -9.22154 22.09703 -31.93124 0.420 53.75566 ? 257 ILE A HG21 1 ATOM 4646 H HG22 A ILE A 1 257 ? -7.59833 21.14210 -31.81465 0.580 51.47976 ? 257 ILE A HG22 1 ATOM 4647 H HG22 B ILE A 1 257 ? -8.17212 21.19678 -32.71340 0.420 53.75566 ? 257 ILE A HG22 1 ATOM 4648 H HG23 A ILE A 1 257 ? -8.75804 21.10327 -32.89957 0.580 51.47976 ? 257 ILE A HG23 1 ATOM 4649 H HG23 B ILE A 1 257 ? -9.72406 21.05806 -33.02281 0.420 53.75566 ? 257 ILE A HG23 1 ATOM 4650 H HD11 A ILE A 1 257 ? -11.84364 21.52520 -29.43691 0.580 59.14326 ? 257 ILE A HD11 1 ATOM 4651 H HD11 B ILE A 1 257 ? -12.42869 20.73118 -30.55798 0.420 54.61450 ? 257 ILE A HD11 1 ATOM 4652 H HD12 A ILE A 1 257 ? -10.58618 20.78532 -28.80853 0.580 59.14326 ? 257 ILE A HD12 1 ATOM 4653 H HD12 B ILE A 1 257 ? -11.55349 21.75572 -31.39933 0.420 54.61450 ? 257 ILE A HD12 1 ATOM 4654 H HD13 A ILE A 1 257 ? -10.38911 22.13740 -29.61881 0.580 59.14326 ? 257 ILE A HD13 1 ATOM 4655 H HD13 B ILE A 1 257 ? -11.75943 20.27013 -31.92291 0.420 54.61450 ? 257 ILE A HD13 1 ATOM 4656 N N . GLY A 1 258 ? -7.62387 18.46831 -33.70303 1.000 40.89750 ? 258 GLY A N 1 ATOM 4657 C CA . GLY A 1 258 ? -6.31085 18.20843 -34.27231 1.000 43.60132 ? 258 GLY A CA 1 ATOM 4658 C C . GLY A 1 258 ? -6.40099 17.68141 -35.69262 1.000 42.87447 ? 258 GLY A C 1 ATOM 4659 O O . GLY A 1 258 ? -7.37454 17.91742 -36.40824 1.000 48.60816 ? 258 GLY A O 1 ATOM 4660 H H A GLY A 1 258 ? -8.24683 18.58045 -34.28522 0.580 49.07700 ? 258 GLY A H 1 ATOM 4661 H H B GLY A 1 258 ? -8.22310 18.69006 -34.27866 0.420 49.07700 ? 258 GLY A H 1 ATOM 4662 H HA2 . GLY A 1 258 ? -5.79460 19.02958 -34.28209 1.000 52.32158 ? 258 GLY A HA2 1 ATOM 4663 H HA3 . GLY A 1 258 ? -5.84791 17.55080 -33.72999 1.000 52.32158 ? 258 GLY A HA3 1 ATOM 4664 N N . SER A 1 259 ? -5.33670 16.99221 -36.09570 1.000 45.69250 ? 259 SER A N 1 ATOM 4665 C CA . SER A 1 259 ? -5.19639 16.44688 -37.43804 1.000 49.61479 ? 259 SER A CA 1 ATOM 4666 C C . SER A 1 259 ? -5.46768 14.94751 -37.43040 1.000 51.62948 ? 259 SER A C 1 ATOM 4667 O O . SER A 1 259 ? -5.62026 14.32392 -36.38150 1.000 49.97254 ? 259 SER A O 1 ATOM 4668 C CB . SER A 1 259 ? -3.78383 16.71024 -37.97446 1.000 51.44571 ? 259 SER A CB 1 ATOM 4669 O OG . SER A 1 259 ? -2.84059 15.94584 -37.22496 1.000 51.19126 ? 259 SER A OG 1 ATOM 4670 H H . SER A 1 259 ? -4.66131 16.82297 -35.59091 1.000 54.83101 ? 259 SER A H 1 ATOM 4671 H HA . SER A 1 259 ? -5.83875 16.87825 -38.02301 1.000 59.53774 ? 259 SER A HA 1 ATOM 4672 H HB2 . SER A 1 259 ? -3.74052 16.44853 -38.90748 1.000 61.73486 ? 259 SER A HB2 1 ATOM 4673 H HB3 . SER A 1 259 ? -3.57674 17.65361 -37.88456 1.000 61.73486 ? 259 SER A HB3 1 ATOM 4674 H HG . SER A 1 259 ? -2.06641 16.06894 -37.52679 1.000 61.42951 ? 259 SER A HG 1 ATOM 4675 N N . GLU A 1 260 ? -5.49460 14.35221 -38.62546 1.000 55.38422 ? 260 GLU A N 1 ATOM 4676 C CA . GLU A 1 260 ? -5.55091 12.89491 -38.68333 1.000 57.46005 ? 260 GLU A CA 1 ATOM 4677 C C . GLU A 1 260 ? -4.32462 12.27289 -38.02608 1.000 51.50900 ? 260 GLU A C 1 ATOM 4678 O O . GLU A 1 260 ? -4.38062 11.13681 -37.54452 1.000 65.85692 ? 260 GLU A O 1 ATOM 4679 C CB . GLU A 1 260 ? -5.65724 12.39833 -40.13088 1.000 61.76401 ? 260 GLU A CB 1 ATOM 4680 C CG . GLU A 1 260 ? -6.68186 13.10618 -40.98691 1.000 79.30215 ? 260 GLU A CG 1 ATOM 4681 C CD . GLU A 1 260 ? -6.07503 14.23556 -41.79137 1.000 88.73769 ? 260 GLU A CD 1 ATOM 4682 O OE1 . GLU A 1 260 ? -5.22045 14.96279 -41.23820 1.000 70.72090 ? 260 GLU A OE1 1 ATOM 4683 O OE2 . GLU A 1 260 ? -6.43767 14.38143 -42.97921 1.000 94.35858 ? 260 GLU A OE2 1 ATOM 4684 H H . GLU A 1 260 ? -5.48167 14.75427 -39.38558 1.000 66.46106 ? 260 GLU A H 1 ATOM 4685 H HA . GLU A 1 260 ? -6.34996 12.60836 -38.21396 1.000 68.95205 ? 260 GLU A HA 1 ATOM 4686 H HB2 . GLU A 1 260 ? -4.79404 12.51500 -40.55771 1.000 74.11681 ? 260 GLU A HB2 1 ATOM 4687 H HB3 . GLU A 1 260 ? -5.89473 11.45800 -40.11426 1.000 74.11681 ? 260 GLU A HB3 1 ATOM 4688 H HG2 . GLU A 1 260 ? -7.07277 12.47022 -41.60630 1.000 95.16258 ? 260 GLU A HG2 1 ATOM 4689 H HG3 . GLU A 1 260 ? -7.37106 13.47896 -40.41513 1.000 95.16258 ? 260 GLU A HG3 1 ATOM 4690 N N . LEU A 1 261 ? -3.21246 13.00556 -37.99990 1.000 55.44736 ? 261 LEU A N 1 ATOM 4691 C CA . LEU A 1 261 ? -1.95389 12.48289 -37.48830 1.000 59.01273 ? 261 LEU A CA 1 ATOM 4692 C C . LEU A 1 261 ? -1.93087 12.49664 -35.96443 1.000 61.96512 ? 261 LEU A C 1 ATOM 4693 O O . LEU A 1 261 ? -1.43101 11.55803 -35.33052 1.000 55.36616 ? 261 LEU A O 1 ATOM 4694 C CB . LEU A 1 261 ? -0.80588 13.32516 -38.04134 1.000 65.30662 ? 261 LEU A CB 1 ATOM 4695 C CG . LEU A 1 261 ? -0.04199 12.89454 -39.29936 1.000 79.55829 ? 261 LEU A CG 1 ATOM 4696 C CD1 . LEU A 1 261 ? 1.37035 13.49676 -39.25400 1.000 75.12273 ? 261 LEU A CD1 1 ATOM 4697 C CD2 . LEU A 1 261 ? 0.02093 11.38034 -39.48981 1.000 73.27601 ? 261 LEU A CD2 1 ATOM 4698 H H . LEU A 1 261 ? -3.16142 13.81827 -38.27647 1.000 66.53683 ? 261 LEU A H 1 ATOM 4699 H HA . LEU A 1 261 ? -1.83771 11.56560 -37.78152 1.000 70.81527 ? 261 LEU A HA 1 ATOM 4700 H HB2 . LEU A 1 261 ? -1.16953 14.20231 -38.23955 1.000 78.36795 ? 261 LEU A HB2 1 ATOM 4701 H HB3 . LEU A 1 261 ? -0.14127 13.39274 -37.33805 1.000 78.36795 ? 261 LEU A HB3 1 ATOM 4702 H HG . LEU A 1 261 ? -0.52412 13.22718 -40.07253 1.000 95.46995 ? 261 LEU A HG 1 ATOM 4703 H HD11 . LEU A 1 261 ? 1.85745 13.21955 -40.04571 1.000 90.14728 ? 261 LEU A HD11 1 ATOM 4704 H HD12 . LEU A 1 261 ? 1.30064 14.46396 -39.23029 1.000 90.14728 ? 261 LEU A HD12 1 ATOM 4705 H HD13 . LEU A 1 261 ? 1.82408 13.17821 -38.45804 1.000 90.14728 ? 261 LEU A HD13 1 ATOM 4706 H HD21 . LEU A 1 261 ? 0.52464 11.18400 -40.29519 1.000 87.93122 ? 261 LEU A HD21 1 ATOM 4707 H HD22 . LEU A 1 261 ? 0.45882 10.98324 -38.72074 1.000 87.93122 ? 261 LEU A HD22 1 ATOM 4708 H HD23 . LEU A 1 261 ? -0.88165 11.03457 -39.57163 1.000 87.93122 ? 261 LEU A HD23 1 ATOM 4709 N N . LYS A 1 262 ? -2.47861 13.54556 -35.35928 1.000 47.79008 ? 262 LYS A N 1 ATOM 4710 C CA . LYS A 1 262 ? -2.38678 13.71818 -33.92223 1.000 42.83619 ? 262 LYS A CA 1 ATOM 4711 C C . LYS A 1 262 ? -3.52527 14.61305 -33.46711 1.000 46.97513 ? 262 LYS A C 1 ATOM 4712 O O . LYS A 1 262 ? -3.73912 15.68190 -34.04318 1.000 44.36406 ? 262 LYS A O 1 ATOM 4713 C CB . LYS A 1 262 ? -1.04409 14.33109 -33.53118 1.000 48.35321 ? 262 LYS A CB 1 ATOM 4714 C CG . LYS A 1 262 ? -0.78775 14.30970 -32.03859 1.000 55.68432 ? 262 LYS A CG 1 ATOM 4715 C CD . LYS A 1 262 ? -0.88504 15.70258 -31.46305 1.000 56.28082 ? 262 LYS A CD 1 ATOM 4716 C CE . LYS A 1 262 ? -0.33313 15.77425 -30.04763 1.000 62.30407 ? 262 LYS A CE 1 ATOM 4717 N NZ . LYS A 1 262 ? -1.36900 15.45780 -29.04112 1.000 61.81814 ? 262 LYS A NZ 1 ATOM 4718 H H . LYS A 1 262 ? -2.90916 14.17077 -35.76343 1.000 57.34810 ? 262 LYS A H 1 ATOM 4719 H HA . LYS A 1 262 ? -2.47422 12.85748 -33.48355 1.000 51.40343 ? 262 LYS A HA 1 ATOM 4720 H HB2 . LYS A 1 262 ? -0.33363 13.83126 -33.96284 1.000 58.02386 ? 262 LYS A HB2 1 ATOM 4721 H HB3 . LYS A 1 262 ? -1.02434 15.25569 -33.82380 1.000 58.02386 ? 262 LYS A HB3 1 ATOM 4722 H HG2 . LYS A 1 262 ? -1.44900 13.74903 -31.60350 1.000 66.82118 ? 262 LYS A HG2 1 ATOM 4723 H HG3 . LYS A 1 262 ? 0.10303 13.96629 -31.86692 1.000 66.82118 ? 262 LYS A HG3 1 ATOM 4724 H HD2 . LYS A 1 262 ? -0.37558 16.31371 -32.01791 1.000 67.53698 ? 262 LYS A HD2 1 ATOM 4725 H HD3 . LYS A 1 262 ? -1.81601 15.97390 -31.43904 1.000 67.53698 ? 262 LYS A HD3 1 ATOM 4726 H HE2 . LYS A 1 262 ? 0.38929 15.13397 -29.95252 1.000 74.76488 ? 262 LYS A HE2 1 ATOM 4727 H HE3 . LYS A 1 262 ? -0.00615 16.67124 -29.87617 1.000 74.76488 ? 262 LYS A HE3 1 ATOM 4728 H HZ1 . LYS A 1 262 ? -1.09206 15.70334 -28.23173 1.000 74.18176 ? 262 LYS A HZ1 1 ATOM 4729 H HZ2 . LYS A 1 262 ? -2.12212 15.89164 -29.23264 1.000 74.18176 ? 262 LYS A HZ2 1 ATOM 4730 H HZ3 . LYS A 1 262 ? -1.53258 14.58297 -29.03735 1.000 74.18176 ? 262 LYS A HZ3 1 ATOM 4731 N N . ARG A 1 263 ? -4.25734 14.18061 -32.45156 1.000 44.40532 ? 263 ARG A N 1 ATOM 4732 C CA A ARG A 1 263 ? -5.35140 14.93503 -31.85846 0.497 43.40926 ? 263 ARG A CA 1 ATOM 4733 C CA B ARG A 1 263 ? -5.26446 15.05369 -31.87675 0.503 43.54612 ? 263 ARG A CA 1 ATOM 4734 C C . ARG A 1 263 ? -5.10343 15.14649 -30.36951 1.000 44.43235 ? 263 ARG A C 1 ATOM 4735 O O . ARG A 1 263 ? -4.34176 14.40982 -29.73952 1.000 41.79006 ? 263 ARG A O 1 ATOM 4736 C CB A ARG A 1 263 ? -6.69170 14.21170 -32.06104 0.497 49.19066 ? 263 ARG A CB 1 ATOM 4737 C CB B ARG A 1 263 ? -6.68275 14.61059 -32.24471 0.503 50.39737 ? 263 ARG A CB 1 ATOM 4738 C CG A ARG A 1 263 ? -7.39965 14.57495 -33.36365 0.497 50.55627 ? 263 ARG A CG 1 ATOM 4739 C CG B ARG A 1 263 ? -7.14775 13.33098 -31.61811 0.503 50.60348 ? 263 ARG A CG 1 ATOM 4740 C CD A ARG A 1 263 ? -8.21241 13.41957 -33.91838 0.497 56.79820 ? 263 ARG A CD 1 ATOM 4741 C CD B ARG A 1 263 ? -8.22040 12.68338 -32.48944 0.503 53.84823 ? 263 ARG A CD 1 ATOM 4742 N NE A ARG A 1 263 ? -8.34678 13.52388 -35.36668 0.497 61.50010 ? 263 ARG A NE 1 ATOM 4743 N NE B ARG A 1 263 ? -7.71166 12.23756 -33.78208 0.503 60.19428 ? 263 ARG A NE 1 ATOM 4744 C CZ A ARG A 1 263 ? -8.97597 14.51216 -35.98986 0.497 60.52839 ? 263 ARG A CZ 1 ATOM 4745 C CZ B ARG A 1 263 ? -8.44647 11.63415 -34.70943 0.503 58.50551 ? 263 ARG A CZ 1 ATOM 4746 N NH1 A ARG A 1 263 ? -9.60958 15.45914 -35.31909 0.497 60.90811 ? 263 ARG A NH1 1 ATOM 4747 N NH1 B ARG A 1 263 ? -9.72537 11.35924 -34.50858 0.503 62.00394 ? 263 ARG A NH1 1 ATOM 4748 N NH2 A ARG A 1 263 ? -8.96827 14.55112 -37.31901 0.497 60.70242 ? 263 ARG A NH2 1 ATOM 4749 N NH2 B ARG A 1 263 ? -7.88344 11.29617 -35.86579 0.503 64.28990 ? 263 ARG A NH2 1 ATOM 4750 H H A ARG A 1 263 ? -4.13429 13.41901 -32.07153 0.497 53.28638 ? 263 ARG A H 1 ATOM 4751 H H B ARG A 1 263 ? -4.18975 13.40416 -32.08802 0.503 53.28638 ? 263 ARG A H 1 ATOM 4752 H HA A ARG A 1 263 ? -5.40167 15.80716 -32.28008 0.497 52.09112 ? 263 ARG A HA 1 ATOM 4753 H HA B ARG A 1 263 ? -5.13200 15.94816 -32.22785 0.503 52.25534 ? 263 ARG A HA 1 ATOM 4754 H HB2 A ARG A 1 263 ? -6.53108 13.25512 -32.06876 0.497 59.02879 ? 263 ARG A HB2 1 ATOM 4755 H HB2 B ARG A 1 263 ? -7.29983 15.30655 -31.96949 0.503 60.47684 ? 263 ARG A HB2 1 ATOM 4756 H HB3 A ARG A 1 263 ? -7.28393 14.44276 -31.32840 0.497 59.02879 ? 263 ARG A HB3 1 ATOM 4757 H HB3 B ARG A 1 263 ? -6.72433 14.49168 -33.20650 0.503 60.47684 ? 263 ARG A HB3 1 ATOM 4758 H HG2 A ARG A 1 263 ? -8.00248 15.31749 -33.20196 0.497 60.66753 ? 263 ARG A HG2 1 ATOM 4759 H HG2 B ARG A 1 263 ? -6.40131 12.71705 -31.53557 0.503 60.72418 ? 263 ARG A HG2 1 ATOM 4760 H HG3 A ARG A 1 263 ? -6.73734 14.82376 -34.02723 0.497 60.66753 ? 263 ARG A HG3 1 ATOM 4761 H HG3 B ARG A 1 263 ? -7.52551 13.51343 -30.74352 0.503 60.72418 ? 263 ARG A HG3 1 ATOM 4762 H HD2 A ARG A 1 263 ? -7.76807 12.58276 -33.71048 0.497 68.15784 ? 263 ARG A HD2 1 ATOM 4763 H HD2 B ARG A 1 263 ? -8.57839 11.90989 -32.02634 0.503 64.61788 ? 263 ARG A HD2 1 ATOM 4764 H HD3 A ARG A 1 263 ? -9.09939 13.43066 -33.52590 0.497 68.15784 ? 263 ARG A HD3 1 ATOM 4765 H HD3 B ARG A 1 263 ? -8.92622 13.32847 -32.65248 0.503 64.61788 ? 263 ARG A HD3 1 ATOM 4766 H HE A ARG A 1 263 ? -7.99522 12.90432 -35.84851 0.497 73.80012 ? 263 ARG A HE 1 ATOM 4767 H HE B ARG A 1 263 ? -6.88048 12.37464 -33.95515 0.503 72.23313 ? 263 ARG A HE 1 ATOM 4768 H HH11 A ARG A 1 263 ? -9.62016 15.44341 -34.45930 0.497 73.08973 ? 263 ARG A HH11 1 ATOM 4769 H HH11 B ARG A 1 263 ? -10.09912 11.57198 -33.76383 0.503 74.40473 ? 263 ARG A HH11 1 ATOM 4770 H HH12 A ARG A 1 263 ? -10.01112 16.09081 -35.74258 0.497 73.08973 ? 263 ARG A HH12 1 ATOM 4771 H HH12 B ARG A 1 263 ? -10.18267 10.96785 -35.12282 0.503 74.40473 ? 263 ARG A HH12 1 ATOM 4772 H HH21 A ARG A 1 263 ? -8.55866 13.94025 -37.76473 0.497 72.84290 ? 263 ARG A HH21 1 ATOM 4773 H HH21 B ARG A 1 263 ? -7.05272 11.46871 -36.00624 0.503 77.14788 ? 263 ARG A HH21 1 ATOM 4774 H HH22 A ARG A 1 263 ? -9.37290 15.18717 -37.73290 0.497 72.84290 ? 263 ARG A HH22 1 ATOM 4775 H HH22 B ARG A 1 263 ? -8.35005 10.90507 -36.47317 0.503 77.14788 ? 263 ARG A HH22 1 ATOM 4776 N N A ASP A 1 264 ? -5.80908 16.13284 -29.81736 0.276 38.03267 ? 264 ASP A N 1 ATOM 4777 N N B ASP A 1 264 ? -5.75487 16.16824 -29.82257 0.724 37.58744 ? 264 ASP A N 1 ATOM 4778 C CA A ASP A 1 264 ? -5.80321 16.44493 -28.39671 0.276 41.21057 ? 264 ASP A CA 1 ATOM 4779 C CA B ASP A 1 264 ? -5.83107 16.42645 -28.40002 0.724 41.16357 ? 264 ASP A CA 1 ATOM 4780 C C A ASP A 1 264 ? -7.24424 16.54793 -27.92183 0.276 40.18192 ? 264 ASP A C 1 ATOM 4781 C C B ASP A 1 264 ? -7.29674 16.37215 -28.00416 0.724 39.93689 ? 264 ASP A C 1 ATOM 4782 O O A ASP A 1 264 ? -8.06342 17.20626 -28.57285 0.276 41.51534 ? 264 ASP A O 1 ATOM 4783 O O B ASP A 1 264 ? -8.17376 16.74842 -28.79163 0.724 41.93405 ? 264 ASP A O 1 ATOM 4784 C CB A ASP A 1 264 ? -5.08646 17.76842 -28.11437 0.276 45.85729 ? 264 ASP A CB 1 ATOM 4785 C CB B ASP A 1 264 ? -5.29669 17.81670 -27.99840 0.724 46.76237 ? 264 ASP A CB 1 ATOM 4786 C CG A ASP A 1 264 ? -3.58801 17.65747 -28.22932 0.276 43.91317 ? 264 ASP A CG 1 ATOM 4787 C CG B ASP A 1 264 ? -3.88418 18.07456 -28.46023 0.724 42.34929 ? 264 ASP A CG 1 ATOM 4788 O OD1 A ASP A 1 264 ? -2.98911 16.86343 -27.47453 0.276 43.58841 ? 264 ASP A OD1 1 ATOM 4789 O OD1 B ASP A 1 264 ? -3.05969 17.13351 -28.45838 0.724 44.53490 ? 264 ASP A OD1 1 ATOM 4790 O OD2 A ASP A 1 264 ? -3.00983 18.37203 -29.07384 0.276 45.15556 ? 264 ASP A OD2 1 ATOM 4791 O OD2 B ASP A 1 264 ? -3.59241 19.24876 -28.77866 0.724 39.10303 ? 264 ASP A OD2 1 ATOM 4792 H H A ASP A 1 264 ? -6.32057 16.65636 -30.26892 0.276 45.63920 ? 264 ASP A H 1 ATOM 4793 H H B ASP A 1 264 ? -6.18187 16.75415 -30.28515 0.724 45.10493 ? 264 ASP A H 1 ATOM 4794 H HA A ASP A 1 264 ? -5.34849 15.73729 -27.91363 0.276 49.45268 ? 264 ASP A HA 1 ATOM 4795 H HA B ASP A 1 264 ? -5.29959 15.76284 -27.93308 0.724 49.39629 ? 264 ASP A HA 1 ATOM 4796 H HB2 A ASP A 1 264 ? -5.38764 18.43331 -28.75320 0.276 55.02874 ? 264 ASP A HB2 1 ATOM 4797 H HB2 B ASP A 1 264 ? -5.86614 18.49663 -28.39124 0.724 56.11484 ? 264 ASP A HB2 1 ATOM 4798 H HB3 A ASP A 1 264 ? -5.29739 18.05569 -27.21221 0.276 55.02874 ? 264 ASP A HB3 1 ATOM 4799 H HB3 B ASP A 1 264 ? -5.31082 17.89032 -27.03130 0.724 56.11484 ? 264 ASP A HB3 1 ATOM 4800 N N . TYR A 1 265 ? -7.55327 15.90956 -26.80100 1.000 39.67400 ? 265 TYR A N 1 ATOM 4801 C CA . TYR A 1 265 ? -8.86074 16.04509 -26.17015 1.000 37.50464 ? 265 TYR A CA 1 ATOM 4802 C C . TYR A 1 265 ? -8.73084 17.26271 -25.26288 1.000 38.32936 ? 265 TYR A C 1 ATOM 4803 O O . TYR A 1 265 ? -8.01418 17.20928 -24.25988 1.000 41.33497 ? 265 TYR A O 1 ATOM 4804 C CB . TYR A 1 265 ? -9.25707 14.79773 -25.40005 1.000 42.37202 ? 265 TYR A CB 1 ATOM 4805 C CG . TYR A 1 265 ? -10.68049 14.88889 -24.92095 1.000 42.33150 ? 265 TYR A CG 1 ATOM 4806 C CD1 . TYR A 1 265 ? -11.73398 14.52554 -25.73734 1.000 49.23206 ? 265 TYR A CD1 1 ATOM 4807 C CD2 . TYR A 1 265 ? -10.96919 15.39807 -23.66456 1.000 43.69204 ? 265 TYR A CD2 1 ATOM 4808 C CE1 . TYR A 1 265 ? -13.04639 14.63628 -25.30058 1.000 54.20971 ? 265 TYR A CE1 1 ATOM 4809 C CE2 . TYR A 1 265 ? -12.27592 15.50666 -23.21467 1.000 51.10278 ? 265 TYR A CE2 1 ATOM 4810 C CZ . TYR A 1 265 ? -13.30741 15.12877 -24.03919 1.000 52.83871 ? 265 TYR A CZ 1 ATOM 4811 O OH . TYR A 1 265 ? -14.60887 15.24388 -23.60078 1.000 57.61216 ? 265 TYR A OH 1 ATOM 4812 H H A TYR A 1 265 ? -7.01638 15.38532 -26.38085 0.276 47.60881 ? 265 TYR A H 1 ATOM 4813 H H B TYR A 1 265 ? -6.97564 15.50158 -26.31162 0.724 47.60881 ? 265 TYR A H 1 ATOM 4814 H HA . TYR A 1 265 ? -9.55970 16.17701 -26.82965 1.000 45.00557 ? 265 TYR A HA 1 ATOM 4815 H HB2 . TYR A 1 265 ? -9.17594 14.02277 -25.97777 1.000 50.84642 ? 265 TYR A HB2 1 ATOM 4816 H HB3 . TYR A 1 265 ? -8.67838 14.69801 -24.62799 1.000 50.84642 ? 265 TYR A HB3 1 ATOM 4817 H HD1 . TYR A 1 265 ? -11.56112 14.20204 -26.59195 1.000 59.07848 ? 265 TYR A HD1 1 ATOM 4818 H HD2 . TYR A 1 265 ? -10.27269 15.67221 -23.11262 1.000 52.43045 ? 265 TYR A HD2 1 ATOM 4819 H HE1 . TYR A 1 265 ? -13.74677 14.37955 -25.85597 1.000 65.05166 ? 265 TYR A HE1 1 ATOM 4820 H HE2 . TYR A 1 265 ? -12.45266 15.83262 -22.36179 1.000 61.32334 ? 265 TYR A HE2 1 ATOM 4821 H HH . TYR A 1 265 ? -14.62342 15.56808 -22.82599 1.000 69.13459 ? 265 TYR A HH 1 ATOM 4822 N N . THR A 1 266 ? -9.35552 18.37726 -25.63981 1.000 37.68033 ? 266 THR A N 1 ATOM 4823 C CA . THR A 1 266 ? -9.05234 19.64451 -24.96671 1.000 39.13444 ? 266 THR A CA 1 ATOM 4824 C C . THR A 1 266 ? -10.20842 20.62510 -25.16075 1.000 43.75174 ? 266 THR A C 1 ATOM 4825 O O . THR A 1 266 ? -11.29793 20.24548 -25.60091 1.000 40.48562 ? 266 THR A O 1 ATOM 4826 C CB . THR A 1 266 ? -7.70811 20.18709 -25.48090 1.000 39.29729 ? 266 THR A CB 1 ATOM 4827 O OG1 . THR A 1 266 ? -7.24472 21.23977 -24.62129 1.000 41.10734 ? 266 THR A OG1 1 ATOM 4828 C CG2 . THR A 1 266 ? -7.81181 20.70073 -26.89723 1.000 42.40274 ? 266 THR A CG2 1 ATOM 4829 H H . THR A 1 266 ? -9.94337 18.42593 -26.26564 1.000 45.21640 ? 266 THR A H 1 ATOM 4830 H HA . THR A 1 266 ? -8.99161 19.48780 -24.01138 1.000 46.96133 ? 266 THR A HA 1 ATOM 4831 H HB . THR A 1 266 ? -7.06523 19.46074 -25.48219 1.000 47.15675 ? 266 THR A HB 1 ATOM 4832 H HG1 . THR A 1 266 ? -7.10568 20.93986 -23.84907 1.000 49.32881 ? 266 THR A HG1 1 ATOM 4833 H HG21 . THR A 1 266 ? -6.92591 20.86785 -27.25522 1.000 50.88329 ? 266 THR A HG21 1 ATOM 4834 H HG22 . THR A 1 266 ? -8.25863 20.04559 -27.45584 1.000 50.88329 ? 266 THR A HG22 1 ATOM 4835 H HG23 . THR A 1 266 ? -8.31922 21.52725 -26.91408 1.000 50.88329 ? 266 THR A HG23 1 ATOM 4836 N N . ILE A 1 267 ? -9.98814 21.89293 -24.79303 1.000 37.09759 ? 267 ILE A N 1 ATOM 4837 C CA . ILE A 1 267 ? -11.03767 22.90205 -24.86421 1.000 36.77047 ? 267 ILE A CA 1 ATOM 4838 C C . ILE A 1 267 ? -10.60578 24.04511 -25.77110 1.000 41.28547 ? 267 ILE A C 1 ATOM 4839 O O . ILE A 1 267 ? -9.41936 24.29656 -25.99009 1.000 42.86202 ? 267 ILE A O 1 ATOM 4840 C CB . ILE A 1 267 ? -11.44939 23.46028 -23.47481 1.000 35.67111 ? 267 ILE A CB 1 ATOM 4841 C CG1 . ILE A 1 267 ? -10.23502 24.05464 -22.75128 1.000 40.45888 ? 267 ILE A CG1 1 ATOM 4842 C CG2 . ILE A 1 267 ? -12.13501 22.39906 -22.63367 1.000 40.65466 ? 267 ILE A CG2 1 ATOM 4843 C CD1 . ILE A 1 267 ? -10.61828 24.86514 -21.52511 1.000 44.92627 ? 267 ILE A CD1 1 ATOM 4844 H H . ILE A 1 267 ? -9.23566 22.18791 -24.49915 1.000 44.51710 ? 267 ILE A H 1 ATOM 4845 H HA . ILE A 1 267 ? -11.81183 22.47627 -25.26458 1.000 44.12456 ? 267 ILE A HA 1 ATOM 4846 H HB . ILE A 1 267 ? -12.09138 24.17333 -23.61735 1.000 42.80534 ? 267 ILE A HB 1 ATOM 4847 H HG12 . ILE A 1 267 ? -9.65432 23.33265 -22.46420 1.000 48.55065 ? 267 ILE A HG12 1 ATOM 4848 H HG13 . ILE A 1 267 ? -9.75970 24.64010 -23.36136 1.000 48.55065 ? 267 ILE A HG13 1 ATOM 4849 H HG21 . ILE A 1 267 ? -12.48039 22.81063 -21.82606 1.000 48.78560 ? 267 ILE A HG21 1 ATOM 4850 H HG22 . ILE A 1 267 ? -12.86283 22.01224 -23.14509 1.000 48.78560 ? 267 ILE A HG22 1 ATOM 4851 H HG23 . ILE A 1 267 ? -11.48977 21.71190 -22.40482 1.000 48.78560 ? 267 ILE A HG23 1 ATOM 4852 H HD11 . ILE A 1 267 ? -9.82145 25.27958 -21.15878 1.000 53.91152 ? 267 ILE A HD11 1 ATOM 4853 H HD12 . ILE A 1 267 ? -11.25666 25.54778 -21.78466 1.000 53.91152 ? 267 ILE A HD12 1 ATOM 4854 H HD13 . ILE A 1 267 ? -11.01577 24.27358 -20.86711 1.000 53.91152 ? 267 ILE A HD13 1 ATOM 4855 N N . LEU A 1 268 ? -11.61727 24.75374 -26.27613 1.000 39.90228 ? 268 LEU A N 1 ATOM 4856 C CA A LEU A 1 268 ? -11.46769 25.88043 -27.18735 0.589 40.99139 ? 268 LEU A CA 1 ATOM 4857 C CA B LEU A 1 268 ? -11.45500 25.88955 -27.17186 0.411 40.99836 ? 268 LEU A CA 1 ATOM 4858 C C . LEU A 1 268 ? -12.50084 26.93750 -26.81619 1.000 41.36775 ? 268 LEU A C 1 ATOM 4859 O O . LEU A 1 268 ? -13.67892 26.60787 -26.67118 1.000 46.61665 ? 268 LEU A O 1 ATOM 4860 C CB A LEU A 1 268 ? -11.70851 25.43921 -28.63923 0.589 46.22311 ? 268 LEU A CB 1 ATOM 4861 C CB B LEU A 1 268 ? -11.62664 25.43747 -28.62817 0.411 46.18511 ? 268 LEU A CB 1 ATOM 4862 C CG A LEU A 1 268 ? -10.58031 25.08031 -29.58795 0.589 47.84177 ? 268 LEU A CG 1 ATOM 4863 C CG B LEU A 1 268 ? -11.06529 26.27866 -29.76130 0.411 49.34481 ? 268 LEU A CG 1 ATOM 4864 C CD1 A LEU A 1 268 ? -11.19643 24.54794 -30.88497 0.589 45.20805 ? 268 LEU A CD1 1 ATOM 4865 C CD1 B LEU A 1 268 ? -9.56590 26.19243 -29.75127 0.411 54.14105 ? 268 LEU A CD1 1 ATOM 4866 C CD2 A LEU A 1 268 ? -9.73418 26.29711 -29.86737 0.589 54.80298 ? 268 LEU A CD2 1 ATOM 4867 C CD2 B LEU A 1 268 ? -11.61144 25.77024 -31.07767 0.411 47.53697 ? 268 LEU A CD2 1 ATOM 4868 H H A LEU A 1 268 ? -12.44166 24.58983 -26.09414 0.589 47.88274 ? 268 LEU A H 1 ATOM 4869 H H B LEU A 1 268 ? -12.44290 24.58512 -26.10438 0.411 47.88274 ? 268 LEU A H 1 ATOM 4870 H HA A LEU A 1 268 ? -10.57607 26.25407 -27.10788 0.589 49.18966 ? 268 LEU A HA 1 ATOM 4871 H HA B LEU A 1 268 ? -10.57682 26.28810 -27.06764 0.411 49.19803 ? 268 LEU A HA 1 ATOM 4872 H HB2 A LEU A 1 268 ? -12.27015 24.64947 -28.59723 0.589 55.46773 ? 268 LEU A HB2 1 ATOM 4873 H HB2 B LEU A 1 268 ? -11.20839 24.56591 -28.70784 0.411 55.42213 ? 268 LEU A HB2 1 ATOM 4874 H HB3 A LEU A 1 268 ? -12.18698 26.16399 -29.07128 0.589 55.46773 ? 268 LEU A HB3 1 ATOM 4875 H HB3 B LEU A 1 268 ? -12.57954 25.36460 -28.79418 0.411 55.42213 ? 268 LEU A HB3 1 ATOM 4876 H HG A LEU A 1 268 ? -10.00527 24.40272 -29.19924 0.589 57.41012 ? 268 LEU A HG 1 ATOM 4877 H HG B LEU A 1 268 ? -11.32271 27.20776 -29.65444 0.411 59.21377 ? 268 LEU A HG 1 ATOM 4878 H HD11 A LEU A 1 268 ? -10.48443 24.33025 -31.50671 0.589 54.24966 ? 268 LEU A HD11 1 ATOM 4879 H HD11 B LEU A 1 268 ? -9.21280 26.74898 -30.46294 0.411 64.96926 ? 268 LEU A HD11 1 ATOM 4880 H HD12 A LEU A 1 268 ? -11.71550 23.75326 -30.68509 0.589 54.24966 ? 268 LEU A HD12 1 ATOM 4881 H HD12 B LEU A 1 268 ? -9.23737 26.50429 -28.89354 0.411 64.96926 ? 268 LEU A HD12 1 ATOM 4882 H HD13 A LEU A 1 268 ? -11.77052 25.23097 -31.26549 0.589 54.24966 ? 268 LEU A HD13 1 ATOM 4883 H HD13 B LEU A 1 268 ? -9.30171 25.26962 -29.89101 0.411 64.96926 ? 268 LEU A HD13 1 ATOM 4884 H HD21 A LEU A 1 268 ? -9.10010 26.08615 -30.57046 0.589 65.76357 ? 268 LEU A HD21 1 ATOM 4885 H HD21 B LEU A 1 268 ? -11.03458 26.07223 -31.79665 0.411 57.04436 ? 268 LEU A HD21 1 ATOM 4886 H HD22 A LEU A 1 268 ? -10.31057 27.02464 -30.14912 0.589 65.76357 ? 268 LEU A HD22 1 ATOM 4887 H HD22 B LEU A 1 268 ? -11.63412 24.80073 -31.05682 0.411 57.04436 ? 268 LEU A HD22 1 ATOM 4888 H HD23 A LEU A 1 268 ? -9.26036 26.54490 -29.05805 0.589 65.76357 ? 268 LEU A HD23 1 ATOM 4889 H HD23 B LEU A 1 268 ? -12.50758 26.11943 -31.20375 0.411 57.04436 ? 268 LEU A HD23 1 ATOM 4890 N N . GLY A 1 269 ? -12.09399 28.19835 -26.69051 1.000 43.65875 ? 269 GLY A N 1 ATOM 4891 C CA . GLY A 1 269 ? -13.08235 29.24723 -26.48223 1.000 43.45272 ? 269 GLY A CA 1 ATOM 4892 C C . GLY A 1 269 ? -12.50995 30.50646 -25.86673 1.000 42.08745 ? 269 GLY A C 1 ATOM 4893 O O . GLY A 1 269 ? -11.37931 30.53982 -25.38764 1.000 39.07354 ? 269 GLY A O 1 ATOM 4894 H H . GLY A 1 269 ? -11.27608 28.46231 -26.72149 1.000 52.39050 ? 269 GLY A H 1 ATOM 4895 H HA2 . GLY A 1 269 ? -13.47792 29.48361 -27.33578 1.000 52.14327 ? 269 GLY A HA2 1 ATOM 4896 H HA3 . GLY A 1 269 ? -13.77763 28.91473 -25.89321 1.000 52.14327 ? 269 GLY A HA3 1 ATOM 4897 N N . ASP A 1 270 ? -13.36406 31.54610 -25.83224 1.000 43.62088 ? 270 ASP A N 1 ATOM 4898 C CA A ASP A 1 270 ? -12.90912 32.87521 -25.42894 0.349 46.81579 ? 270 ASP A CA 1 ATOM 4899 C CA B ASP A 1 270 ? -12.91183 32.87614 -25.43048 0.651 46.82766 ? 270 ASP A CA 1 ATOM 4900 C C . ASP A 1 270 ? -12.42314 32.90748 -23.98657 1.000 43.29896 ? 270 ASP A C 1 ATOM 4901 O O . ASP A 1 270 ? -11.52615 33.68894 -23.65396 1.000 44.11884 ? 270 ASP A O 1 ATOM 4902 C CB A ASP A 1 270 ? -14.03027 33.90410 -25.61651 0.349 48.75586 ? 270 ASP A CB 1 ATOM 4903 C CB B ASP A 1 270 ? -14.04282 33.89724 -25.62214 0.651 48.74363 ? 270 ASP A CB 1 ATOM 4904 C CG A ASP A 1 270 ? -13.57222 35.32547 -25.32834 0.349 51.43380 ? 270 ASP A CG 1 ATOM 4905 C CG B ASP A 1 270 ? -14.39432 34.12505 -27.08330 0.651 53.19549 ? 270 ASP A CG 1 ATOM 4906 O OD1 A ASP A 1 270 ? -12.61193 35.78544 -25.98117 0.349 50.39524 ? 270 ASP A OD1 1 ATOM 4907 O OD1 B ASP A 1 270 ? -13.52681 33.93084 -27.95217 0.651 55.35832 ? 270 ASP A OD1 1 ATOM 4908 O OD2 A ASP A 1 270 ? -14.16569 35.97777 -24.44301 0.349 48.75783 ? 270 ASP A OD2 1 ATOM 4909 O OD2 B ASP A 1 270 ? -15.54754 34.50475 -27.36621 0.651 58.96138 ? 270 ASP A OD2 1 ATOM 4910 H H A ASP A 1 270 ? -14.19852 31.50282 -26.03571 0.349 52.34506 ? 270 ASP A H 1 ATOM 4911 H H B ASP A 1 270 ? -14.19858 31.50200 -26.03528 0.651 52.34506 ? 270 ASP A H 1 ATOM 4912 H HA A ASP A 1 270 ? -12.16625 33.11974 -26.00275 0.349 56.17895 ? 270 ASP A HA 1 ATOM 4913 H HA B ASP A 1 270 ? -12.16876 33.12796 -26.00086 0.651 56.19320 ? 270 ASP A HA 1 ATOM 4914 H HB2 A ASP A 1 270 ? -14.34230 33.86893 -26.53428 0.349 58.50703 ? 270 ASP A HB2 1 ATOM 4915 H HB2 B ASP A 1 270 ? -14.83825 33.57541 -25.16980 0.651 58.49236 ? 270 ASP A HB2 1 ATOM 4916 H HB3 A ASP A 1 270 ? -14.75787 33.69390 -25.01045 0.349 58.50703 ? 270 ASP A HB3 1 ATOM 4917 H HB3 B ASP A 1 270 ? -13.76753 34.74731 -25.24466 0.651 58.49236 ? 270 ASP A HB3 1 ATOM 4918 N N . ALA A 1 271 ? -13.00322 32.08269 -23.10998 1.000 40.82201 ? 271 ALA A N 1 ATOM 4919 C CA . ALA A 1 271 ? -12.56667 32.07907 -21.71278 1.000 41.78846 ? 271 ALA A CA 1 ATOM 4920 C C . ALA A 1 271 ? -11.08537 31.76291 -21.59209 1.000 41.41467 ? 271 ALA A C 1 ATOM 4921 O O . ALA A 1 271 ? -10.43984 32.15393 -20.61383 1.000 39.86419 ? 271 ALA A O 1 ATOM 4922 C CB . ALA A 1 271 ? -13.37495 31.06785 -20.90201 1.000 41.38332 ? 271 ALA A CB 1 ATOM 4923 H H . ALA A 1 271 ? -13.63549 31.52951 -23.29389 1.000 48.98642 ? 271 ALA A H 1 ATOM 4924 H HA . ALA A 1 271 ? -12.72686 32.96118 -21.34246 1.000 50.14616 ? 271 ALA A HA 1 ATOM 4925 H HB1 . ALA A 1 271 ? -13.07805 31.09361 -19.97893 1.000 49.65999 ? 271 ALA A HB1 1 ATOM 4926 H HB2 . ALA A 1 271 ? -14.31512 31.30086 -20.95371 1.000 49.65999 ? 271 ALA A HB2 1 ATOM 4927 H HB3 . ALA A 1 271 ? -13.23299 30.18188 -21.27054 1.000 49.65999 ? 271 ALA A HB3 1 ATOM 4928 N N . VAL A 1 272 ? -10.52668 31.03647 -22.56034 1.000 42.59563 ? 272 VAL A N 1 ATOM 4929 C CA . VAL A 1 272 ? -9.10128 30.75069 -22.51309 1.000 39.30562 ? 272 VAL A CA 1 ATOM 4930 C C . VAL A 1 272 ? -8.29479 32.03369 -22.68557 1.000 41.25524 ? 272 VAL A C 1 ATOM 4931 O O . VAL A 1 272 ? -7.33270 32.27175 -21.94324 1.000 39.01444 ? 272 VAL A O 1 ATOM 4932 C CB . VAL A 1 272 ? -8.70744 29.70663 -23.57361 1.000 41.08649 ? 272 VAL A CB 1 ATOM 4933 C CG1 . VAL A 1 272 ? -7.19537 29.53765 -23.57920 1.000 41.98705 ? 272 VAL A CG1 1 ATOM 4934 C CG2 . VAL A 1 272 ? -9.41424 28.36702 -23.32392 1.000 39.80850 ? 272 VAL A CG2 1 ATOM 4935 H H . VAL A 1 272 ? -10.94308 30.70725 -23.23696 1.000 51.11476 ? 272 VAL A H 1 ATOM 4936 H HA . VAL A 1 272 ? -8.90435 30.37648 -21.64011 1.000 47.16675 ? 272 VAL A HA 1 ATOM 4937 H HB . VAL A 1 272 ? -8.99044 30.01539 -24.44853 1.000 49.30379 ? 272 VAL A HB 1 ATOM 4938 H HG11 . VAL A 1 272 ? -6.98046 28.62548 -23.82949 1.000 50.38446 ? 272 VAL A HG11 1 ATOM 4939 H HG12 . VAL A 1 272 ? -6.81088 30.15587 -24.22020 1.000 50.38446 ? 272 VAL A HG12 1 ATOM 4940 H HG13 . VAL A 1 272 ? -6.85323 29.72640 -22.69138 1.000 50.38446 ? 272 VAL A HG13 1 ATOM 4941 H HG21 . VAL A 1 272 ? -9.14507 27.73539 -24.00912 1.000 47.77020 ? 272 VAL A HG21 1 ATOM 4942 H HG22 . VAL A 1 272 ? -9.16013 28.03414 -22.44898 1.000 47.77020 ? 272 VAL A HG22 1 ATOM 4943 H HG23 . VAL A 1 272 ? -10.37375 28.50475 -23.35955 1.000 47.77020 ? 272 VAL A HG23 1 ATOM 4944 N N . ASN A 1 273 ? -8.64256 32.86048 -23.69297 1.000 41.05229 ? 273 ASN A N 1 ATOM 4945 C CA A ASN A 1 273 ? -7.87906 34.08724 -23.85405 0.545 43.09559 ? 273 ASN A CA 1 ATOM 4946 C CA B ASN A 1 273 ? -7.98001 34.15316 -23.89016 0.455 43.00400 ? 273 ASN A CA 1 ATOM 4947 C C . ASN A 1 273 ? -8.05600 34.99573 -22.63783 1.000 41.06556 ? 273 ASN A C 1 ATOM 4948 O O . ASN A 1 273 ? -7.11434 35.70988 -22.27992 1.000 41.11387 ? 273 ASN A O 1 ATOM 4949 C CB A ASN A 1 273 ? -8.26761 34.80793 -25.14708 0.545 44.94460 ? 273 ASN A CB 1 ATOM 4950 C CB B ASN A 1 273 ? -8.62889 35.01660 -24.98083 0.455 43.18113 ? 273 ASN A CB 1 ATOM 4951 C CG A ASN A 1 273 ? -7.29502 34.52481 -26.32528 0.545 45.85789 ? 273 ASN A CG 1 ATOM 4952 C CG B ASN A 1 273 ? -8.93411 34.27639 -26.20839 0.455 49.50008 ? 273 ASN A CG 1 ATOM 4953 O OD1 A ASN A 1 273 ? -6.39955 33.65154 -26.27195 0.545 48.19066 ? 273 ASN A OD1 1 ATOM 4954 O OD1 B ASN A 1 273 ? -9.63123 33.27823 -26.16025 0.455 52.74423 ? 273 ASN A OD1 1 ATOM 4955 N ND2 A ASN A 1 273 ? -7.47695 35.28553 -27.39828 0.545 51.13283 ? 273 ASN A ND2 1 ATOM 4956 N ND2 B ASN A 1 273 ? -8.47310 34.78686 -27.34416 0.455 43.59869 ? 273 ASN A ND2 1 ATOM 4957 H H A ASN A 1 273 ? -9.27943 32.73177 -24.25638 0.545 49.26275 ? 273 ASN A H 1 ATOM 4958 H H B ASN A 1 273 ? -9.25701 32.69230 -24.27070 0.455 49.26275 ? 273 ASN A H 1 ATOM 4959 H HA A ASN A 1 273 ? -6.93778 33.86768 -23.93582 0.545 51.71471 ? 273 ASN A HA 1 ATOM 4960 H HA B ASN A 1 273 ? -7.07271 33.92843 -24.14938 0.455 51.60480 ? 273 ASN A HA 1 ATOM 4961 H HB2 A ASN A 1 273 ? -9.15288 34.51600 -25.41534 0.545 53.93352 ? 273 ASN A HB2 1 ATOM 4962 H HB2 B ASN A 1 273 ? -9.46070 35.38005 -24.63896 0.455 51.81736 ? 273 ASN A HB2 1 ATOM 4963 H HB3 A ASN A 1 273 ? -8.26852 35.76434 -24.98529 0.545 53.93352 ? 273 ASN A HB3 1 ATOM 4964 H HB3 B ASN A 1 273 ? -8.02215 35.73724 -25.21202 0.455 51.81736 ? 273 ASN A HB3 1 ATOM 4965 H HD21 A ASN A 1 273 ? -6.97390 35.18318 -28.08826 0.545 61.35940 ? 273 ASN A HD21 1 ATOM 4966 H HD21 B ASN A 1 273 ? -8.62778 34.38670 -28.08951 0.455 52.31842 ? 273 ASN A HD21 1 ATOM 4967 H HD22 A ASN A 1 273 ? -8.09783 35.88058 -27.40327 0.545 61.35940 ? 273 ASN A HD22 1 ATOM 4968 H HD22 B ASN A 1 273 ? -8.01982 35.51765 -27.33443 0.455 52.31842 ? 273 ASN A HD22 1 ATOM 4969 N N . VAL A 1 274 ? -9.23340 34.98883 -22.00860 1.000 40.20730 ? 274 VAL A N 1 ATOM 4970 C CA . VAL A 1 274 ? -9.44806 35.84853 -20.85468 1.000 38.40464 ? 274 VAL A CA 1 ATOM 4971 C C . VAL A 1 274 ? -8.55937 35.40802 -19.69875 1.000 40.27947 ? 274 VAL A C 1 ATOM 4972 O O . VAL A 1 274 ? -7.92850 36.24448 -19.03784 1.000 39.95059 ? 274 VAL A O 1 ATOM 4973 C CB . VAL A 1 274 ? -10.93812 35.87296 -20.45468 1.000 44.41914 ? 274 VAL A CB 1 ATOM 4974 C CG1 . VAL A 1 274 ? -11.12703 36.69536 -19.17756 1.000 43.37716 ? 274 VAL A CG1 1 ATOM 4975 C CG2 . VAL A 1 274 ? -11.78565 36.47311 -21.57634 1.000 48.97830 ? 274 VAL A CG2 1 ATOM 4976 H H . VAL A 1 274 ? -9.90858 34.50371 -22.22857 1.000 48.24876 ? 274 VAL A H 1 ATOM 4977 H HA . VAL A 1 274 ? -9.20078 36.75399 -21.09943 1.000 46.08557 ? 274 VAL A HA 1 ATOM 4978 H HB . VAL A 1 274 ? -11.23147 34.96231 -20.29481 1.000 53.30297 ? 274 VAL A HB 1 ATOM 4979 H HG11 . VAL A 1 274 ? -12.07031 36.89130 -19.06476 1.000 52.05259 ? 274 VAL A HG11 1 ATOM 4980 H HG12 . VAL A 1 274 ? -10.80294 36.18238 -18.42078 1.000 52.05259 ? 274 VAL A HG12 1 ATOM 4981 H HG13 . VAL A 1 274 ? -10.62476 37.52141 -19.25669 1.000 52.05259 ? 274 VAL A HG13 1 ATOM 4982 H HG21 . VAL A 1 274 ? -12.71673 36.47098 -21.30432 1.000 58.77396 ? 274 VAL A HG21 1 ATOM 4983 H HG22 . VAL A 1 274 ? -11.49162 37.38244 -21.74234 1.000 58.77396 ? 274 VAL A HG22 1 ATOM 4984 H HG23 . VAL A 1 274 ? -11.67390 35.93786 -22.37754 1.000 58.77396 ? 274 VAL A HG23 1 ATOM 4985 N N . ALA A 1 275 ? -8.48800 34.09804 -19.43790 1.000 39.11132 ? 275 ALA A N 1 ATOM 4986 C CA . ALA A 1 275 ? -7.62916 33.60101 -18.36441 1.000 38.94937 ? 275 ALA A CA 1 ATOM 4987 C C . ALA A 1 275 ? -6.17025 33.93054 -18.63515 1.000 39.22763 ? 275 ALA A C 1 ATOM 4988 O O . ALA A 1 275 ? -5.42413 34.29495 -17.72397 1.000 37.34300 ? 275 ALA A O 1 ATOM 4989 C CB . ALA A 1 275 ? -7.80613 32.09332 -18.19399 1.000 37.41809 ? 275 ALA A CB 1 ATOM 4990 H H . ALA A 1 275 ? -8.92037 33.48736 -19.86185 1.000 46.93359 ? 275 ALA A H 1 ATOM 4991 H HA . ALA A 1 275 ? -7.89358 34.02925 -17.53520 1.000 46.73924 ? 275 ALA A HA 1 ATOM 4992 H HB1 . ALA A 1 275 ? -7.22230 31.78515 -17.48331 1.000 44.90171 ? 275 ALA A HB1 1 ATOM 4993 H HB2 . ALA A 1 275 ? -8.73061 31.90758 -17.96653 1.000 44.90171 ? 275 ALA A HB2 1 ATOM 4994 H HB3 . ALA A 1 275 ? -7.57525 31.65215 -19.02644 1.000 44.90171 ? 275 ALA A HB3 1 ATOM 4995 N N . ALA A 1 276 ? -5.73844 33.81109 -19.88795 1.000 38.50272 ? 276 ALA A N 1 ATOM 4996 C CA . ALA A 1 276 ? -4.34946 34.10769 -20.20979 1.000 39.06119 ? 276 ALA A CA 1 ATOM 4997 C C . ALA A 1 276 ? -4.04829 35.58751 -20.04646 1.000 41.79193 ? 276 ALA A C 1 ATOM 4998 O O . ALA A 1 276 ? -2.95872 35.95480 -19.58752 1.000 41.80751 ? 276 ALA A O 1 ATOM 4999 C CB . ALA A 1 276 ? -4.03550 33.63136 -21.63118 1.000 39.94031 ? 276 ALA A CB 1 ATOM 5000 H H . ALA A 1 276 ? -6.22047 33.56494 -20.55628 1.000 46.20327 ? 276 ALA A H 1 ATOM 5001 H HA . ALA A 1 276 ? -3.77039 33.62466 -19.59967 1.000 46.87343 ? 276 ALA A HA 1 ATOM 5002 H HB1 . ALA A 1 276 ? -3.11011 33.83758 -21.83617 1.000 47.92837 ? 276 ALA A HB1 1 ATOM 5003 H HB2 . ALA A 1 276 ? -4.18014 32.67358 -21.68245 1.000 47.92837 ? 276 ALA A HB2 1 ATOM 5004 H HB3 . ALA A 1 276 ? -4.62205 34.08828 -22.25415 1.000 47.92837 ? 276 ALA A HB3 1 ATOM 5005 N N . ARG A 1 277 ? -5.00159 36.45884 -20.40654 1.000 40.02761 ? 277 ARG A N 1 ATOM 5006 C CA . ARG A 1 277 ? -4.80396 37.89177 -20.22944 1.000 41.97928 ? 277 ARG A CA 1 ATOM 5007 C C . ARG A 1 277 ? -4.76403 38.26386 -18.75281 1.000 41.30059 ? 277 ARG A C 1 ATOM 5008 O O . ARG A 1 277 ? -3.98801 39.13573 -18.34264 1.000 43.63068 ? 277 ARG A O 1 ATOM 5009 C CB . ARG A 1 277 ? -5.92109 38.65460 -20.93729 1.000 49.40502 ? 277 ARG A CB 1 ATOM 5010 C CG . ARG A 1 277 ? -6.03843 40.10721 -20.54297 1.000 69.41732 ? 277 ARG A CG 1 ATOM 5011 C CD . ARG A 1 277 ? -6.64800 40.89533 -21.67418 1.000 97.30838 ? 277 ARG A CD 1 ATOM 5012 N NE . ARG A 1 277 ? -8.09423 40.93710 -21.50954 1.000 99.66425 ? 277 ARG A NE 1 ATOM 5013 C CZ . ARG A 1 277 ? -8.95978 40.28919 -22.27955 1.000 90.37451 ? 277 ARG A CZ 1 ATOM 5014 N NH1 . ARG A 1 277 ? -8.56018 39.54505 -23.29942 1.000 89.28421 ? 277 ARG A NH1 1 ATOM 5015 N NH2 . ARG A 1 277 ? -10.25775 40.37317 -22.00719 1.000 79.80839 ? 277 ARG A NH2 1 ATOM 5016 H H . ARG A 1 277 ? -5.75978 36.24349 -20.75059 1.000 48.03313 ? 277 ARG A H 1 ATOM 5017 H HA . ARG A 1 277 ? -3.95672 38.14561 -20.62775 1.000 50.37514 ? 277 ARG A HA 1 ATOM 5018 H HB2 . ARG A 1 277 ? -5.75850 38.62320 -21.89305 1.000 59.28602 ? 277 ARG A HB2 1 ATOM 5019 H HB3 . ARG A 1 277 ? -6.76637 38.22616 -20.73031 1.000 59.28602 ? 277 ARG A HB3 1 ATOM 5020 H HG2 . ARG A 1 277 ? -6.60829 40.19000 -19.76239 1.000 83.30079 ? 277 ARG A HG2 1 ATOM 5021 H HG3 . ARG A 1 277 ? -5.15829 40.46686 -20.35084 1.000 83.30079 ? 277 ARG A HG3 1 ATOM 5022 H HD2 . ARG A 1 277 ? -6.30473 41.80252 -21.66574 1.000 116.77006 ? 277 ARG A HD2 1 ATOM 5023 H HD3 . ARG A 1 277 ? -6.44057 40.47000 -22.52092 1.000 116.77006 ? 277 ARG A HD3 1 ATOM 5024 H HE . ARG A 1 277 ? -8.40983 41.41527 -20.86818 1.000 119.59710 ? 277 ARG A HE 1 ATOM 5025 H HH11 . ARG A 1 277 ? -7.72171 39.47265 -23.47639 1.000 107.14105 ? 277 ARG A HH11 1 ATOM 5026 H HH12 . ARG A 1 277 ? -9.13915 39.13418 -23.78479 1.000 107.14105 ? 277 ARG A HH12 1 ATOM 5027 H HH21 . ARG A 1 277 ? -10.52743 40.84289 -21.33918 1.000 95.77006 ? 277 ARG A HH21 1 ATOM 5028 H HH22 . ARG A 1 277 ? -10.82806 39.95781 -22.49894 1.000 95.77006 ? 277 ARG A HH22 1 ATOM 5029 N N . LEU A 1 278 ? -5.60505 37.63017 -17.94339 1.000 40.30554 ? 278 LEU A N 1 ATOM 5030 C CA . LEU A 1 278 ? -5.59176 37.93953 -16.51940 1.000 38.22519 ? 278 LEU A CA 1 ATOM 5031 C C . LEU A 1 278 ? -4.28534 37.49704 -15.87023 1.000 39.92925 ? 278 LEU A C 1 ATOM 5032 O O . LEU A 1 278 ? -3.74067 38.21510 -15.01895 1.000 41.02110 ? 278 LEU A O 1 ATOM 5033 C CB . LEU A 1 278 ? -6.78975 37.30139 -15.82413 1.000 40.57400 ? 278 LEU A CB 1 ATOM 5034 C CG . LEU A 1 278 ? -8.16547 37.85761 -16.21958 1.000 44.87197 ? 278 LEU A CG 1 ATOM 5035 C CD1 . LEU A 1 278 ? -9.30969 37.02632 -15.59093 1.000 46.80129 ? 278 LEU A CD1 1 ATOM 5036 C CD2 . LEU A 1 278 ? -8.28740 39.32824 -15.87364 1.000 58.29335 ? 278 LEU A CD2 1 ATOM 5037 H H . LEU A 1 278 ? -6.17642 37.03469 -18.18533 1.000 48.36665 ? 278 LEU A H 1 ATOM 5038 H HA . LEU A 1 278 ? -5.66906 38.90022 -16.40989 1.000 45.87023 ? 278 LEU A HA 1 ATOM 5039 H HB2 . LEU A 1 278 ? -6.79152 36.35384 -16.03160 1.000 48.68880 ? 278 LEU A HB2 1 ATOM 5040 H HB3 . LEU A 1 278 ? -6.69028 37.43149 -14.86805 1.000 48.68880 ? 278 LEU A HB3 1 ATOM 5041 H HG . LEU A 1 278 ? -8.25720 37.78516 -17.18251 1.000 53.84636 ? 278 LEU A HG 1 ATOM 5042 H HD11 . LEU A 1 278 ? -10.16051 37.41302 -15.85069 1.000 56.16154 ? 278 LEU A HD11 1 ATOM 5043 H HD12 . LEU A 1 278 ? -9.24968 36.11296 -15.91198 1.000 56.16154 ? 278 LEU A HD12 1 ATOM 5044 H HD13 . LEU A 1 278 ? -9.21929 37.04414 -14.62532 1.000 56.16154 ? 278 LEU A HD13 1 ATOM 5045 H HD21 . LEU A 1 278 ? -9.19059 39.62436 -16.06720 1.000 69.95202 ? 278 LEU A HD21 1 ATOM 5046 H HD22 . LEU A 1 278 ? -8.09509 39.44780 -14.93045 1.000 69.95202 ? 278 LEU A HD22 1 ATOM 5047 H HD23 . LEU A 1 278 ? -7.65274 39.83181 -16.40706 1.000 69.95202 ? 278 LEU A HD23 1 ATOM 5048 N N . GLU A 1 279 ? -3.77543 36.31412 -16.24265 1.000 37.80968 ? 279 GLU A N 1 ATOM 5049 C CA . GLU A 1 279 ? -2.49899 35.85775 -15.69330 1.000 40.10980 ? 279 GLU A CA 1 ATOM 5050 C C . GLU A 1 279 ? -1.39623 36.86061 -16.01095 1.000 39.05222 ? 279 GLU A C 1 ATOM 5051 O O . GLU A 1 279 ? -0.56406 37.19077 -15.15477 1.000 41.54680 ? 279 GLU A O 1 ATOM 5052 C CB . GLU A 1 279 ? -2.15983 34.46998 -16.25033 1.000 38.47483 ? 279 GLU A CB 1 ATOM 5053 C CG . GLU A 1 279 ? -0.96895 33.76881 -15.58911 1.000 35.81045 ? 279 GLU A CG 1 ATOM 5054 C CD . GLU A 1 279 ? 0.38359 34.33862 -15.97781 1.000 46.43402 ? 279 GLU A CD 1 ATOM 5055 O OE1 . GLU A 1 279 ? 0.55143 34.80630 -17.12758 1.000 40.46724 ? 279 GLU A OE1 1 ATOM 5056 O OE2 . GLU A 1 279 ? 1.30413 34.31411 -15.12809 1.000 40.96953 ? 279 GLU A OE2 1 ATOM 5057 H H . GLU A 1 279 ? -4.14269 35.77130 -16.79948 1.000 45.37162 ? 279 GLU A H 1 ATOM 5058 H HA . GLU A 1 279 ? -2.56711 35.77749 -14.72903 1.000 48.13176 ? 279 GLU A HA 1 ATOM 5059 H HB2 . GLU A 1 279 ? -2.93368 33.89682 -16.13395 1.000 46.16979 ? 279 GLU A HB2 1 ATOM 5060 H HB3 . GLU A 1 279 ? -1.95379 34.56168 -17.19375 1.000 46.16979 ? 279 GLU A HB3 1 ATOM 5061 H HG2 . GLU A 1 279 ? -1.05622 33.85005 -14.62647 1.000 42.97255 ? 279 GLU A HG2 1 ATOM 5062 H HG3 . GLU A 1 279 ? -0.97813 32.83329 -15.84529 1.000 42.97255 ? 279 GLU A HG3 1 ATOM 5063 N N . ALA A 1 280 ? -1.39680 37.38744 -17.23499 1.000 40.07994 ? 280 ALA A N 1 ATOM 5064 C CA . ALA A 1 280 ? -0.37564 38.34656 -17.63104 1.000 43.10190 ? 280 ALA A CA 1 ATOM 5065 C C . ALA A 1 280 ? -0.47391 39.64044 -16.83163 1.000 42.12832 ? 280 ALA A C 1 ATOM 5066 O O . ALA A 1 280 ? 0.54701 40.29695 -16.58676 1.000 45.72178 ? 280 ALA A O 1 ATOM 5067 C CB . ALA A 1 280 ? -0.49466 38.62092 -19.13411 1.000 46.79871 ? 280 ALA A CB 1 ATOM 5068 H H . ALA A 1 280 ? -1.97267 37.20666 -17.84760 1.000 48.09592 ? 280 ALA A H 1 ATOM 5069 H HA . ALA A 1 280 ? 0.50226 37.97091 -17.46050 1.000 51.72228 ? 280 ALA A HA 1 ATOM 5070 H HB1 . ALA A 1 280 ? 0.18281 39.26541 -19.39211 1.000 56.15846 ? 280 ALA A HB1 1 ATOM 5071 H HB2 . ALA A 1 280 ? -0.36277 37.79070 -19.61809 1.000 56.15846 ? 280 ALA A HB2 1 ATOM 5072 H HB3 . ALA A 1 280 ? -1.37761 38.97626 -19.32133 1.000 56.15846 ? 280 ALA A HB3 1 ATOM 5073 N N . LEU A 1 281 ? -1.68204 40.01907 -16.41379 1.000 42.80902 ? 281 LEU A N 1 ATOM 5074 C CA . LEU A 1 281 ? -1.86504 41.21891 -15.61003 1.000 45.21163 ? 281 LEU A CA 1 ATOM 5075 C C . LEU A 1 281 ? -1.13688 41.15362 -14.26962 1.000 47.41172 ? 281 LEU A C 1 ATOM 5076 O O . LEU A 1 281 ? -0.82897 42.20593 -13.69111 1.000 48.81969 ? 281 LEU A O 1 ATOM 5077 C CB . LEU A 1 281 ? -3.35338 41.44905 -15.35357 1.000 52.36280 ? 281 LEU A CB 1 ATOM 5078 C CG . LEU A 1 281 ? -4.15566 42.28206 -16.34827 1.000 71.31142 ? 281 LEU A CG 1 ATOM 5079 C CD1 . LEU A 1 281 ? -5.60304 42.31691 -15.86384 1.000 66.58031 ? 281 LEU A CD1 1 ATOM 5080 C CD2 . LEU A 1 281 ? -3.58848 43.68793 -16.49442 1.000 62.87809 ? 281 LEU A CD2 1 ATOM 5081 H H . LEU A 1 281 ? -2.41137 39.59622 -16.58376 1.000 51.37082 ? 281 LEU A H 1 ATOM 5082 H HA . LEU A 1 281 ? -1.50829 41.97030 -16.10907 1.000 54.25396 ? 281 LEU A HA 1 ATOM 5083 H HB2 . LEU A 1 281 ? -3.77999 40.57861 -15.31817 1.000 62.83536 ? 281 LEU A HB2 1 ATOM 5084 H HB3 . LEU A 1 281 ? -3.43486 41.89360 -14.49530 1.000 62.83536 ? 281 LEU A HB3 1 ATOM 5085 H HG . LEU A 1 281 ? -4.11110 41.88588 -17.23255 1.000 85.57370 ? 281 LEU A HG 1 ATOM 5086 H HD11 . LEU A 1 281 ? -6.12852 42.85400 -16.47726 1.000 79.89638 ? 281 LEU A HD11 1 ATOM 5087 H HD12 . LEU A 1 281 ? -5.94911 41.41113 -15.83740 1.000 79.89638 ? 281 LEU A HD12 1 ATOM 5088 H HD13 . LEU A 1 281 ? -5.62966 42.70722 -14.97623 1.000 79.89638 ? 281 LEU A HD13 1 ATOM 5089 H HD21 . LEU A 1 281 ? -4.21704 44.23163 -16.99462 1.000 75.45371 ? 281 LEU A HD21 1 ATOM 5090 H HD22 . LEU A 1 281 ? -3.45246 44.06691 -15.61194 1.000 75.45371 ? 281 LEU A HD22 1 ATOM 5091 H HD23 . LEU A 1 281 ? -2.74310 43.63979 -16.96763 1.000 75.45371 ? 281 LEU A HD23 1 ATOM 5092 N N . THR A 1 282 ? -0.85680 39.94875 -13.76118 1.000 42.34412 ? 282 THR A N 1 ATOM 5093 C CA . THR A 1 282 ? -0.19717 39.83982 -12.46928 1.000 40.79216 ? 282 THR A CA 1 ATOM 5094 C C . THR A 1 282 ? 1.20467 40.42276 -12.48423 1.000 43.75000 ? 282 THR A C 1 ATOM 5095 O O . THR A 1 282 ? 1.75214 40.69814 -11.41454 1.000 52.67459 ? 282 THR A O 1 ATOM 5096 C CB . THR A 1 282 ? -0.09804 38.37620 -12.00592 1.000 40.16179 ? 282 THR A CB 1 ATOM 5097 O OG1 . THR A 1 282 ? 0.66184 37.61428 -12.94701 1.000 40.20093 ? 282 THR A OG1 1 ATOM 5098 C CG2 . THR A 1 282 ? -1.47501 37.75896 -11.86621 1.000 41.78360 ? 282 THR A CG2 1 ATOM 5099 H H . THR A 1 282 ? -1.03667 39.19816 -14.14048 1.000 50.81295 ? 282 THR A H 1 ATOM 5100 H HA . THR A 1 282 ? -0.74508 40.32532 -11.83288 1.000 48.95060 ? 282 THR A HA 1 ATOM 5101 H HB . THR A 1 282 ? 0.33981 38.35075 -11.14074 1.000 48.19414 ? 282 THR A HB 1 ATOM 5102 H HG1 . THR A 1 282 ? 0.71443 36.81505 -12.69389 1.000 48.24112 ? 282 THR A HG1 1 ATOM 5103 H HG21 . THR A 1 282 ? -1.39789 36.84153 -11.56080 1.000 50.14032 ? 282 THR A HG21 1 ATOM 5104 H HG22 . THR A 1 282 ? -2.00022 38.26147 -11.22392 1.000 50.14032 ? 282 THR A HG22 1 ATOM 5105 H HG23 . THR A 1 282 ? -1.93125 37.76850 -12.72217 1.000 50.14032 ? 282 THR A HG23 1 ATOM 5106 N N . ARG A 1 283 ? 1.82469 40.55464 -13.66343 1.000 43.99840 ? 283 ARG A N 1 ATOM 5107 C CA . ARG A 1 283 ? 3.14193 41.16831 -13.73018 1.000 43.38850 ? 283 ARG A CA 1 ATOM 5108 C C . ARG A 1 283 ? 3.10273 42.64788 -13.35710 1.000 58.41530 ? 283 ARG A C 1 ATOM 5109 O O . ARG A 1 283 ? 4.13712 43.20859 -12.98214 1.000 57.88866 ? 283 ARG A O 1 ATOM 5110 C CB . ARG A 1 283 ? 3.74459 41.02593 -15.12382 1.000 48.46206 ? 283 ARG A CB 1 ATOM 5111 C CG . ARG A 1 283 ? 3.84759 39.59350 -15.65014 1.000 51.74405 ? 283 ARG A CG 1 ATOM 5112 C CD . ARG A 1 283 ? 4.72147 38.74700 -14.75500 1.000 50.38149 ? 283 ARG A CD 1 ATOM 5113 N NE . ARG A 1 283 ? 4.98802 37.42956 -15.33024 1.000 44.94906 ? 283 ARG A NE 1 ATOM 5114 C CZ . ARG A 1 283 ? 4.16305 36.39272 -15.26732 1.000 40.92171 ? 283 ARG A CZ 1 ATOM 5115 N NH1 . ARG A 1 283 ? 2.99177 36.47361 -14.65832 1.000 44.69782 ? 283 ARG A NH1 1 ATOM 5116 N NH2 . ARG A 1 283 ? 4.51906 35.24836 -15.83711 1.000 40.33579 ? 283 ARG A NH2 1 ATOM 5117 H H . ARG A 1 283 ? 1.50544 40.30018 -14.42035 1.000 52.79809 ? 283 ARG A H 1 ATOM 5118 H HA . ARG A 1 283 ? 3.71957 40.69901 -13.10810 1.000 52.06620 ? 283 ARG A HA 1 ATOM 5119 H HB2 . ARG A 1 283 ? 3.19345 41.52424 -15.74737 1.000 58.15447 ? 283 ARG A HB2 1 ATOM 5120 H HB3 . ARG A 1 283 ? 4.64218 41.39330 -15.10751 1.000 58.15447 ? 283 ARG A HB3 1 ATOM 5121 H HG2 . ARG A 1 283 ? 2.96323 39.19610 -15.67990 1.000 62.09287 ? 283 ARG A HG2 1 ATOM 5122 H HG3 . ARG A 1 283 ? 4.23702 39.60317 -16.53848 1.000 62.09287 ? 283 ARG A HG3 1 ATOM 5123 H HD2 . ARG A 1 283 ? 5.57084 39.19617 -14.62192 1.000 60.45779 ? 283 ARG A HD2 1 ATOM 5124 H HD3 . ARG A 1 283 ? 4.27613 38.62017 -13.90266 1.000 60.45779 ? 283 ARG A HD3 1 ATOM 5125 H HE . ARG A 1 283 ? 5.73582 37.31850 -15.74018 1.000 53.93887 ? 283 ARG A HE 1 ATOM 5126 H HH11 . ARG A 1 283 ? 2.74850 37.21189 -14.29041 1.000 53.63738 ? 283 ARG A HH11 1 ATOM 5127 H HH12 . ARG A 1 283 ? 2.47345 35.78793 -14.63025 1.000 53.63738 ? 283 ARG A HH12 1 ATOM 5128 H HH21 . ARG A 1 283 ? 5.27607 35.18605 -16.24042 1.000 48.40295 ? 283 ARG A HH21 1 ATOM 5129 H HH22 . ARG A 1 283 ? 3.99278 34.56905 -15.80307 1.000 48.40295 ? 283 ARG A HH22 1 ATOM 5130 N N . GLN A 1 284 ? 1.94115 43.29036 -13.45782 1.000 52.03558 ? 284 GLN A N 1 ATOM 5131 C CA . GLN A 1 284 ? 1.82559 44.70998 -13.14007 1.000 56.95576 ? 284 GLN A CA 1 ATOM 5132 C C . GLN A 1 284 ? 1.18586 44.97550 -11.78570 1.000 59.98861 ? 284 GLN A C 1 ATOM 5133 O O . GLN A 1 284 ? 1.10116 46.13677 -11.37900 1.000 57.23310 ? 284 GLN A O 1 ATOM 5134 C CB . GLN A 1 284 ? 1.02347 45.44935 -14.22075 1.000 55.67087 ? 284 GLN A CB 1 ATOM 5135 C CG . GLN A 1 284 ? 1.23023 44.98069 -15.65028 1.000 79.55340 ? 284 GLN A CG 1 ATOM 5136 C CD . GLN A 1 284 ? 0.11533 45.45046 -16.56956 1.000 111.46179 ? 284 GLN A CD 1 ATOM 5137 O OE1 . GLN A 1 284 ? -0.62726 46.37678 -16.23825 1.000 109.83733 ? 284 GLN A OE1 1 ATOM 5138 N NE2 . GLN A 1 284 ? -0.00479 44.81595 -17.73034 1.000 104.85568 ? 284 GLN A NE2 1 ATOM 5139 H H . GLN A 1 284 ? 1.20475 42.92384 -13.70877 1.000 62.44269 ? 284 GLN A H 1 ATOM 5140 H HA . GLN A 1 284 ? 2.72309 45.07773 -13.12814 1.000 68.34692 ? 284 GLN A HA 1 ATOM 5141 H HB2 . GLN A 1 284 ? 0.08006 45.34601 -14.02026 1.000 66.80505 ? 284 GLN A HB2 1 ATOM 5142 H HB3 . GLN A 1 284 ? 1.26841 46.38740 -14.18980 1.000 66.80505 ? 284 GLN A HB3 1 ATOM 5143 H HG2 . GLN A 1 284 ? 2.06871 45.33592 -15.98444 1.000 95.46408 ? 284 GLN A HG2 1 ATOM 5144 H HG3 . GLN A 1 284 ? 1.24997 44.01106 -15.66851 1.000 95.46408 ? 284 GLN A HG3 1 ATOM 5145 H HE21 . GLN A 1 284 ? 0.53367 44.17513 -17.92784 1.000 125.82682 ? 284 GLN A HE21 1 ATOM 5146 H HE22 . GLN A 1 284 ? -0.62102 45.04597 -18.28437 1.000 125.82682 ? 284 GLN A HE22 1 ATOM 5147 N N . LEU A 1 285 ? 0.75193 43.94192 -11.07644 1.000 54.35896 ? 285 LEU A N 1 ATOM 5148 C CA . LEU A 1 285 ? 0.08048 44.06693 -9.79226 1.000 54.25806 ? 285 LEU A CA 1 ATOM 5149 C C . LEU A 1 285 ? 0.94575 43.45353 -8.70171 1.000 60.21611 ? 285 LEU A C 1 ATOM 5150 O O . LEU A 1 285 ? 1.86324 42.67868 -8.97366 1.000 59.29432 ? 285 LEU A O 1 ATOM 5151 C CB . LEU A 1 285 ? -1.27898 43.36292 -9.83845 1.000 56.89414 ? 285 LEU A CB 1 ATOM 5152 C CG . LEU A 1 285 ? -2.25052 43.91554 -10.88072 1.000 60.33230 ? 285 LEU A CG 1 ATOM 5153 C CD1 . LEU A 1 285 ? -3.49117 43.04645 -10.96958 1.000 67.84379 ? 285 LEU A CD1 1 ATOM 5154 C CD2 . LEU A 1 285 ? -2.63912 45.34515 -10.53760 1.000 67.17027 ? 285 LEU A CD2 1 ATOM 5155 H H . LEU A 1 285 ? 0.83905 43.12472 -11.32978 1.000 65.23075 ? 285 LEU A H 1 ATOM 5156 H HA . LEU A 1 285 ? -0.06316 45.00197 -9.57786 1.000 65.10967 ? 285 LEU A HA 1 ATOM 5157 H HB2 . LEU A 1 285 ? -1.13303 42.42589 -10.04233 1.000 68.27297 ? 285 LEU A HB2 1 ATOM 5158 H HB3 . LEU A 1 285 ? -1.70064 43.45158 -8.96940 1.000 68.27297 ? 285 LEU A HB3 1 ATOM 5159 H HG . LEU A 1 285 ? -1.81432 43.91346 -11.74711 1.000 72.39877 ? 285 LEU A HG 1 ATOM 5160 H HD11 . LEU A 1 285 ? -4.08959 43.41756 -11.63671 1.000 81.41255 ? 285 LEU A HD11 1 ATOM 5161 H HD12 . LEU A 1 285 ? -3.22953 42.14754 -11.22336 1.000 81.41255 ? 285 LEU A HD12 1 ATOM 5162 H HD13 . LEU A 1 285 ? -3.92900 43.03163 -10.10414 1.000 81.41255 ? 285 LEU A HD13 1 ATOM 5163 H HD21 . LEU A 1 285 ? -3.25170 45.67660 -11.21272 1.000 80.60432 ? 285 LEU A HD21 1 ATOM 5164 H HD22 . LEU A 1 285 ? -3.06829 45.35565 -9.66777 1.000 80.60432 ? 285 LEU A HD22 1 ATOM 5165 H HD23 . LEU A 1 285 ? -1.83946 45.89386 -10.51855 1.000 80.60432 ? 285 LEU A HD23 1 ATOM 5166 N N . SER A 1 286 ? 0.64528 43.79436 -7.45054 1.000 59.36609 ? 286 SER A N 1 ATOM 5167 C CA . SER A 1 286 ? 1.30188 43.09265 -6.35390 1.000 63.80159 ? 286 SER A CA 1 ATOM 5168 C C . SER A 1 286 ? 0.77614 41.66930 -6.20211 1.000 63.73798 ? 286 SER A C 1 ATOM 5169 O O . SER A 1 286 ? 1.49814 40.80307 -5.69435 1.000 59.73996 ? 286 SER A O 1 ATOM 5170 C CB . SER A 1 286 ? 1.12748 43.87003 -5.04576 1.000 70.75362 ? 286 SER A CB 1 ATOM 5171 O OG . SER A 1 286 ? -0.23794 44.13325 -4.78249 1.000 75.38452 ? 286 SER A OG 1 ATOM 5172 H H . SER A 1 286 ? 0.08589 44.40529 -7.21936 1.000 71.23931 ? 286 SER A H 1 ATOM 5173 H HA . SER A 1 286 ? 2.25400 43.04315 -6.53255 1.000 76.56190 ? 286 SER A HA 1 ATOM 5174 H HB2 . SER A 1 286 ? 1.49201 43.34391 -4.31691 1.000 84.90435 ? 286 SER A HB2 1 ATOM 5175 H HB3 . SER A 1 286 ? 1.60191 44.71317 -5.11595 1.000 84.90435 ? 286 SER A HB3 1 ATOM 5176 H HG . SER A 1 286 ? -0.31485 44.55863 -4.06226 1.000 90.46143 ? 286 SER A HG 1 ATOM 5177 N N . GLN A 1 287 ? -0.44656 41.40512 -6.66002 1.000 54.19899 ? 287 GLN A N 1 ATOM 5178 C CA . GLN A 1 287 ? -1.07742 40.10812 -6.47603 1.000 46.34921 ? 287 GLN A CA 1 ATOM 5179 C C . GLN A 1 287 ? -0.62645 39.11661 -7.54456 1.000 42.86204 ? 287 GLN A C 1 ATOM 5180 O O . GLN A 1 287 ? -0.50876 39.46351 -8.72001 1.000 48.10635 ? 287 GLN A O 1 ATOM 5181 C CB . GLN A 1 287 ? -2.59845 40.25915 -6.52408 1.000 49.18074 ? 287 GLN A CB 1 ATOM 5182 C CG . GLN A 1 287 ? -3.17441 40.96009 -5.29022 1.000 50.19349 ? 287 GLN A CG 1 ATOM 5183 C CD . GLN A 1 287 ? -3.17326 42.47441 -5.40170 1.000 60.58902 ? 287 GLN A CD 1 ATOM 5184 O OE1 . GLN A 1 287 ? -2.82523 43.04225 -6.43365 1.000 53.50720 ? 287 GLN A OE1 1 ATOM 5185 N NE2 . GLN A 1 287 ? -3.56404 43.13841 -4.32088 1.000 74.15384 ? 287 GLN A NE2 1 ATOM 5186 H H . GLN A 1 287 ? -0.93532 41.97021 -7.08591 1.000 65.03879 ? 287 GLN A H 1 ATOM 5187 H HA . GLN A 1 287 ? -0.82088 39.74956 -5.61202 1.000 55.61905 ? 287 GLN A HA 1 ATOM 5188 H HB2 . GLN A 1 287 ? -2.83736 40.78381 -7.30418 1.000 59.01688 ? 287 GLN A HB2 1 ATOM 5189 H HB3 . GLN A 1 287 ? -2.99979 39.37792 -6.58132 1.000 59.01688 ? 287 GLN A HB3 1 ATOM 5190 H HG2 . GLN A 1 287 ? -4.09219 40.67192 -5.16562 1.000 60.23219 ? 287 GLN A HG2 1 ATOM 5191 H HG3 . GLN A 1 287 ? -2.64281 40.71867 -4.51562 1.000 60.23219 ? 287 GLN A HG3 1 ATOM 5192 H HE21 . GLN A 1 287 ? -3.79837 42.70887 -3.61364 1.000 88.98461 ? 287 GLN A HE21 1 ATOM 5193 H HE22 . GLN A 1 287 ? -3.58291 43.99818 -4.32783 1.000 88.98461 ? 287 GLN A HE22 1 ATOM 5194 N N . ALA A 1 288 ? -0.39834 37.87238 -7.12380 1.000 41.49702 ? 288 ALA A N 1 ATOM 5195 C CA . ALA A 1 288 ? 0.02385 36.80525 -8.02301 1.000 42.84543 ? 288 ALA A CA 1 ATOM 5196 C C . ALA A 1 288 ? -1.13879 35.99514 -8.56846 1.000 37.26312 ? 288 ALA A C 1 ATOM 5197 O O . ALA A 1 288 ? -0.91256 35.13013 -9.42136 1.000 41.43076 ? 288 ALA A O 1 ATOM 5198 C CB . ALA A 1 288 ? 0.98395 35.85283 -7.30978 1.000 46.17006 ? 288 ALA A CB 1 ATOM 5199 H H . ALA A 1 288 ? -0.48341 37.61891 -6.30641 1.000 49.79642 ? 288 ALA A H 1 ATOM 5200 H HA . ALA A 1 288 ? 0.49502 37.20911 -8.76853 1.000 51.41452 ? 288 ALA A HA 1 ATOM 5201 H HB1 . ALA A 1 288 ? 1.25853 35.15877 -7.92928 1.000 55.40408 ? 288 ALA A HB1 1 ATOM 5202 H HB2 . ALA A 1 288 ? 1.75872 36.35260 -7.00837 1.000 55.40408 ? 288 ALA A HB2 1 ATOM 5203 H HB3 . ALA A 1 288 ? 0.52951 35.45694 -6.54974 1.000 55.40408 ? 288 ALA A HB3 1 ATOM 5204 N N . LEU A 1 289 ? -2.35330 36.22522 -8.05391 1.000 38.41627 ? 289 LEU A N 1 ATOM 5205 C CA . LEU A 1 289 ? -3.58185 35.54834 -8.46689 1.000 37.14903 ? 289 LEU A CA 1 ATOM 5206 C C . LEU A 1 289 ? -4.63492 36.59938 -8.78484 1.000 43.98275 ? 289 LEU A C 1 ATOM 5207 O O . LEU A 1 289 ? -4.91721 37.46711 -7.95404 1.000 40.44924 ? 289 LEU A O 1 ATOM 5208 C CB . LEU A 1 289 ? -4.08774 34.61857 -7.34909 1.000 38.81794 ? 289 LEU A CB 1 ATOM 5209 C CG . LEU A 1 289 ? -5.51202 34.08981 -7.44197 1.000 37.48165 ? 289 LEU A CG 1 ATOM 5210 C CD1 . LEU A 1 289 ? -5.60525 33.09647 -8.62398 1.000 41.15180 ? 289 LEU A CD1 1 ATOM 5211 C CD2 . LEU A 1 289 ? -5.88262 33.40626 -6.13066 1.000 44.66319 ? 289 LEU A CD2 1 ATOM 5212 H H . LEU A 1 289 ? -2.49507 36.80074 -7.43078 1.000 46.09953 ? 289 LEU A H 1 ATOM 5213 H HA . LEU A 1 289 ? -3.42065 35.02043 -9.26453 1.000 44.57883 ? 289 LEU A HA 1 ATOM 5214 H HB2 . LEU A 1 289 ? -3.50495 33.84352 -7.32567 1.000 46.58152 ? 289 LEU A HB2 1 ATOM 5215 H HB3 . LEU A 1 289 ? -4.02639 35.10520 -6.51223 1.000 46.58152 ? 289 LEU A HB3 1 ATOM 5216 H HG . LEU A 1 289 ? -6.13972 34.81310 -7.59612 1.000 44.97798 ? 289 LEU A HG 1 ATOM 5217 H HD11 . LEU A 1 289 ? -6.49195 32.70342 -8.63699 1.000 49.38216 ? 289 LEU A HD11 1 ATOM 5218 H HD12 . LEU A 1 289 ? -5.44334 33.57493 -9.45210 1.000 49.38216 ? 289 LEU A HD12 1 ATOM 5219 H HD13 . LEU A 1 289 ? -4.93756 32.40266 -8.50684 1.000 49.38216 ? 289 LEU A HD13 1 ATOM 5220 H HD21 . LEU A 1 289 ? -6.78865 33.06621 -6.19683 1.000 53.59583 ? 289 LEU A HD21 1 ATOM 5221 H HD22 . LEU A 1 289 ? -5.26576 32.67503 -5.97035 1.000 53.59583 ? 289 LEU A HD22 1 ATOM 5222 H HD23 . LEU A 1 289 ? -5.82376 34.05273 -5.40989 1.000 53.59583 ? 289 LEU A HD23 1 ATOM 5223 N N A VAL A 1 290 ? -5.22464 36.53910 -9.97343 0.472 36.76305 ? 290 VAL A N 1 ATOM 5224 N N B VAL A 1 290 ? -5.20226 36.51229 -9.98727 0.528 36.70684 ? 290 VAL A N 1 ATOM 5225 C CA A VAL A 1 290 ? -6.34018 37.42495 -10.29457 0.472 38.29697 ? 290 VAL A CA 1 ATOM 5226 C CA B VAL A 1 290 ? -6.28185 37.37955 -10.44103 0.528 38.25595 ? 290 VAL A CA 1 ATOM 5227 C C A VAL A 1 290 ? -7.36052 36.66372 -11.12211 0.472 39.95475 ? 290 VAL A C 1 ATOM 5228 C C B VAL A 1 290 ? -7.38486 36.49881 -11.00879 0.528 39.82940 ? 290 VAL A C 1 ATOM 5229 O O A VAL A 1 290 ? -7.00539 35.84342 -11.97511 0.472 40.35001 ? 290 VAL A O 1 ATOM 5230 O O B VAL A 1 290 ? -7.11904 35.42581 -11.56033 0.528 38.66026 ? 290 VAL A O 1 ATOM 5231 C CB A VAL A 1 290 ? -5.87735 38.69895 -11.03004 0.472 41.92693 ? 290 VAL A CB 1 ATOM 5232 C CB B VAL A 1 290 ? -5.77881 38.38578 -11.49984 0.528 42.87759 ? 290 VAL A CB 1 ATOM 5233 C CG1 A VAL A 1 290 ? -4.96580 39.51923 -10.13073 0.472 44.40374 ? 290 VAL A CG1 1 ATOM 5234 C CG1 B VAL A 1 290 ? -6.93981 39.04730 -12.20723 0.528 44.81819 ? 290 VAL A CG1 1 ATOM 5235 C CG2 A VAL A 1 290 ? -5.18847 38.34062 -12.33375 0.472 38.22402 ? 290 VAL A CG2 1 ATOM 5236 C CG2 B VAL A 1 290 ? -4.86836 39.42093 -10.85747 0.528 45.63358 ? 290 VAL A CG2 1 ATOM 5237 H H A VAL A 1 290 ? -4.99955 35.99951 -10.60413 0.472 44.11566 ? 290 VAL A H 1 ATOM 5238 H H B VAL A 1 290 ? -4.96777 35.93476 -10.57978 0.528 44.04820 ? 290 VAL A H 1 ATOM 5239 H HA A VAL A 1 290 ? -6.76678 37.69357 -9.46587 0.472 45.95636 ? 290 VAL A HA 1 ATOM 5240 H HA B VAL A 1 290 ? -6.64673 37.88097 -9.69515 0.528 45.90714 ? 290 VAL A HA 1 ATOM 5241 H HB A VAL A 1 290 ? -6.65030 39.24273 -11.24857 0.472 50.31232 ? 290 VAL A HB 1 ATOM 5242 H HB B VAL A 1 290 ? -5.26372 37.90668 -12.16771 0.528 51.45310 ? 290 VAL A HB 1 ATOM 5243 H HG11 A VAL A 1 290 ? -4.78229 40.37009 -10.55883 0.472 53.28449 ? 290 VAL A HG11 1 ATOM 5244 H HG11 B VAL A 1 290 ? -6.65701 39.91556 -12.53440 0.528 53.78182 ? 290 VAL A HG11 1 ATOM 5245 H HG12 A VAL A 1 290 ? -5.40936 39.66554 -9.28058 0.472 53.28449 ? 290 VAL A HG12 1 ATOM 5246 H HG12 B VAL A 1 290 ? -7.21712 38.48827 -12.94985 0.528 53.78182 ? 290 VAL A HG12 1 ATOM 5247 H HG13 A VAL A 1 290 ? -4.13787 39.03310 -9.99252 0.472 53.28449 ? 290 VAL A HG13 1 ATOM 5248 H HG13 B VAL A 1 290 ? -7.67281 39.15258 -11.58071 0.528 53.78182 ? 290 VAL A HG13 1 ATOM 5249 H HG21 A VAL A 1 290 ? -4.85170 39.15139 -12.74622 0.472 45.86882 ? 290 VAL A HG21 1 ATOM 5250 H HG21 B VAL A 1 290 ? -4.53896 40.02143 -11.54434 0.528 54.76029 ? 290 VAL A HG21 1 ATOM 5251 H HG22 A VAL A 1 290 ? -4.45419 37.73497 -12.14686 0.472 45.86882 ? 290 VAL A HG22 1 ATOM 5252 H HG22 B VAL A 1 290 ? -5.37401 39.91967 -10.19681 0.528 54.76029 ? 290 VAL A HG22 1 ATOM 5253 H HG23 A VAL A 1 290 ? -5.82941 37.91177 -12.92212 0.472 45.86882 ? 290 VAL A HG23 1 ATOM 5254 H HG23 B VAL A 1 290 ? -4.12498 38.96651 -10.43112 0.528 54.76029 ? 290 VAL A HG23 1 ATOM 5255 N N . PHE A 1 291 ? -8.63240 36.94545 -10.87720 1.000 37.79838 ? 291 PHE A N 1 ATOM 5256 C CA . PHE A 1 291 ? -9.71718 36.23237 -11.53371 1.000 36.00702 ? 291 PHE A CA 1 ATOM 5257 C C . PHE A 1 291 ? -10.87880 37.17234 -11.80310 1.000 42.54585 ? 291 PHE A C 1 ATOM 5258 O O . PHE A 1 291 ? -11.00271 38.24451 -11.20529 1.000 41.08258 ? 291 PHE A O 1 ATOM 5259 C CB . PHE A 1 291 ? -10.16314 34.98416 -10.73224 1.000 38.69209 ? 291 PHE A CB 1 ATOM 5260 C CG . PHE A 1 291 ? -10.35789 35.21157 -9.24103 1.000 36.82866 ? 291 PHE A CG 1 ATOM 5261 C CD1 . PHE A 1 291 ? -11.55990 35.68555 -8.75749 1.000 36.66726 ? 291 PHE A CD1 1 ATOM 5262 C CD2 . PHE A 1 291 ? -9.34467 34.91396 -8.33780 1.000 38.81722 ? 291 PHE A CD2 1 ATOM 5263 C CE1 . PHE A 1 291 ? -11.75307 35.88222 -7.38694 1.000 43.06842 ? 291 PHE A CE1 1 ATOM 5264 C CE2 . PHE A 1 291 ? -9.52041 35.12324 -6.97060 1.000 42.89288 ? 291 PHE A CE2 1 ATOM 5265 C CZ . PHE A 1 291 ? -10.72860 35.59083 -6.50140 1.000 42.57665 ? 291 PHE A CZ 1 ATOM 5266 H H A PHE A 1 291 ? -8.89568 37.55277 -10.32815 0.472 45.35806 ? 291 PHE A H 1 ATOM 5267 H H B PHE A 1 291 ? -8.86619 37.63903 -10.42566 0.528 45.35806 ? 291 PHE A H 1 ATOM 5268 H HA . PHE A 1 291 ? -9.40460 35.92483 -12.39894 1.000 43.20842 ? 291 PHE A HA 1 ATOM 5269 H HB2 . PHE A 1 291 ? -11.00927 34.67487 -11.09182 1.000 46.43050 ? 291 PHE A HB2 1 ATOM 5270 H HB3 . PHE A 1 291 ? -9.48744 34.29588 -10.83527 1.000 46.43050 ? 291 PHE A HB3 1 ATOM 5271 H HD1 . PHE A 1 291 ? -12.25025 35.87660 -9.35063 1.000 44.00071 ? 291 PHE A HD1 1 ATOM 5272 H HD2 . PHE A 1 291 ? -8.53854 34.57057 -8.64945 1.000 46.58066 ? 291 PHE A HD2 1 ATOM 5273 H HE1 . PHE A 1 291 ? -12.56534 36.20707 -7.07135 1.000 51.68210 ? 291 PHE A HE1 1 ATOM 5274 H HE2 . PHE A 1 291 ? -8.82535 34.94805 -6.37805 1.000 51.47146 ? 291 PHE A HE2 1 ATOM 5275 H HZ . PHE A 1 291 ? -10.85652 35.71105 -5.58812 1.000 51.09198 ? 291 PHE A HZ 1 ATOM 5276 N N . SER A 1 292 ? -11.72586 36.75285 -12.74127 1.000 41.69981 ? 292 SER A N 1 ATOM 5277 C CA . SER A 1 292 ? -12.84413 37.55883 -13.18917 1.000 41.45702 ? 292 SER A CA 1 ATOM 5278 C C . SER A 1 292 ? -14.00090 37.51054 -12.19617 1.000 45.05814 ? 292 SER A C 1 ATOM 5279 O O . SER A 1 292 ? -14.09457 36.62259 -11.34855 1.000 42.02712 ? 292 SER A O 1 ATOM 5280 C CB . SER A 1 292 ? -13.33595 37.05964 -14.53521 1.000 47.00476 ? 292 SER A CB 1 ATOM 5281 O OG . SER A 1 292 ? -13.86224 35.75886 -14.36588 1.000 46.74724 ? 292 SER A OG 1 ATOM 5282 H H . SER A 1 292 ? -11.66896 35.99157 -13.13727 1.000 50.03977 ? 292 SER A H 1 ATOM 5283 H HA . SER A 1 292 ? -12.55077 38.47996 -13.26892 1.000 49.74843 ? 292 SER A HA 1 ATOM 5284 H HB2 . SER A 1 292 ? -14.02992 37.65043 -14.86726 1.000 56.40571 ? 292 SER A HB2 1 ATOM 5285 H HB3 . SER A 1 292 ? -12.59601 37.03193 -15.16181 1.000 56.40571 ? 292 SER A HB3 1 ATOM 5286 H HG . SER A 1 292 ? -14.13610 35.46163 -15.10226 1.000 56.09669 ? 292 SER A HG 1 ATOM 5287 N N . SER A 1 293 ? -14.92110 38.45813 -12.35453 1.000 44.66368 ? 293 SER A N 1 ATOM 5288 C CA . SER A 1 293 ? -16.08000 38.51342 -11.47015 1.000 43.46120 ? 293 SER A CA 1 ATOM 5289 C C . SER A 1 293 ? -16.96572 37.28134 -11.61289 1.000 47.82005 ? 293 SER A C 1 ATOM 5290 O O . SER A 1 293 ? -17.66136 36.90872 -10.66060 1.000 48.70241 ? 293 SER A O 1 ATOM 5291 C CB . SER A 1 293 ? -16.88590 39.77819 -11.76191 1.000 53.33534 ? 293 SER A CB 1 ATOM 5292 O OG . SER A 1 293 ? -17.27352 39.79709 -13.12123 1.000 58.11651 ? 293 SER A OG 1 ATOM 5293 H H . SER A 1 293 ? -14.89892 39.07167 -12.95676 1.000 53.59641 ? 293 SER A H 1 ATOM 5294 H HA . SER A 1 293 ? -15.77036 38.54809 -10.55155 1.000 52.15344 ? 293 SER A HA 1 ATOM 5295 H HB2 . SER A 1 293 ? -17.67873 39.78819 -11.20314 1.000 64.00240 ? 293 SER A HB2 1 ATOM 5296 H HB3 . SER A 1 293 ? -16.33825 40.55661 -11.57470 1.000 64.00240 ? 293 SER A HB3 1 ATOM 5297 H HG . SER A 1 293 ? -17.71902 40.49053 -13.28333 1.000 69.73981 ? 293 SER A HG 1 ATOM 5298 N N . GLU A 1 294 ? -16.97863 36.64891 -12.79202 1.000 47.59997 ? 294 GLU A N 1 ATOM 5299 C CA . GLU A 1 294 ? -17.77350 35.43170 -12.94435 1.000 49.16751 ? 294 GLU A CA 1 ATOM 5300 C C . GLU A 1 294 ? -17.24449 34.30485 -12.06398 1.000 47.39916 ? 294 GLU A C 1 ATOM 5301 O O . GLU A 1 294 ? -18.02804 33.49874 -11.55165 1.000 47.39948 ? 294 GLU A O 1 ATOM 5302 C CB . GLU A 1 294 ? -17.81352 34.99322 -14.40859 1.000 53.27337 ? 294 GLU A CB 1 ATOM 5303 C CG . GLU A 1 294 ? -18.62192 35.93978 -15.30876 1.000 62.80800 ? 294 GLU A CG 1 ATOM 5304 C CD . GLU A 1 294 ? -17.88364 37.21682 -15.68537 1.000 84.22272 ? 294 GLU A CD 1 ATOM 5305 O OE1 . GLU A 1 294 ? -16.65352 37.29624 -15.48076 1.000 64.77925 ? 294 GLU A OE1 1 ATOM 5306 O OE2 . GLU A 1 294 ? -18.54695 38.15276 -16.18121 1.000 105.47584 ? 294 GLU A OE2 1 ATOM 5307 H H . GLU A 1 294 ? -16.54957 36.89721 -13.49477 1.000 57.11996 ? 294 GLU A H 1 ATOM 5308 H HA . GLU A 1 294 ? -18.68479 35.62410 -12.67336 1.000 59.00101 ? 294 GLU A HA 1 ATOM 5309 H HB2 . GLU A 1 294 ? -16.90630 34.96043 -14.75032 1.000 63.92805 ? 294 GLU A HB2 1 ATOM 5310 H HB3 . GLU A 1 294 ? -18.21973 34.11392 -14.46093 1.000 63.92805 ? 294 GLU A HB3 1 ATOM 5311 H HG2 . GLU A 1 294 ? -18.84359 35.47433 -16.13042 1.000 75.36960 ? 294 GLU A HG2 1 ATOM 5312 H HG3 . GLU A 1 294 ? -19.43346 36.19508 -14.84279 1.000 75.36960 ? 294 GLU A HG3 1 ATOM 5313 N N . VAL A 1 295 ? -15.92961 34.24700 -11.85898 1.000 43.91077 ? 295 VAL A N 1 ATOM 5314 C CA . VAL A 1 295 ? -15.36655 33.27839 -10.92053 1.000 40.37671 ? 295 VAL A CA 1 ATOM 5315 C C . VAL A 1 295 ? -15.73996 33.64785 -9.49109 1.000 44.55044 ? 295 VAL A C 1 ATOM 5316 O O . VAL A 1 295 ? -16.16501 32.79650 -8.69966 1.000 45.26955 ? 295 VAL A O 1 ATOM 5317 C CB . VAL A 1 295 ? -13.84184 33.19447 -11.10105 1.000 41.18148 ? 295 VAL A CB 1 ATOM 5318 C CG1 . VAL A 1 295 ? -13.22097 32.32115 -10.03706 1.000 40.77028 ? 295 VAL A CG1 1 ATOM 5319 C CG2 . VAL A 1 295 ? -13.49940 32.67546 -12.50831 1.000 43.47273 ? 295 VAL A CG2 1 ATOM 5320 H H . VAL A 1 295 ? -15.34900 34.75035 -12.24516 1.000 52.69293 ? 295 VAL A H 1 ATOM 5321 H HA . VAL A 1 295 ? -15.74280 32.40468 -11.11015 1.000 48.45205 ? 295 VAL A HA 1 ATOM 5322 H HB . VAL A 1 295 ? -13.46529 34.08335 -11.00617 1.000 49.41778 ? 295 VAL A HB 1 ATOM 5323 H HG11 . VAL A 1 295 ? -12.31997 32.08536 -10.30816 1.000 48.92433 ? 295 VAL A HG11 1 ATOM 5324 H HG12 . VAL A 1 295 ? -13.19704 32.81142 -9.20042 1.000 48.92433 ? 295 VAL A HG12 1 ATOM 5325 H HG13 . VAL A 1 295 ? -13.75637 31.51876 -9.93504 1.000 48.92433 ? 295 VAL A HG13 1 ATOM 5326 H HG21 . VAL A 1 295 ? -12.53516 32.62171 -12.59911 1.000 52.16727 ? 295 VAL A HG21 1 ATOM 5327 H HG22 . VAL A 1 295 ? -13.89215 31.79622 -12.62486 1.000 52.16727 ? 295 VAL A HG22 1 ATOM 5328 H HG23 . VAL A 1 295 ? -13.86004 33.28886 -13.16755 1.000 52.16727 ? 295 VAL A HG23 1 ATOM 5329 N N . LYS A 1 296 ? -15.58763 34.92368 -9.13936 1.000 42.60067 ? 296 LYS A N 1 ATOM 5330 C CA . LYS A 1 296 ? -15.95468 35.37750 -7.80096 1.000 42.31925 ? 296 LYS A CA 1 ATOM 5331 C C . LYS A 1 296 ? -17.41737 35.07523 -7.49852 1.000 47.20722 ? 296 LYS A C 1 ATOM 5332 O O . LYS A 1 296 ? -17.75837 34.62424 -6.39417 1.000 47.88550 ? 296 LYS A O 1 ATOM 5333 C CB . LYS A 1 296 ? -15.66039 36.87604 -7.68357 1.000 48.69142 ? 296 LYS A CB 1 ATOM 5334 C CG . LYS A 1 296 ? -15.89835 37.47520 -6.29639 1.000 48.77975 ? 296 LYS A CG 1 ATOM 5335 C CD . LYS A 1 296 ? -17.03310 38.46470 -6.30910 1.000 51.09645 ? 296 LYS A CD 1 ATOM 5336 C CE . LYS A 1 296 ? -17.24316 39.08909 -4.93707 1.000 57.18881 ? 296 LYS A CE 1 ATOM 5337 N NZ . LYS A 1 296 ? -18.69283 39.16378 -4.61582 1.000 66.58397 ? 296 LYS A NZ 1 ATOM 5338 H H . LYS A 1 296 ? -15.27704 35.54073 -9.65160 1.000 51.12080 ? 296 LYS A H 1 ATOM 5339 H HA . LYS A 1 296 ? -15.42219 34.91040 -7.13827 1.000 50.78310 ? 296 LYS A HA 1 ATOM 5340 H HB2 . LYS A 1 296 ? -14.72853 37.02434 -7.90839 1.000 58.42970 ? 296 LYS A HB2 1 ATOM 5341 H HB3 . LYS A 1 296 ? -16.23176 37.35081 -8.30728 1.000 58.42970 ? 296 LYS A HB3 1 ATOM 5342 H HG2 . LYS A 1 296 ? -16.12003 36.76532 -5.67363 1.000 58.53570 ? 296 LYS A HG2 1 ATOM 5343 H HG3 . LYS A 1 296 ? -15.09622 37.93518 -6.00329 1.000 58.53570 ? 296 LYS A HG3 1 ATOM 5344 H HD2 . LYS A 1 296 ? -16.83381 39.17423 -6.93978 1.000 61.31574 ? 296 LYS A HD2 1 ATOM 5345 H HD3 . LYS A 1 296 ? -17.85142 38.01203 -6.56669 1.000 61.31574 ? 296 LYS A HD3 1 ATOM 5346 H HE2 . LYS A 1 296 ? -16.80446 38.54710 -4.26276 1.000 68.62657 ? 296 LYS A HE2 1 ATOM 5347 H HE3 . LYS A 1 296 ? -16.87801 39.98770 -4.92961 1.000 68.62657 ? 296 LYS A HE3 1 ATOM 5348 H HZ1 . LYS A 1 296 ? -18.80810 39.52782 -3.81190 1.000 79.90077 ? 296 LYS A HZ1 1 ATOM 5349 H HZ2 . LYS A 1 296 ? -19.11356 39.66200 -5.22152 1.000 79.90077 ? 296 LYS A HZ2 1 ATOM 5350 H HZ3 . LYS A 1 296 ? -19.04727 38.34741 -4.61672 1.000 79.90077 ? 296 LYS A HZ3 1 ATOM 5351 N N . ASN A 1 297 ? -18.30169 35.30502 -8.46388 1.000 49.31878 ? 297 ASN A N 1 ATOM 5352 C CA . ASN A 1 297 ? -19.72388 35.16247 -8.19455 1.000 50.32536 ? 297 ASN A CA 1 ATOM 5353 C C . ASN A 1 297 ? -20.16907 33.70959 -8.15181 1.000 51.80088 ? 297 ASN A C 1 ATOM 5354 O O . ASN A 1 297 ? -21.22012 33.41886 -7.57305 1.000 51.85610 ? 297 ASN A O 1 ATOM 5355 C CB . ASN A 1 297 ? -20.52927 35.93781 -9.23866 1.000 54.96373 ? 297 ASN A CB 1 ATOM 5356 C CG . ASN A 1 297 ? -20.42928 37.43554 -9.03710 1.000 58.45165 ? 297 ASN A CG 1 ATOM 5357 O OD1 . ASN A 1 297 ? -20.28758 37.90717 -7.90673 1.000 65.84145 ? 297 ASN A OD1 1 ATOM 5358 N ND2 . ASN A 1 297 ? -20.52797 38.19207 -10.12349 1.000 64.85548 ? 297 ASN A ND2 1 ATOM 5359 H H . ASN A 1 297 ? -18.10572 35.54014 -9.26757 1.000 59.18254 ? 297 ASN A H 1 ATOM 5360 H HA . ASN A 1 297 ? -19.92332 35.54784 -7.32702 1.000 60.39043 ? 297 ASN A HA 1 ATOM 5361 H HB2 . ASN A 1 297 ? -20.19035 35.72792 -10.12296 1.000 65.95648 ? 297 ASN A HB2 1 ATOM 5362 H HB3 . ASN A 1 297 ? -21.46343 35.68503 -9.17279 1.000 65.95648 ? 297 ASN A HB3 1 ATOM 5363 H HD21 . ASN A 1 297 ? -20.64286 37.82622 -10.89326 1.000 77.82658 ? 297 ASN A HD21 1 ATOM 5364 H HD22 . ASN A 1 297 ? -20.47700 39.04802 -10.05751 1.000 77.82658 ? 297 ASN A HD22 1 ATOM 5365 N N . SER A 1 298 ? -19.38305 32.79800 -8.72194 1.000 50.75252 ? 298 SER A N 1 ATOM 5366 C CA . SER A 1 298 ? -19.68181 31.37294 -8.70335 1.000 54.85985 ? 298 SER A CA 1 ATOM 5367 C C . SER A 1 298 ? -19.12676 30.64866 -7.47844 1.000 52.72359 ? 298 SER A C 1 ATOM 5368 O O . SER A 1 298 ? -19.47718 29.48516 -7.25799 1.000 57.24520 ? 298 SER A O 1 ATOM 5369 C CB . SER A 1 298 ? -19.12446 30.70518 -9.96787 1.000 58.36808 ? 298 SER A CB 1 ATOM 5370 O OG . SER A 1 298 ? -19.67430 31.28501 -11.13608 1.000 64.03272 ? 298 SER A OG 1 ATOM 5371 H H . SER A 1 298 ? -18.65317 32.98726 -9.13552 1.000 60.90302 ? 298 SER A H 1 ATOM 5372 H HA . SER A 1 298 ? -20.64588 31.26600 -8.69674 1.000 65.83182 ? 298 SER A HA 1 ATOM 5373 H HB2 . SER A 1 298 ? -18.16113 30.81757 -9.98440 1.000 70.04169 ? 298 SER A HB2 1 ATOM 5374 H HB3 . SER A 1 298 ? -19.34812 29.76149 -9.94989 1.000 70.04169 ? 298 SER A HB3 1 ATOM 5375 H HG . SER A 1 298 ? -19.48707 32.10333 -11.16612 1.000 76.83927 ? 298 SER A HG 1 ATOM 5376 N N . ALA A 1 299 ? -18.26723 31.28805 -6.69035 1.000 48.74251 ? 299 ALA A N 1 ATOM 5377 C CA . ALA A 1 299 ? -17.77324 30.65804 -5.47162 1.000 53.26214 ? 299 ALA A CA 1 ATOM 5378 C C . ALA A 1 299 ? -18.86698 30.61763 -4.41068 1.000 52.14104 ? 299 ALA A C 1 ATOM 5379 O O . ALA A 1 299 ? -19.75210 31.47813 -4.36428 1.000 55.30642 ? 299 ALA A O 1 ATOM 5380 C CB . ALA A 1 299 ? -16.55365 31.41043 -4.94064 1.000 51.74207 ? 299 ALA A CB 1 ATOM 5381 H H . ALA A 1 299 ? -17.95871 32.07726 -6.83718 1.000 58.49101 ? 299 ALA A H 1 ATOM 5382 H HA . ALA A 1 299 ? -17.50296 29.74640 -5.66336 1.000 63.91457 ? 299 ALA A HA 1 ATOM 5383 H HB1 . ALA A 1 299 ? -16.24259 30.97623 -4.13094 1.000 62.09049 ? 299 ALA A HB1 1 ATOM 5384 H HB2 . ALA A 1 299 ? -15.85525 31.39473 -5.61362 1.000 62.09049 ? 299 ALA A HB2 1 ATOM 5385 H HB3 . ALA A 1 299 ? -16.80702 32.32676 -4.74819 1.000 62.09049 ? 299 ALA A HB3 1 ATOM 5386 N N . THR A 1 300 ? -18.80886 29.60128 -3.53890 1.000 52.59596 ? 300 THR A N 1 ATOM 5387 C CA . THR A 1 300 ? -19.79378 29.47076 -2.47623 1.000 56.35934 ? 300 THR A CA 1 ATOM 5388 C C . THR A 1 300 ? -19.23675 29.74088 -1.08204 1.000 59.99498 ? 300 THR A C 1 ATOM 5389 O O . THR A 1 300 ? -20.02049 29.98877 -0.16194 1.000 63.52566 ? 300 THR A O 1 ATOM 5390 C CB . THR A 1 300 ? -20.43231 28.06915 -2.48515 1.000 63.20155 ? 300 THR A CB 1 ATOM 5391 O OG1 . THR A 1 300 ? -19.46987 27.08256 -2.10861 1.000 60.37443 ? 300 THR A OG1 1 ATOM 5392 C CG2 . THR A 1 300 ? -20.94672 27.72513 -3.86896 1.000 63.66773 ? 300 THR A CG2 1 ATOM 5393 H H . THR A 1 300 ? -18.21044 28.98370 -3.54862 1.000 63.11515 ? 300 THR A H 1 ATOM 5394 H HA . THR A 1 300 ? -20.50061 30.11344 -2.64433 1.000 67.63121 ? 300 THR A HA 1 ATOM 5395 H HB . THR A 1 300 ? -21.17130 28.06304 -1.85686 1.000 75.84186 ? 300 THR A HB 1 ATOM 5396 H HG1 . THR A 1 300 ? -18.85512 27.04812 -2.68001 1.000 72.44931 ? 300 THR A HG1 1 ATOM 5397 H HG21 . THR A 1 300 ? -21.43677 26.88845 -3.84221 1.000 76.40128 ? 300 THR A HG21 1 ATOM 5398 H HG22 . THR A 1 300 ? -21.53729 28.42581 -4.18704 1.000 76.40128 ? 300 THR A HG22 1 ATOM 5399 H HG23 . THR A 1 300 ? -20.20386 27.63526 -4.48619 1.000 76.40128 ? 300 THR A HG23 1 ATOM 5400 N N . LYS A 1 301 ? -17.91915 29.70525 -0.90219 1.000 52.79473 ? 301 LYS A N 1 ATOM 5401 C CA . LYS A 1 301 ? -17.30673 29.97514 0.39177 1.000 56.77211 ? 301 LYS A CA 1 ATOM 5402 C C . LYS A 1 301 ? -17.02330 31.46406 0.54994 1.000 53.33906 ? 301 LYS A C 1 ATOM 5403 O O . LYS A 1 301 ? -16.92917 32.20544 -0.42620 1.000 51.81222 ? 301 LYS A O 1 ATOM 5404 C CB . LYS A 1 301 ? -16.01381 29.17117 0.55846 1.000 55.74531 ? 301 LYS A CB 1 ATOM 5405 C CG . LYS A 1 301 ? -16.21550 27.66757 0.42891 1.000 65.13140 ? 301 LYS A CG 1 ATOM 5406 C CD . LYS A 1 301 ? -14.98903 26.94706 -0.10863 1.000 82.52913 ? 301 LYS A CD 1 ATOM 5407 C CE . LYS A 1 301 ? -14.32018 26.10797 0.97692 1.000 90.19933 ? 301 LYS A CE 1 ATOM 5408 N NZ . LYS A 1 301 ? -13.21657 25.25636 0.44256 1.000 96.16269 ? 301 LYS A NZ 1 ATOM 5409 H H . LYS A 1 301 ? -17.35244 29.52463 -1.52334 1.000 63.35368 ? 301 LYS A H 1 ATOM 5410 H HA . LYS A 1 301 ? -17.91780 29.70705 1.09577 1.000 68.12653 ? 301 LYS A HA 1 ATOM 5411 H HB2 . LYS A 1 301 ? -15.38329 29.44688 -0.12516 1.000 66.89437 ? 301 LYS A HB2 1 ATOM 5412 H HB3 . LYS A 1 301 ? -15.64674 29.34747 1.43885 1.000 66.89437 ? 301 LYS A HB3 1 ATOM 5413 H HG2 . LYS A 1 301 ? -16.41814 27.29996 1.30339 1.000 78.15768 ? 301 LYS A HG2 1 ATOM 5414 H HG3 . LYS A 1 301 ? -16.95131 27.49931 -0.18032 1.000 78.15768 ? 301 LYS A HG3 1 ATOM 5415 H HD2 . LYS A 1 301 ? -15.25306 26.35720 -0.83199 1.000 99.03496 ? 301 LYS A HD2 1 ATOM 5416 H HD3 . LYS A 1 301 ? -14.34712 27.59941 -0.43001 1.000 99.03496 ? 301 LYS A HD3 1 ATOM 5417 H HE2 . LYS A 1 301 ? -13.94571 26.69879 1.64893 1.000 108.23920 ? 301 LYS A HE2 1 ATOM 5418 H HE3 . LYS A 1 301 ? -14.98211 25.52454 1.37985 1.000 108.23920 ? 301 LYS A HE3 1 ATOM 5419 H HZ1 . LYS A 1 301 ? -12.85459 24.77890 1.10066 1.000 115.39522 ? 301 LYS A HZ1 1 ATOM 5420 H HZ2 . LYS A 1 301 ? -13.53314 24.70111 -0.17678 1.000 115.39522 ? 301 LYS A HZ2 1 ATOM 5421 H HZ3 . LYS A 1 301 ? -12.58690 25.76816 0.07692 1.000 115.39522 ? 301 LYS A HZ3 1 ATOM 5422 N N . SER A 1 302 ? -16.90246 31.89716 1.80773 1.000 50.13848 ? 302 SER A N 1 ATOM 5423 C CA . SER A 1 302 ? -16.68782 33.31439 2.12370 1.000 52.55205 ? 302 SER A CA 1 ATOM 5424 C C . SER A 1 302 ? -15.19434 33.64334 2.07340 1.000 52.06685 ? 302 SER A C 1 ATOM 5425 O O . SER A 1 302 ? -14.53823 33.93210 3.07933 1.000 53.49912 ? 302 SER A O 1 ATOM 5426 C CB . SER A 1 302 ? -17.28288 33.65643 3.48558 1.000 64.91200 ? 302 SER A CB 1 ATOM 5427 O OG . SER A 1 302 ? -18.65161 33.30488 3.54530 1.000 87.28852 ? 302 SER A OG 1 ATOM 5428 H H . SER A 1 302 ? -16.94126 31.38800 2.49972 1.000 60.16617 ? 302 SER A H 1 ATOM 5429 H HA . SER A 1 302 ? -17.13758 33.84521 1.44779 1.000 63.06246 ? 302 SER A HA 1 ATOM 5430 H HB2 . SER A 1 302 ? -16.80192 33.16705 4.17121 1.000 77.89440 ? 302 SER A HB2 1 ATOM 5431 H HB3 . SER A 1 302 ? -17.19604 34.61069 3.63642 1.000 77.89440 ? 302 SER A HB3 1 ATOM 5432 H HG . SER A 1 302 ? -18.97233 33.52421 4.29004 1.000 104.74622 ? 302 SER A HG 1 ATOM 5433 N N . TRP A 1 303 ? -14.67073 33.61242 0.85567 1.000 45.48229 ? 303 TRP A N 1 ATOM 5434 C CA . TRP A 1 303 ? -13.28825 33.97581 0.60873 1.000 43.57036 ? 303 TRP A CA 1 ATOM 5435 C C . TRP A 1 303 ? -13.03656 35.43876 0.94759 1.000 43.74953 ? 303 TRP A C 1 ATOM 5436 O O . TRP A 1 303 ? -13.94321 36.27956 0.92192 1.000 42.51971 ? 303 TRP A O 1 ATOM 5437 C CB . TRP A 1 303 ? -12.93326 33.75881 -0.85907 1.000 43.81045 ? 303 TRP A CB 1 ATOM 5438 C CG . TRP A 1 303 ? -13.06248 32.34397 -1.31337 1.000 47.49297 ? 303 TRP A CG 1 ATOM 5439 C CD1 . TRP A 1 303 ? -14.08303 31.79700 -2.03646 1.000 48.15000 ? 303 TRP A CD1 1 ATOM 5440 C CD2 . TRP A 1 303 ? -12.12160 31.29483 -1.08229 1.000 42.46421 ? 303 TRP A CD2 1 ATOM 5441 N NE1 . TRP A 1 303 ? -13.83066 30.45954 -2.27370 1.000 45.94536 ? 303 TRP A NE1 1 ATOM 5442 C CE2 . TRP A 1 303 ? -12.63176 30.12817 -1.69785 1.000 43.54085 ? 303 TRP A CE2 1 ATOM 5443 C CE3 . TRP A 1 303 ? -10.89730 31.22600 -0.41562 1.000 42.05964 ? 303 TRP A CE3 1 ATOM 5444 C CZ2 . TRP A 1 303 ? -11.95839 28.90973 -1.65774 1.000 45.60799 ? 303 TRP A CZ2 1 ATOM 5445 C CZ3 . TRP A 1 303 ? -10.23244 30.01006 -0.37486 1.000 47.92062 ? 303 TRP A CZ3 1 ATOM 5446 C CH2 . TRP A 1 303 ? -10.76596 28.87005 -0.98720 1.000 50.73887 ? 303 TRP A CH2 1 ATOM 5447 H H . TRP A 1 303 ? -15.10141 33.38157 0.14798 1.000 54.57875 ? 303 TRP A H 1 ATOM 5448 H HA . TRP A 1 303 ? -12.72179 33.41923 1.16573 1.000 52.28444 ? 303 TRP A HA 1 ATOM 5449 H HB2 . TRP A 1 303 ? -13.52567 34.29893 -1.40517 1.000 52.57254 ? 303 TRP A HB2 1 ATOM 5450 H HB3 . TRP A 1 303 ? -12.01276 34.03053 -0.99960 1.000 52.57254 ? 303 TRP A HB3 1 ATOM 5451 H HD1 . TRP A 1 303 ? -14.83734 32.25708 -2.32673 1.000 57.78000 ? 303 TRP A HD1 1 ATOM 5452 H HE1 . TRP A 1 303 ? -14.34161 29.92327 -2.71068 1.000 55.13443 ? 303 TRP A HE1 1 ATOM 5453 H HE3 . TRP A 1 303 ? -10.53541 31.97933 -0.00766 1.000 50.47157 ? 303 TRP A HE3 1 ATOM 5454 H HZ2 . TRP A 1 303 ? -12.30565 28.15224 -2.07069 1.000 54.72959 ? 303 TRP A HZ2 1 ATOM 5455 H HZ3 . TRP A 1 303 ? -9.41662 29.95075 0.06766 1.000 57.50474 ? 303 TRP A HZ3 1 ATOM 5456 H HH2 . TRP A 1 303 ? -10.29939 28.06711 -0.93725 1.000 60.88664 ? 303 TRP A HH2 1 ATOM 5457 N N . ASN A 1 304 ? -11.76768 35.75449 1.21106 1.000 42.80819 ? 304 ASN A N 1 ATOM 5458 C CA . ASN A 1 304 ? -11.36900 37.12834 1.53037 1.000 42.89403 ? 304 ASN A CA 1 ATOM 5459 C C . ASN A 1 304 ? -11.07958 37.88305 0.22958 1.000 40.74604 ? 304 ASN A C 1 ATOM 5460 O O . ASN A 1 304 ? -9.94378 38.22839 -0.09727 1.000 42.98435 ? 304 ASN A O 1 ATOM 5461 C CB . ASN A 1 304 ? -10.15983 37.13502 2.45752 1.000 46.43152 ? 304 ASN A CB 1 ATOM 5462 C CG . ASN A 1 304 ? -10.47462 36.60020 3.85186 1.000 50.44546 ? 304 ASN A CG 1 ATOM 5463 O OD1 . ASN A 1 304 ? -11.58574 36.75899 4.37526 1.000 51.16199 ? 304 ASN A OD1 1 ATOM 5464 N ND2 . ASN A 1 304 ? -9.48965 35.96054 4.45851 1.000 51.24600 ? 304 ASN A ND2 1 ATOM 5465 H H . ASN A 1 304 ? -11.11795 35.19106 1.21142 1.000 51.36983 ? 304 ASN A H 1 ATOM 5466 H HA . ASN A 1 304 ? -12.10266 37.56756 1.98832 1.000 51.47283 ? 304 ASN A HA 1 ATOM 5467 H HB2 . ASN A 1 304 ? -9.46506 36.57767 2.07341 1.000 55.71783 ? 304 ASN A HB2 1 ATOM 5468 H HB3 . ASN A 1 304 ? -9.84008 38.04593 2.55192 1.000 55.71783 ? 304 ASN A HB3 1 ATOM 5469 H HD21 . ASN A 1 304 ? -9.60808 35.63678 5.24638 1.000 61.49520 ? 304 ASN A HD21 1 ATOM 5470 H HD22 . ASN A 1 304 ? -8.73040 35.86815 4.06531 1.000 61.49520 ? 304 ASN A HD22 1 ATOM 5471 N N . PHE A 1 305 ? -12.15607 38.14915 -0.51357 1.000 41.05463 ? 305 PHE A N 1 ATOM 5472 C CA . PHE A 1 305 ? -12.02979 38.79124 -1.81238 1.000 41.49512 ? 305 PHE A CA 1 ATOM 5473 C C . PHE A 1 305 ? -11.57122 40.23486 -1.66563 1.000 43.46502 ? 305 PHE A C 1 ATOM 5474 O O . PHE A 1 305 ? -11.99279 40.94500 -0.74233 1.000 39.69453 ? 305 PHE A O 1 ATOM 5475 C CB . PHE A 1 305 ? -13.36775 38.81086 -2.55711 1.000 44.91237 ? 305 PHE A CB 1 ATOM 5476 C CG . PHE A 1 305 ? -13.91222 37.45705 -2.92055 1.000 45.76274 ? 305 PHE A CG 1 ATOM 5477 C CD1 . PHE A 1 305 ? -13.26598 36.64614 -3.84313 1.000 45.19310 ? 305 PHE A CD1 1 ATOM 5478 C CD2 . PHE A 1 305 ? -15.10092 37.01669 -2.36012 1.000 49.10237 ? 305 PHE A CD2 1 ATOM 5479 C CE1 . PHE A 1 305 ? -13.79758 35.40361 -4.18190 1.000 44.95401 ? 305 PHE A CE1 1 ATOM 5480 C CE2 . PHE A 1 305 ? -15.62194 35.77800 -2.69518 1.000 49.61971 ? 305 PHE A CE2 1 ATOM 5481 C CZ . PHE A 1 305 ? -14.97907 34.98452 -3.60376 1.000 45.27163 ? 305 PHE A CZ 1 ATOM 5482 H H . PHE A 1 305 ? -12.96503 37.96702 -0.28549 1.000 49.26556 ? 305 PHE A H 1 ATOM 5483 H HA . PHE A 1 305 ? -11.38068 38.28454 -2.32504 1.000 49.79414 ? 305 PHE A HA 1 ATOM 5484 H HB2 . PHE A 1 305 ? -14.02612 39.24758 -1.99433 1.000 53.89484 ? 305 PHE A HB2 1 ATOM 5485 H HB3 . PHE A 1 305 ? -13.25313 39.30908 -3.38145 1.000 53.89484 ? 305 PHE A HB3 1 ATOM 5486 H HD1 . PHE A 1 305 ? -12.47414 36.93360 -4.23718 1.000 54.23172 ? 305 PHE A HD1 1 ATOM 5487 H HD2 . PHE A 1 305 ? -15.55274 37.55788 -1.75360 1.000 58.92284 ? 305 PHE A HD2 1 ATOM 5488 H HE1 . PHE A 1 305 ? -13.35848 34.85904 -4.79471 1.000 53.94481 ? 305 PHE A HE1 1 ATOM 5489 H HE2 . PHE A 1 305 ? -16.41162 35.48518 -2.30078 1.000 59.54365 ? 305 PHE A HE2 1 ATOM 5490 H HZ . PHE A 1 305 ? -15.33930 34.15848 -3.83353 1.000 54.32596 ? 305 PHE A HZ 1 ATOM 5491 N N . ILE A 1 306 ? -10.76224 40.68290 -2.61995 1.000 39.68769 ? 306 ILE A N 1 ATOM 5492 C CA . ILE A 1 306 ? -10.43829 42.09361 -2.78903 1.000 39.05399 ? 306 ILE A CA 1 ATOM 5493 C C . ILE A 1 306 ? -10.71189 42.47871 -4.24032 1.000 41.33247 ? 306 ILE A C 1 ATOM 5494 O O . ILE A 1 306 ? -10.31382 41.76089 -5.16886 1.000 42.41740 ? 306 ILE A O 1 ATOM 5495 C CB . ILE A 1 306 ? -8.97820 42.39269 -2.39032 1.000 39.25778 ? 306 ILE A CB 1 ATOM 5496 C CG1 . ILE A 1 306 ? -8.66647 43.87327 -2.59634 1.000 40.93802 ? 306 ILE A CG1 1 ATOM 5497 C CG2 . ILE A 1 306 ? -7.99369 41.48444 -3.14851 1.000 43.13061 ? 306 ILE A CG2 1 ATOM 5498 C CD1 . ILE A 1 306 ? -7.41248 44.32368 -1.92007 1.000 48.43395 ? 306 ILE A CD1 1 ATOM 5499 H H . ILE A 1 306 ? -10.37869 40.17377 -3.19726 1.000 47.62522 ? 306 ILE A H 1 ATOM 5500 H HA . ILE A 1 306 ? -11.01649 42.63335 -2.22754 1.000 46.86479 ? 306 ILE A HA 1 ATOM 5501 H HB . ILE A 1 306 ? -8.87217 42.19516 -1.44658 1.000 47.10934 ? 306 ILE A HB 1 ATOM 5502 H HG12 . ILE A 1 306 ? -8.56756 44.04199 -3.54642 1.000 49.12562 ? 306 ILE A HG12 1 ATOM 5503 H HG13 . ILE A 1 306 ? -9.39998 44.39894 -2.24063 1.000 49.12562 ? 306 ILE A HG13 1 ATOM 5504 H HG21 . ILE A 1 306 ? -7.09105 41.68043 -2.85230 1.000 51.75673 ? 306 ILE A HG21 1 ATOM 5505 H HG22 . ILE A 1 306 ? -8.20977 40.55777 -2.96011 1.000 51.75673 ? 306 ILE A HG22 1 ATOM 5506 H HG23 . ILE A 1 306 ? -8.07425 41.65607 -4.09980 1.000 51.75673 ? 306 ILE A HG23 1 ATOM 5507 H HD11 . ILE A 1 306 ? -7.32789 45.28487 -2.01933 1.000 58.12074 ? 306 ILE A HD11 1 ATOM 5508 H HD12 . ILE A 1 306 ? -7.45989 44.09117 -0.97954 1.000 58.12074 ? 306 ILE A HD12 1 ATOM 5509 H HD13 . ILE A 1 306 ? -6.65458 43.88058 -2.33255 1.000 58.12074 ? 306 ILE A HD13 1 ATOM 5510 N N . TRP A 1 307 ? -11.44135 43.57586 -4.42335 1.000 42.49982 ? 307 TRP A N 1 ATOM 5511 C CA . TRP A 1 307 ? -11.74519 44.14268 -5.73723 1.000 44.07767 ? 307 TRP A CA 1 ATOM 5512 C C . TRP A 1 307 ? -10.57634 45.00971 -6.19296 1.000 49.95273 ? 307 TRP A C 1 ATOM 5513 O O . TRP A 1 307 ? -10.18918 45.94101 -5.48429 1.000 49.78652 ? 307 TRP A O 1 ATOM 5514 C CB . TRP A 1 307 ? -13.02994 44.96592 -5.62744 1.000 49.79226 ? 307 TRP A CB 1 ATOM 5515 C CG . TRP A 1 307 ? -13.60598 45.46442 -6.91617 1.000 57.06517 ? 307 TRP A CG 1 ATOM 5516 C CD1 . TRP A 1 307 ? -13.10449 45.28381 -8.16768 1.000 63.64163 ? 307 TRP A CD1 1 ATOM 5517 C CD2 . TRP A 1 307 ? -14.80090 46.24276 -7.06897 1.000 72.26616 ? 307 TRP A CD2 1 ATOM 5518 N NE1 . TRP A 1 307 ? -13.91480 45.89885 -9.09669 1.000 69.02529 ? 307 TRP A NE1 1 ATOM 5519 C CE2 . TRP A 1 307 ? -14.96315 46.49363 -8.44560 1.000 77.93307 ? 307 TRP A CE2 1 ATOM 5520 C CE3 . TRP A 1 307 ? -15.75138 46.74856 -6.17382 1.000 78.33574 ? 307 TRP A CE3 1 ATOM 5521 C CZ2 . TRP A 1 307 ? -16.03792 47.22764 -8.95004 1.000 82.10358 ? 307 TRP A CZ2 1 ATOM 5522 C CZ3 . TRP A 1 307 ? -16.81662 47.47784 -6.67651 1.000 79.90030 ? 307 TRP A CZ3 1 ATOM 5523 C CH2 . TRP A 1 307 ? -16.95016 47.71042 -8.05100 1.000 80.08299 ? 307 TRP A CH2 1 ATOM 5524 H H . TRP A 1 307 ? -11.78585 44.02913 -3.77878 1.000 50.99978 ? 307 TRP A H 1 ATOM 5525 H HA . TRP A 1 307 ? -11.87097 43.44210 -6.39621 1.000 52.89320 ? 307 TRP A HA 1 ATOM 5526 H HB2 . TRP A 1 307 ? -13.70760 44.41459 -5.20587 1.000 59.75071 ? 307 TRP A HB2 1 ATOM 5527 H HB3 . TRP A 1 307 ? -12.84526 45.74323 -5.07738 1.000 59.75071 ? 307 TRP A HB3 1 ATOM 5528 H HD1 . TRP A 1 307 ? -12.32743 44.81343 -8.36721 1.000 76.36995 ? 307 TRP A HD1 1 ATOM 5529 H HE1 . TRP A 1 307 ? -13.78388 45.90792 -9.94662 1.000 82.83035 ? 307 TRP A HE1 1 ATOM 5530 H HE3 . TRP A 1 307 ? -15.66921 46.59790 -5.25979 1.000 94.00289 ? 307 TRP A HE3 1 ATOM 5531 H HZ2 . TRP A 1 307 ? -16.13066 47.38277 -9.86230 1.000 98.52429 ? 307 TRP A HZ2 1 ATOM 5532 H HZ3 . TRP A 1 307 ? -17.45388 47.81875 -6.09121 1.000 95.88036 ? 307 TRP A HZ3 1 ATOM 5533 H HH2 . TRP A 1 307 ? -17.67518 48.20415 -8.35998 1.000 96.09959 ? 307 TRP A HH2 1 ATOM 5534 N N . LEU A 1 308 ? -10.02200 44.72504 -7.37691 1.000 48.77012 ? 308 LEU A N 1 ATOM 5535 C CA . LEU A 1 308 ? -8.85565 45.44274 -7.88829 1.000 56.69590 ? 308 LEU A CA 1 ATOM 5536 C C . LEU A 1 308 ? -9.25525 46.47667 -8.93836 1.000 68.13068 ? 308 LEU A C 1 ATOM 5537 O O . LEU A 1 308 ? -10.00701 46.16988 -9.86955 1.000 65.01560 ? 308 LEU A O 1 ATOM 5538 C CB . LEU A 1 308 ? -7.83620 44.47025 -8.49169 1.000 49.42795 ? 308 LEU A CB 1 ATOM 5539 C CG . LEU A 1 308 ? -7.28351 43.37972 -7.57492 1.000 50.08583 ? 308 LEU A CG 1 ATOM 5540 C CD1 . LEU A 1 308 ? -6.43810 42.41065 -8.37776 1.000 62.05552 ? 308 LEU A CD1 1 ATOM 5541 C CD2 . LEU A 1 308 ? -6.47528 43.98065 -6.45018 1.000 56.13361 ? 308 LEU A CD2 1 ATOM 5542 H H . LEU A 1 308 ? -10.30988 44.11168 -7.90655 1.000 58.52415 ? 308 LEU A H 1 ATOM 5543 H HA . LEU A 1 308 ? -8.44854 45.91776 -7.14700 1.000 68.03509 ? 308 LEU A HA 1 ATOM 5544 H HB2 . LEU A 1 308 ? -8.25975 44.02153 -9.24013 1.000 59.31354 ? 308 LEU A HB2 1 ATOM 5545 H HB3 . LEU A 1 308 ? -7.07757 44.98897 -8.80203 1.000 59.31354 ? 308 LEU A HB3 1 ATOM 5546 H HG . LEU A 1 308 ? -8.02251 42.89249 -7.17819 1.000 60.10299 ? 308 LEU A HG 1 ATOM 5547 H HD11 . LEU A 1 308 ? -5.88046 41.89984 -7.77031 1.000 74.46662 ? 308 LEU A HD11 1 ATOM 5548 H HD12 . LEU A 1 308 ? -7.02331 41.81415 -8.87033 1.000 74.46662 ? 308 LEU A HD12 1 ATOM 5549 H HD13 . LEU A 1 308 ? -5.88223 42.91236 -8.99435 1.000 74.46662 ? 308 LEU A HD13 1 ATOM 5550 H HD21 . LEU A 1 308 ? -6.12201 43.26561 -5.89809 1.000 67.36033 ? 308 LEU A HD21 1 ATOM 5551 H HD22 . LEU A 1 308 ? -5.74669 44.49869 -6.82661 1.000 67.36033 ? 308 LEU A HD22 1 ATOM 5552 H HD23 . LEU A 1 308 ? -7.04996 44.55476 -5.92005 1.000 67.36033 ? 308 LEU A HD23 1 ATOM 5553 N N . THR A 1 309 ? -8.71910 47.68805 -8.80444 1.000 86.04774 ? 309 THR A N 1 ATOM 5554 C CA . THR A 1 309 ? -9.02887 48.79879 -9.70918 1.000 101.58925 ? 309 THR A CA 1 ATOM 5555 C C . THR A 1 309 ? -8.02876 48.89807 -10.86043 1.000 101.66838 ? 309 THR A C 1 ATOM 5556 O O . THR A 1 309 ? -7.48447 49.96673 -11.14269 1.000 103.00145 ? 309 THR A O 1 ATOM 5557 C CB . THR A 1 309 ? -9.07114 50.10500 -8.92267 1.000 78.16331 ? 309 THR A CB 1 ATOM 5558 H H . THR A 1 309 ? -8.16096 47.89824 -8.18484 1.000 103.25729 ? 309 THR A H 1 ATOM 5559 H HA . THR A 1 309 ? -9.90537 48.64063 -10.09341 1.000 121.90710 ? 309 THR A HA 1 ATOM 5560 N N . ASP A 1 310 ? -7.79075 47.78047 -11.54765 0.000 82.60014 ? 310 ASP A N 1 ATOM 5561 C CA . ASP A 1 310 ? -6.82223 47.72304 -12.63862 0.000 77.15873 ? 310 ASP A CA 1 ATOM 5562 C C . ASP A 1 310 ? -7.39717 46.96086 -13.82508 0.000 70.52876 ? 310 ASP A C 1 ATOM 5563 O O . ASP A 1 310 ? -6.72544 46.11983 -14.43190 0.000 67.65915 ? 310 ASP A O 1 ATOM 5564 C CB . ASP A 1 310 ? -5.51272 47.08191 -12.17741 0.000 76.67616 ? 310 ASP A CB 1 ATOM 5565 H H . ASP A 1 310 ? -8.18511 47.03124 -11.39688 0.000 99.12017 ? 310 ASP A H 1 ATOM 5566 H HA . ASP A 1 310 ? -6.63482 48.62928 -12.92933 0.000 92.59047 ? 310 ASP A HA 1 ATOM 5567 N N . SER A 1 311 ? -8.65111 47.25038 -14.17658 0.000 68.61716 ? 311 SER A N 1 ATOM 5568 C CA . SER A 1 311 ? -9.31633 46.58834 -15.29883 0.000 63.71896 ? 311 SER A CA 1 ATOM 5569 C C . SER A 1 311 ? -9.02072 47.37275 -16.57484 0.000 60.60888 ? 311 SER A C 1 ATOM 5570 O O . SER A 1 311 ? -9.81455 48.19000 -17.04634 0.000 59.05288 ? 311 SER A O 1 ATOM 5571 C CB . SER A 1 311 ? -10.81364 46.47234 -15.04127 0.000 64.13685 ? 311 SER A CB 1 ATOM 5572 H H . SER A 1 311 ? -9.14181 47.83236 -13.77644 0.000 82.34059 ? 311 SER A H 1 ATOM 5573 H HA . SER A 1 311 ? -8.95204 45.69492 -15.39880 0.000 76.46276 ? 311 SER A HA 1 ATOM 5574 N N . GLU A 1 312 ? -7.84449 47.11003 -17.13939 0.000 60.25843 ? 312 GLU A N 1 ATOM 5575 C CA . GLU A 1 312 ? -7.40067 47.70926 -18.39171 0.000 59.01351 ? 312 GLU A CA 1 ATOM 5576 C C . GLU A 1 312 ? -7.18457 46.63287 -19.44901 0.000 59.23669 ? 312 GLU A C 1 ATOM 5577 O O . GLU A 1 312 ? -6.18915 46.63554 -20.17677 0.000 59.06108 ? 312 GLU A O 1 ATOM 5578 C CB . GLU A 1 312 ? -6.12563 48.52291 -18.18362 0.000 57.47601 ? 312 GLU A CB 1 ATOM 5579 H H . GLU A 1 312 ? -7.26771 46.56855 -16.80215 0.000 72.31012 ? 312 GLU A H 1 ATOM 5580 H HA . GLU A 1 312 ? -8.08985 48.31286 -18.71045 0.000 70.81621 ? 312 GLU A HA 1 ATOM 5581 N N . LEU A 1 313 ? -8.12660 45.69842 -19.54205 0.000 60.67514 ? 313 LEU A N 1 ATOM 5582 C CA . LEU A 1 313 ? -7.98808 44.56513 -20.43985 0.000 65.73454 ? 313 LEU A CA 1 ATOM 5583 C C . LEU A 1 313 ? -8.02511 45.01976 -21.89829 0.000 65.80732 ? 313 LEU A C 1 ATOM 5584 O O . LEU A 1 313 ? -8.41586 46.14409 -22.22545 0.000 62.23666 ? 313 LEU A O 1 ATOM 5585 C CB . LEU A 1 313 ? -9.09557 43.54589 -20.17762 0.000 69.36224 ? 313 LEU A CB 1 ATOM 5586 H H . LEU A 1 313 ? -8.85925 45.70037 -19.09169 0.000 72.81016 ? 313 LEU A H 1 ATOM 5587 H HA . LEU A 1 313 ? -7.13161 44.13817 -20.28153 0.000 78.88145 ? 313 LEU A HA 1 ATOM 5588 N N . LYS A 1 314 ? -7.60602 44.11571 -22.78194 0.000 68.61114 ? 314 LYS A N 1 ATOM 5589 C CA . LYS A 1 314 ? -7.61765 44.35183 -24.21748 0.000 67.25310 ? 314 LYS A CA 1 ATOM 5590 C C . LYS A 1 314 ? -8.08486 43.08609 -24.92014 0.000 68.95044 ? 314 LYS A C 1 ATOM 5591 O O . LYS A 1 314 ? -7.81784 41.97061 -24.46534 0.000 71.97660 ? 314 LYS A O 1 ATOM 5592 C CB . LYS A 1 314 ? -6.23329 44.76258 -24.73576 0.000 64.18483 ? 314 LYS A CB 1 ATOM 5593 H H . LYS A 1 314 ? -7.30367 43.34010 -22.56604 0.000 82.33336 ? 314 LYS A H 1 ATOM 5594 H HA . LYS A 1 314 ? -8.23875 45.06653 -24.42800 0.000 80.70373 ? 314 LYS A HA 1 ATOM 5595 N N . GLY A 1 315 ? -8.78770 43.27036 -26.03693 0.000 65.16873 ? 315 GLY A N 1 ATOM 5596 C CA . GLY A 1 315 ? -9.33679 42.16324 -26.78662 0.000 64.28983 ? 315 GLY A CA 1 ATOM 5597 C C . GLY A 1 315 ? -10.65678 41.63353 -26.27505 0.000 63.83046 ? 315 GLY A C 1 ATOM 5598 O O . GLY A 1 315 ? -11.26771 40.79036 -26.94519 0.000 61.88620 ? 315 GLY A O 1 ATOM 5599 H H . GLY A 1 315 ? -8.95796 44.04094 -26.37872 0.000 78.20247 ? 315 GLY A H 1 ATOM 5600 H HA2 . GLY A 1 315 ? -9.46887 42.44654 -27.70488 0.000 77.14780 ? 315 GLY A HA2 1 ATOM 5601 H HA3 . GLY A 1 315 ? -8.69956 41.43210 -26.77025 0.000 77.14780 ? 315 GLY A HA3 1 ATOM 5602 N N . LYS A 1 316 ? -11.12010 42.09351 -25.11820 0.000 64.76897 ? 316 LYS A N 1 ATOM 5603 C CA . LYS A 1 316 ? -12.38376 41.63459 -24.56098 0.000 62.50316 ? 316 LYS A CA 1 ATOM 5604 C C . LYS A 1 316 ? -13.54060 42.26146 -25.33875 0.000 57.94825 ? 316 LYS A C 1 ATOM 5605 O O . LYS A 1 316 ? -13.35658 42.92823 -26.36102 0.000 57.17341 ? 316 LYS A O 1 ATOM 5606 C CB . LYS A 1 316 ? -12.46023 41.97206 -23.07519 0.000 65.20234 ? 316 LYS A CB 1 ATOM 5607 H H . LYS A 1 316 ? -10.71639 42.67758 -24.63294 0.000 77.72277 ? 316 LYS A H 1 ATOM 5608 H HA . LYS A 1 316 ? -12.42705 40.67089 -24.66252 0.000 75.00380 ? 316 LYS A HA 1 ATOM 5609 N N . SER A 1 317 ? -14.75978 42.04792 -24.84650 0.000 56.70849 ? 317 SER A N 1 ATOM 5610 C CA . SER A 1 317 ? -15.96152 42.62263 -25.43680 0.000 55.26457 ? 317 SER A CA 1 ATOM 5611 C C . SER A 1 317 ? -16.49473 43.81016 -24.64800 0.000 55.48386 ? 317 SER A C 1 ATOM 5612 O O . SER A 1 317 ? -16.93237 44.79742 -25.24659 0.000 55.89405 ? 317 SER A O 1 ATOM 5613 C CB . SER A 1 317 ? -17.05627 41.55630 -25.54647 0.000 53.63313 ? 317 SER A CB 1 ATOM 5614 H H . SER A 1 317 ? -14.91770 41.56184 -24.15485 0.000 68.05019 ? 317 SER A H 1 ATOM 5615 H HA . SER A 1 317 ? -15.75375 42.92912 -26.33334 0.000 66.31748 ? 317 SER A HA 1 ATOM 5616 N N . GLU A 1 318 ? -16.46569 43.74055 -23.32056 0.000 57.01500 ? 318 GLU A N 1 ATOM 5617 C CA . GLU A 1 318 ? -16.96203 44.82664 -22.48370 0.000 58.60377 ? 318 GLU A CA 1 ATOM 5618 C C . GLU A 1 318 ? -16.17634 44.86750 -21.17373 0.000 61.33287 ? 318 GLU A C 1 ATOM 5619 O O . GLU A 1 318 ? -16.74223 44.95722 -20.08301 0.000 62.40778 ? 318 GLU A O 1 ATOM 5620 C CB . GLU A 1 318 ? -18.46185 44.67183 -22.22979 0.000 57.88678 ? 318 GLU A CB 1 ATOM 5621 H H . GLU A 1 318 ? -16.16090 43.06940 -22.87754 0.000 68.41800 ? 318 GLU A H 1 ATOM 5622 H HA . GLU A 1 318 ? -16.81641 45.66656 -22.94655 0.000 70.32453 ? 318 GLU A HA 1 ATOM 5623 N N . SER A 1 319 ? -14.84853 44.80120 -21.27226 0.000 62.69495 ? 319 SER A N 1 ATOM 5624 C CA . SER A 1 319 ? -13.98676 44.88942 -20.09884 0.000 65.65076 ? 319 SER A CA 1 ATOM 5625 C C . SER A 1 319 ? -14.26468 43.74754 -19.12823 0.000 68.64933 ? 319 SER A C 1 ATOM 5626 O O . SER A 1 319 ? -14.81224 42.71291 -19.52250 0.000 67.26234 ? 319 SER A O 1 ATOM 5627 C CB . SER A 1 319 ? -14.17682 46.23919 -19.40372 1.000 76.01314 ? 319 SER A CB 1 ATOM 5628 H H . SER A 1 319 ? -14.42169 44.70471 -22.01260 0.000 75.23394 ? 319 SER A H 1 ATOM 5629 H HA . SER A 1 319 ? -13.06129 44.81936 -20.38080 0.000 78.78091 ? 319 SER A HA 1 ATOM 5630 N N . ILE A 1 320 ? -13.89041 43.92198 -17.85945 1.000 82.83456 ? 320 ILE A N 1 ATOM 5631 C CA . ILE A 1 320 ? -14.07301 42.87851 -16.85514 1.000 73.37188 ? 320 ILE A CA 1 ATOM 5632 C C . ILE A 1 320 ? -13.67229 43.38974 -15.47703 1.000 67.22838 ? 320 ILE A C 1 ATOM 5633 O O . ILE A 1 320 ? -12.59851 43.98031 -15.31032 1.000 66.45236 ? 320 ILE A O 1 ATOM 5634 C CB . ILE A 1 320 ? -13.26175 41.61914 -17.22150 1.000 64.02779 ? 320 ILE A CB 1 ATOM 5635 H H . ILE A 1 320 ? -13.52687 44.63995 -17.55619 1.000 99.40148 ? 320 ILE A H 1 ATOM 5636 H HA . ILE A 1 320 ? -15.01566 42.65238 -16.82097 1.000 88.04626 ? 320 ILE A HA 1 ATOM 5637 N N . ASP A 1 321 ? -14.53625 43.17866 -14.48150 1.000 64.57832 ? 321 ASP A N 1 ATOM 5638 C CA . ASP A 1 321 ? -14.15161 43.42194 -13.09748 1.000 56.26464 ? 321 ASP A CA 1 ATOM 5639 C C . ASP A 1 321 ? -13.18084 42.34284 -12.63519 1.000 53.62439 ? 321 ASP A C 1 ATOM 5640 O O . ASP A 1 321 ? -13.39857 41.15047 -12.88167 1.000 56.02168 ? 321 ASP A O 1 ATOM 5641 C CB . ASP A 1 321 ? -15.37326 43.44615 -12.17938 1.000 64.94628 ? 321 ASP A CB 1 ATOM 5642 C CG . ASP A 1 321 ? -16.18506 44.70741 -12.32883 1.000 77.95179 ? 321 ASP A CG 1 ATOM 5643 O OD1 . ASP A 1 321 ? -15.63428 45.79478 -12.06129 1.000 80.36452 ? 321 ASP A OD1 1 ATOM 5644 O OD2 . ASP A 1 321 ? -17.37320 44.61078 -12.70108 1.000 88.36939 ? 321 ASP A OD2 1 ATOM 5645 H H . ASP A 1 321 ? -15.34255 42.89742 -14.58342 1.000 77.49398 ? 321 ASP A H 1 ATOM 5646 H HA . ASP A 1 321 ? -13.72079 44.28910 -13.03969 1.000 67.51756 ? 321 ASP A HA 1 ATOM 5647 H HB2 . ASP A 1 321 ? -15.94567 42.69301 -12.39392 1.000 77.93554 ? 321 ASP A HB2 1 ATOM 5648 H HB3 . ASP A 1 321 ? -15.07782 43.38626 -11.25741 1.000 77.93554 ? 321 ASP A HB3 1 ATOM 5649 N N . ILE A 1 322 ? -12.11452 42.76216 -11.96005 1.000 52.35670 ? 322 ILE A N 1 ATOM 5650 C CA . ILE A 1 322 ? -11.00756 41.89139 -11.58204 1.000 47.05075 ? 322 ILE A CA 1 ATOM 5651 C C . ILE A 1 322 ? -10.96593 41.75767 -10.06225 1.000 42.50818 ? 322 ILE A C 1 ATOM 5652 O O . ILE A 1 322 ? -11.11497 42.75053 -9.34464 1.000 44.54001 ? 322 ILE A O 1 ATOM 5653 C CB . ILE A 1 322 ? -9.67416 42.46070 -12.10033 1.000 53.22639 ? 322 ILE A CB 1 ATOM 5654 C CG1 . ILE A 1 322 ? -9.59864 42.46811 -13.63487 1.000 65.42052 ? 322 ILE A CG1 1 ATOM 5655 C CG2 . ILE A 1 322 ? -8.53744 41.67135 -11.52031 1.000 56.26783 ? 322 ILE A CG2 1 ATOM 5656 C CD1 . ILE A 1 322 ? -10.40480 41.40930 -14.32083 1.000 65.61159 ? 322 ILE A CD1 1 ATOM 5657 H H . ILE A 1 322 ? -12.00693 43.57525 -11.70138 1.000 62.82804 ? 322 ILE A H 1 ATOM 5658 H HA . ILE A 1 322 ? -11.15417 41.00936 -11.95811 1.000 56.46090 ? 322 ILE A HA 1 ATOM 5659 H HB . ILE A 1 322 ? -9.61570 43.38556 -11.81377 1.000 63.87167 ? 322 ILE A HB 1 ATOM 5660 H HG12 . ILE A 1 322 ? -9.91878 43.32685 -13.95264 1.000 78.50462 ? 322 ILE A HG12 1 ATOM 5661 H HG13 . ILE A 1 322 ? -8.67307 42.34175 -13.89609 1.000 78.50462 ? 322 ILE A HG13 1 ATOM 5662 H HG21 . ILE A 1 322 ? -7.78363 41.70884 -12.12963 1.000 67.52140 ? 322 ILE A HG21 1 ATOM 5663 H HG22 . ILE A 1 322 ? -8.29046 42.05550 -10.66455 1.000 67.52140 ? 322 ILE A HG22 1 ATOM 5664 H HG23 . ILE A 1 322 ? -8.82053 40.75134 -11.40056 1.000 67.52140 ? 322 ILE A HG23 1 ATOM 5665 H HD11 . ILE A 1 322 ? -10.15117 41.37582 -15.25649 1.000 78.73391 ? 322 ILE A HD11 1 ATOM 5666 H HD12 . ILE A 1 322 ? -10.22691 40.55408 -13.89909 1.000 78.73391 ? 322 ILE A HD12 1 ATOM 5667 H HD13 . ILE A 1 322 ? -11.34645 41.62797 -14.24099 1.000 78.73391 ? 322 ILE A HD13 1 ATOM 5668 N N . TYR A 1 323 ? -10.72992 40.53832 -9.57637 1.000 39.43776 ? 323 TYR A N 1 ATOM 5669 C CA . TYR A 1 323 ? -10.66402 40.26469 -8.14278 1.000 37.68101 ? 323 TYR A CA 1 ATOM 5670 C C . TYR A 1 323 ? -9.42426 39.44952 -7.80090 1.000 40.98305 ? 323 TYR A C 1 ATOM 5671 O O . TYR A 1 323 ? -8.84321 38.77877 -8.65549 1.000 41.31984 ? 323 TYR A O 1 ATOM 5672 C CB . TYR A 1 323 ? -11.89179 39.48580 -7.66145 1.000 41.62453 ? 323 TYR A CB 1 ATOM 5673 C CG . TYR A 1 323 ? -13.14247 40.31108 -7.62954 1.000 41.01239 ? 323 TYR A CG 1 ATOM 5674 C CD1 . TYR A 1 323 ? -13.91436 40.48185 -8.76284 1.000 45.19027 ? 323 TYR A CD1 1 ATOM 5675 C CD2 . TYR A 1 323 ? -13.55893 40.91431 -6.45454 1.000 46.08787 ? 323 TYR A CD2 1 ATOM 5676 C CE1 . TYR A 1 323 ? -15.06603 41.24729 -8.73128 1.000 51.75437 ? 323 TYR A CE1 1 ATOM 5677 C CE2 . TYR A 1 323 ? -14.70804 41.66151 -6.40735 1.000 46.77254 ? 323 TYR A CE2 1 ATOM 5678 C CZ . TYR A 1 323 ? -15.45974 41.82668 -7.54759 1.000 55.43005 ? 323 TYR A CZ 1 ATOM 5679 O OH . TYR A 1 323 ? -16.60428 42.58988 -7.49623 1.000 57.51594 ? 323 TYR A OH 1 ATOM 5680 H H . TYR A 1 323 ? -10.60282 39.84301 -10.06626 1.000 47.32531 ? 323 TYR A H 1 ATOM 5681 H HA . TYR A 1 323 ? -10.61018 41.11634 -7.68159 1.000 45.21722 ? 323 TYR A HA 1 ATOM 5682 H HB2 . TYR A 1 323 ? -12.04339 38.73799 -8.26036 1.000 49.94943 ? 323 TYR A HB2 1 ATOM 5683 H HB3 . TYR A 1 323 ? -11.72523 39.16224 -6.76230 1.000 49.94943 ? 323 TYR A HB3 1 ATOM 5684 H HD1 . TYR A 1 323 ? -13.65569 40.07609 -9.55868 1.000 54.22832 ? 323 TYR A HD1 1 ATOM 5685 H HD2 . TYR A 1 323 ? -13.04991 40.81080 -5.68312 1.000 55.30545 ? 323 TYR A HD2 1 ATOM 5686 H HE1 . TYR A 1 323 ? -15.56968 41.36911 -9.50355 1.000 62.10525 ? 323 TYR A HE1 1 ATOM 5687 H HE2 . TYR A 1 323 ? -14.97766 42.05445 -5.60873 1.000 56.12705 ? 323 TYR A HE2 1 ATOM 5688 H HH . TYR A 1 323 ? -16.71503 42.88972 -6.71942 1.000 69.01912 ? 323 TYR A HH 1 ATOM 5689 N N . SER A 1 324 ? -9.03730 39.48442 -6.52743 1.000 40.11912 ? 324 SER A N 1 ATOM 5690 C CA . SER A 1 324 ? -8.03538 38.56163 -6.00952 1.000 37.64405 ? 324 SER A CA 1 ATOM 5691 C C . SER A 1 324 ? -8.46185 38.14821 -4.59985 1.000 39.36301 ? 324 SER A C 1 ATOM 5692 O O . SER A 1 324 ? -9.60093 38.38227 -4.17873 1.000 38.92246 ? 324 SER A O 1 ATOM 5693 C CB . SER A 1 324 ? -6.63235 39.18361 -6.04310 1.000 38.75826 ? 324 SER A CB 1 ATOM 5694 O OG . SER A 1 324 ? -5.63893 38.25586 -5.63378 1.000 40.32016 ? 324 SER A OG 1 ATOM 5695 H H . SER A 1 324 ? -9.34294 40.03649 -5.94314 1.000 48.14295 ? 324 SER A H 1 ATOM 5696 H HA . SER A 1 324 ? -8.02210 37.77303 -6.57417 1.000 45.17286 ? 324 SER A HA 1 ATOM 5697 H HB2 . SER A 1 324 ? -6.43869 39.46940 -6.94959 1.000 46.50991 ? 324 SER A HB2 1 ATOM 5698 H HB3 . SER A 1 324 ? -6.61396 39.94609 -5.44378 1.000 46.50991 ? 324 SER A HB3 1 ATOM 5699 H HG . SER A 1 324 ? -5.67206 37.56835 -6.11526 1.000 48.38419 ? 324 SER A HG 1 ATOM 5700 N N . ILE A 1 325 ? -7.55616 37.46660 -3.90062 1.000 38.79383 ? 325 ILE A N 1 ATOM 5701 C CA . ILE A 1 325 ? -7.71057 37.11034 -2.49453 1.000 40.08609 ? 325 ILE A CA 1 ATOM 5702 C C . ILE A 1 325 ? -6.67544 37.90354 -1.70788 1.000 47.07212 ? 325 ILE A C 1 ATOM 5703 O O . ILE A 1 325 ? -5.49460 37.91744 -2.07314 1.000 45.05197 ? 325 ILE A O 1 ATOM 5704 C CB . ILE A 1 325 ? -7.50800 35.60008 -2.27153 1.000 42.52055 ? 325 ILE A CB 1 ATOM 5705 C CG1 . ILE A 1 325 ? -8.56231 34.77032 -3.00249 1.000 49.97614 ? 325 ILE A CG1 1 ATOM 5706 C CG2 . ILE A 1 325 ? -7.51577 35.26201 -0.77931 1.000 46.13988 ? 325 ILE A CG2 1 ATOM 5707 C CD1 . ILE A 1 325 ? -9.98780 35.09818 -2.64117 1.000 50.87917 ? 325 ILE A CD1 1 ATOM 5708 H H . ILE A 1 325 ? -6.81393 37.18898 -4.23472 1.000 46.55260 ? 325 ILE A H 1 ATOM 5709 H HA . ILE A 1 325 ? -8.60056 37.34982 -2.19210 1.000 48.10331 ? 325 ILE A HA 1 ATOM 5710 H HB . ILE A 1 325 ? -6.64045 35.37542 -2.64273 1.000 51.02466 ? 325 ILE A HB 1 ATOM 5711 H HG12 . ILE A 1 325 ? -8.46231 34.91675 -3.95614 1.000 59.97137 ? 325 ILE A HG12 1 ATOM 5712 H HG13 . ILE A 1 325 ? -8.41654 33.83439 -2.79347 1.000 59.97137 ? 325 ILE A HG13 1 ATOM 5713 H HG21 . ILE A 1 325 ? -7.41507 34.30322 -0.67219 1.000 55.36785 ? 325 ILE A HG21 1 ATOM 5714 H HG22 . ILE A 1 325 ? -6.77922 35.72227 -0.34739 1.000 55.36785 ? 325 ILE A HG22 1 ATOM 5715 H HG23 . ILE A 1 325 ? -8.35784 35.55122 -0.39436 1.000 55.36785 ? 325 ILE A HG23 1 ATOM 5716 H HD11 . ILE A 1 325 ? -10.58164 34.50999 -3.13340 1.000 61.05501 ? 325 ILE A HD11 1 ATOM 5717 H HD12 . ILE A 1 325 ? -10.10967 34.96870 -1.68760 1.000 61.05501 ? 325 ILE A HD12 1 ATOM 5718 H HD13 . ILE A 1 325 ? -10.16846 36.02200 -2.87529 1.000 61.05501 ? 325 ILE A HD13 1 ATOM 5719 N N . ASP A 1 326 ? -7.09444 38.52233 -0.61031 1.000 44.70988 ? 326 ASP A N 1 ATOM 5720 C CA A ASP A 1 326 ? -6.19432 39.30221 0.23825 0.681 49.87771 ? 326 ASP A CA 1 ATOM 5721 C CA B ASP A 1 326 ? -6.19236 39.29951 0.23568 0.319 50.06196 ? 326 ASP A CA 1 ATOM 5722 C C . ASP A 1 326 ? -5.78881 38.43169 1.42264 1.000 57.49206 ? 326 ASP A C 1 ATOM 5723 O O . ASP A 1 326 ? -6.53110 38.31363 2.39860 1.000 61.87631 ? 326 ASP A O 1 ATOM 5724 C CB A ASP A 1 326 ? -6.86086 40.59532 0.69751 0.681 46.95061 ? 326 ASP A CB 1 ATOM 5725 C CB B ASP A 1 326 ? -6.85162 40.59786 0.68845 0.319 47.10971 ? 326 ASP A CB 1 ATOM 5726 C CG A ASP A 1 326 ? -5.94017 41.46043 1.53640 0.681 52.89402 ? 326 ASP A CG 1 ATOM 5727 C CG B ASP A 1 326 ? -5.90388 41.48955 1.46646 0.319 52.99221 ? 326 ASP A CG 1 ATOM 5728 O OD1 A ASP A 1 326 ? -4.73713 41.14622 1.62081 0.681 52.35038 ? 326 ASP A OD1 1 ATOM 5729 O OD1 B ASP A 1 326 ? -4.81408 41.80373 0.94104 0.319 55.80898 ? 326 ASP A OD1 1 ATOM 5730 O OD2 A ASP A 1 326 ? -6.42058 42.46034 2.10660 0.681 46.95597 ? 326 ASP A OD2 1 ATOM 5731 O OD2 B ASP A 1 326 ? -6.24973 41.87500 2.60271 0.319 50.59177 ? 326 ASP A OD2 1 ATOM 5732 H H A ASP A 1 326 ? -7.90748 38.50615 -0.33049 0.681 53.65186 ? 326 ASP A H 1 ATOM 5733 H H B ASP A 1 326 ? -7.90741 38.50722 -0.33021 0.319 53.65186 ? 326 ASP A H 1 ATOM 5734 H HA A ASP A 1 326 ? -5.39778 39.53078 -0.26591 0.681 59.85325 ? 326 ASP A HA 1 ATOM 5735 H HA B ASP A 1 326 ? -5.39433 39.52201 -0.26884 0.319 60.07436 ? 326 ASP A HA 1 ATOM 5736 H HB2 A ASP A 1 326 ? -7.12766 41.10798 -0.08153 0.681 56.34074 ? 326 ASP A HB2 1 ATOM 5737 H HB2 B ASP A 1 326 ? -7.15438 41.08852 -0.09161 0.319 56.53165 ? 326 ASP A HB2 1 ATOM 5738 H HB3 A ASP A 1 326 ? -7.63926 40.37718 1.23361 0.681 56.34074 ? 326 ASP A HB3 1 ATOM 5739 H HB3 B ASP A 1 326 ? -7.60558 40.38760 1.26136 0.319 56.53165 ? 326 ASP A HB3 1 ATOM 5740 N N . ASN A 1 327 ? -4.60958 37.82023 1.32582 1.000 72.16956 ? 327 ASN A N 1 ATOM 5741 C CA A ASN A 1 327 ? -4.02075 37.02687 2.39648 0.550 82.33390 ? 327 ASN A CA 1 ATOM 5742 C CA B ASN A 1 327 ? -4.03504 37.06393 2.43438 0.450 82.29025 ? 327 ASN A CA 1 ATOM 5743 C C . ASN A 1 327 ? -2.54550 37.40445 2.49890 1.000 95.84640 ? 327 ASN A C 1 ATOM 5744 O O . ASN A 1 327 ? -2.06883 38.32213 1.82245 1.000 100.15997 ? 327 ASN A O 1 ATOM 5745 C CB A ASN A 1 327 ? -4.22049 35.52296 2.14770 0.550 79.08307 ? 327 ASN A CB 1 ATOM 5746 C CB B ASN A 1 327 ? -4.30214 35.55719 2.27774 0.450 79.14142 ? 327 ASN A CB 1 ATOM 5747 C CG A ASN A 1 327 ? -3.34778 34.97939 1.01849 0.550 72.67175 ? 327 ASN A CG 1 ATOM 5748 C CG B ASN A 1 327 ? -5.72005 35.15527 2.70315 0.450 67.04398 ? 327 ASN A CG 1 ATOM 5749 O OD1 A ASN A 1 327 ? -2.51342 35.68466 0.45254 0.550 79.17996 ? 327 ASN A OD1 1 ATOM 5750 O OD1 B ASN A 1 327 ? -6.38955 35.87692 3.44428 0.450 58.92353 ? 327 ASN A OD1 1 ATOM 5751 N ND2 A ASN A 1 327 ? -3.54204 33.70775 0.69311 0.550 69.03179 ? 327 ASN A ND2 1 ATOM 5752 N ND2 B ASN A 1 327 ? -6.16708 33.98339 2.24872 0.450 52.30905 ? 327 ASN A ND2 1 ATOM 5753 H H A ASN A 1 327 ? -4.11506 37.85264 0.62297 0.550 86.60347 ? 327 ASN A H 1 ATOM 5754 H H B ASN A 1 327 ? -4.11847 37.82957 0.61990 0.450 86.60347 ? 327 ASN A H 1 ATOM 5755 H HA A ASN A 1 327 ? -4.46310 37.25503 3.22904 0.550 98.80068 ? 327 ASN A HA 1 ATOM 5756 H HA B ASN A 1 327 ? -4.45386 37.34764 3.26203 0.450 98.74831 ? 327 ASN A HA 1 ATOM 5757 H HB2 A ASN A 1 327 ? -3.99677 35.03784 2.95733 0.550 94.89969 ? 327 ASN A HB2 1 ATOM 5758 H HB2 B ASN A 1 327 ? -4.18811 35.31161 1.34630 0.450 94.96970 ? 327 ASN A HB2 1 ATOM 5759 H HB3 A ASN A 1 327 ? -5.14760 35.36377 1.91102 0.550 94.89969 ? 327 ASN A HB3 1 ATOM 5760 H HB3 B ASN A 1 327 ? -3.67349 35.06617 2.82965 0.450 94.96970 ? 327 ASN A HB3 1 ATOM 5761 H HD21 A ASN A 1 327 ? -3.07812 33.34917 0.06399 0.550 82.83815 ? 327 ASN A HD21 1 ATOM 5762 H HD21 B ASN A 1 327 ? -5.66639 33.49811 1.74531 0.450 62.77086 ? 327 ASN A HD21 1 ATOM 5763 H HD22 A ASN A 1 327 ? -4.13188 33.24216 1.11134 0.550 82.83815 ? 327 ASN A HD22 1 ATOM 5764 H HD22 B ASN A 1 327 ? -6.95594 33.71320 2.45917 0.450 62.77086 ? 327 ASN A HD22 1 ATOM 5765 N N . GLU A 1 328 ? -1.80215 36.66797 3.32791 1.000 101.99072 ? 328 GLU A N 1 ATOM 5766 C CA . GLU A 1 328 ? -0.38777 36.97701 3.51746 1.000 112.82094 ? 328 GLU A CA 1 ATOM 5767 C C . GLU A 1 328 ? 0.40622 36.86223 2.21948 1.000 124.95351 ? 328 GLU A C 1 ATOM 5768 O O . GLU A 1 328 ? 1.39966 37.57582 2.03630 1.000 125.92000 ? 328 GLU A O 1 ATOM 5769 C CB . GLU A 1 328 ? 0.20610 36.05532 4.58574 1.000 112.66724 ? 328 GLU A CB 1 ATOM 5770 C CG . GLU A 1 328 ? 0.20861 34.57558 4.21407 1.000 124.33013 ? 328 GLU A CG 1 ATOM 5771 C CD . GLU A 1 328 ? -0.99819 33.82989 4.75220 1.000 122.29797 ? 328 GLU A CD 1 ATOM 5772 O OE1 . GLU A 1 328 ? -1.96169 34.49091 5.19468 1.000 121.32870 ? 328 GLU A OE1 1 ATOM 5773 O OE2 . GLU A 1 328 ? -0.98490 32.58081 4.72515 1.000 109.03238 ? 328 GLU A OE2 1 ATOM 5774 H H . GLU A 1 328 ? -2.08825 35.99691 3.78335 1.000 122.38887 ? 328 GLU A H 1 ATOM 5775 H HA . GLU A 1 328 ? -0.31187 37.89351 3.82594 1.000 135.38513 ? 328 GLU A HA 1 ATOM 5776 H HB2 . GLU A 1 328 ? 1.12593 36.31907 4.74464 1.000 135.20068 ? 328 GLU A HB2 1 ATOM 5777 H HB3 . GLU A 1 328 ? -0.31214 36.15203 5.39997 1.000 135.20068 ? 328 GLU A HB3 1 ATOM 5778 H HG2 . GLU A 1 328 ? 0.20510 34.49293 3.24760 1.000 149.19616 ? 328 GLU A HG2 1 ATOM 5779 H HG3 . GLU A 1 328 ? 1.00501 34.15970 4.57971 1.000 149.19616 ? 328 GLU A HG3 1 ATOM 5780 N N . MET A 1 329 ? -0.00892 35.97968 1.31132 1.000 121.90657 ? 329 MET A N 1 ATOM 5781 C CA . MET A 1 329 ? 0.74561 35.73216 0.08968 1.000 118.44783 ? 329 MET A CA 1 ATOM 5782 C C . MET A 1 329 ? 0.61863 36.87835 -0.90461 1.000 133.91494 ? 329 MET A C 1 ATOM 5783 O O . MET A 1 329 ? 1.59644 37.58330 -1.17613 1.000 139.18905 ? 329 MET A O 1 ATOM 5784 C CB . MET A 1 329 ? 0.27819 34.42969 -0.56092 1.000 107.27696 ? 329 MET A CB 1 ATOM 5785 C CG . MET A 1 329 ? 1.37286 33.69723 -1.30870 1.000 106.11815 ? 329 MET A CG 1 ATOM 5786 S SD . MET A 1 329 ? 2.38855 32.63823 -0.26384 1.000 108.85165 ? 329 MET A SD 1 ATOM 5787 C CE . MET A 1 329 ? 1.14532 31.67510 0.57905 1.000 92.06325 ? 329 MET A CE 1 ATOM 5788 H H . MET A 1 329 ? -0.72676 35.51132 1.38172 1.000 146.28789 ? 329 MET A H 1 ATOM 5789 H HA . MET A 1 329 ? 1.68107 35.64583 0.33126 1.000 142.13739 ? 329 MET A HA 1 ATOM 5790 H HB2 . MET A 1 329 ? -0.05591 33.83748 0.13086 1.000 128.73236 ? 329 MET A HB2 1 ATOM 5791 H HB3 . MET A 1 329 ? -0.42850 34.63276 -1.19357 1.000 128.73236 ? 329 MET A HB3 1 ATOM 5792 H HG2 . MET A 1 329 ? 0.96538 33.13773 -1.98827 1.000 127.34178 ? 329 MET A HG2 1 ATOM 5793 H HG3 . MET A 1 329 ? 1.95764 34.35050 -1.72364 1.000 127.34178 ? 329 MET A HG3 1 ATOM 5794 H HE1 . MET A 1 329 ? 1.57416 30.93078 1.02957 1.000 110.47590 ? 329 MET A HE1 1 ATOM 5795 H HE2 . MET A 1 329 ? 0.69475 32.23886 1.22716 1.000 110.47590 ? 329 MET A HE2 1 ATOM 5796 H HE3 . MET A 1 329 ? 0.50694 31.34427 -0.07205 1.000 110.47590 ? 329 MET A HE3 1 ATOM 5797 N N . THR A 1 330 ? -0.58156 37.07270 -1.45245 1.000 128.31617 ? 330 THR A N 1 ATOM 5798 C CA . THR A 1 330 ? -0.78586 38.09599 -2.46727 1.000 120.86476 ? 330 THR A CA 1 ATOM 5799 C C . THR A 1 330 ? -0.48138 39.49720 -1.95964 1.000 125.75737 ? 330 THR A C 1 ATOM 5800 O O . THR A 1 330 ? -0.43307 40.43263 -2.76589 1.000 121.60443 ? 330 THR A O 1 ATOM 5801 C CB . THR A 1 330 ? -2.22835 38.04172 -2.97505 1.000 118.32469 ? 330 THR A CB 1 ATOM 5802 O OG1 . THR A 1 330 ? -3.13045 38.05025 -1.85948 1.000 119.78934 ? 330 THR A OG1 1 ATOM 5803 C CG2 . THR A 1 330 ? -2.45526 36.78697 -3.80812 1.000 113.53488 ? 330 THR A CG2 1 ATOM 5804 H H . THR A 1 330 ? -1.28848 36.62562 -1.25250 1.000 153.97941 ? 330 THR A H 1 ATOM 5805 H HA . THR A 1 330 ? -0.19234 37.91317 -3.21239 1.000 145.03771 ? 330 THR A HA 1 ATOM 5806 H HB . THR A 1 330 ? -2.40516 38.81294 -3.53617 1.000 141.98963 ? 330 THR A HB 1 ATOM 5807 H HG1 . THR A 1 330 ? -3.92428 38.08296 -2.13217 1.000 143.74721 ? 330 THR A HG1 1 ATOM 5808 H HG21 . THR A 1 330 ? -3.37053 36.76241 -4.12839 1.000 136.24185 ? 330 THR A HG21 1 ATOM 5809 H HG22 . THR A 1 330 ? -1.85491 36.78152 -4.56999 1.000 136.24185 ? 330 THR A HG22 1 ATOM 5810 H HG23 . THR A 1 330 ? -2.28862 35.99708 -3.27035 1.000 136.24185 ? 330 THR A HG23 1 ATOM 5811 N N . ARG A 1 331 ? -0.27382 39.66532 -0.65543 1.000 134.75231 ? 331 ARG A N 1 ATOM 5812 C CA . ARG A 1 331 ? -0.05174 40.98502 -0.07559 1.000 141.33614 ? 331 ARG A CA 1 ATOM 5813 C C . ARG A 1 331 ? 1.43402 41.34031 -0.04863 1.000 145.25295 ? 331 ARG A C 1 ATOM 5814 O O . ARG A 1 331 ? 1.84504 42.36017 -0.61141 1.000 145.08841 ? 331 ARG A O 1 ATOM 5815 C CB . ARG A 1 331 ? -0.65473 41.03601 1.33514 1.000 126.98950 ? 331 ARG A CB 1 ATOM 5816 C CG . ARG A 1 331 ? -0.53204 42.39297 1.99849 1.000 129.89242 ? 331 ARG A CG 1 ATOM 5817 C CD . ARG A 1 331 ? -1.27163 42.49454 3.33577 1.000 131.99969 ? 331 ARG A CD 1 ATOM 5818 N NE . ARG A 1 331 ? -2.55299 41.79690 3.38147 1.000 132.23619 ? 331 ARG A NE 1 ATOM 5819 C CZ . ARG A 1 331 ? -2.78431 40.67014 4.04522 1.000 130.00666 ? 331 ARG A CZ 1 ATOM 5820 N NH1 . ARG A 1 331 ? -1.82281 40.03963 4.70002 1.000 126.20426 ? 331 ARG A NH1 1 ATOM 5821 N NH2 . ARG A 1 331 ? -4.01664 40.17116 4.06379 1.000 131.78277 ? 331 ARG A NH2 1 ATOM 5822 H H . ARG A 1 331 ? -0.25700 39.02490 -0.08169 1.000 161.70277 ? 331 ARG A H 1 ATOM 5823 H HA . ARG A 1 331 ? -0.50275 41.64957 -0.61952 1.000 169.60336 ? 331 ARG A HA 1 ATOM 5824 H HB2 . ARG A 1 331 ? -1.59803 40.81684 1.27982 1.000 152.38740 ? 331 ARG A HB2 1 ATOM 5825 H HB3 . ARG A 1 331 ? -0.19619 40.38963 1.89445 1.000 152.38740 ? 331 ARG A HB3 1 ATOM 5826 H HG2 . ARG A 1 331 ? 0.40586 42.57600 2.16504 1.000 155.87091 ? 331 ARG A HG2 1 ATOM 5827 H HG3 . ARG A 1 331 ? -0.90106 43.06569 1.40505 1.000 155.87091 ? 331 ARG A HG3 1 ATOM 5828 H HD2 . ARG A 1 331 ? -0.70895 42.11531 4.02894 1.000 158.39962 ? 331 ARG A HD2 1 ATOM 5829 H HD3 . ARG A 1 331 ? -1.44318 43.43072 3.52296 1.000 158.39962 ? 331 ARG A HD3 1 ATOM 5830 H HE . ARG A 1 331 ? -3.20863 42.14212 2.94494 1.000 158.68342 ? 331 ARG A HE 1 ATOM 5831 H HH11 . ARG A 1 331 ? -1.99667 39.31119 5.12281 1.000 151.44512 ? 331 ARG A HH11 1 ATOM 5832 H HH12 . ARG A 1 331 ? -1.02402 40.35826 4.70282 1.000 151.44512 ? 331 ARG A HH12 1 ATOM 5833 H HH21 . ARG A 1 331 ? -4.65135 40.57744 3.64945 1.000 158.13932 ? 331 ARG A HH21 1 ATOM 5834 H HH22 . ARG A 1 331 ? -4.17899 39.44215 4.49015 1.000 158.13932 ? 331 ARG A HH22 1 ATOM 5835 N N . LYS A 1 332 ? 2.25106 40.49911 0.58925 0.815 147.56695 ? 332 LYS A N 1 ATOM 5836 C CA . LYS A 1 332 ? 3.66829 40.79830 0.80010 0.815 139.99583 ? 332 LYS A CA 1 ATOM 5837 C C . LYS A 1 332 ? 4.47284 40.31006 -0.40187 0.815 138.48894 ? 332 LYS A C 1 ATOM 5838 O O . LYS A 1 332 ? 5.07134 39.23193 -0.40333 0.815 134.42392 ? 332 LYS A O 1 ATOM 5839 C CB . LYS A 1 332 ? 4.15939 40.16668 2.09795 0.815 126.57180 ? 332 LYS A CB 1 ATOM 5840 H H . LYS A 1 332 ? 2.00522 39.74099 0.91239 0.815 177.08034 ? 332 LYS A H 1 ATOM 5841 H HA . LYS A 1 332 ? 3.77466 41.76059 0.85991 0.815 167.99500 ? 332 LYS A HA 1 ATOM 5842 N N . SER A 1 333 ? 4.48705 41.13775 -1.44413 0.929 142.33180 ? 333 SER A N 1 ATOM 5843 C CA . SER A 1 333 ? 5.29502 40.88828 -2.62739 0.929 144.35409 ? 333 SER A CA 1 ATOM 5844 C C . SER A 1 333 ? 5.96954 42.18683 -3.04569 0.929 146.41860 ? 333 SER A C 1 ATOM 5845 O O . SER A 1 333 ? 5.50357 43.28345 -2.72609 0.929 155.00255 ? 333 SER A O 1 ATOM 5846 C CB . SER A 1 333 ? 4.45101 40.33367 -3.78436 0.929 134.11980 ? 333 SER A CB 1 ATOM 5847 H H . SER A 1 333 ? 4.02747 41.86335 -1.48761 0.929 170.79817 ? 333 SER A H 1 ATOM 5848 H HA . SER A 1 333 ? 5.98360 40.23791 -2.41818 0.929 173.22491 ? 333 SER A HA 1 ATOM 5849 N N . SER A 1 334 ? 7.08437 42.05190 -3.76154 0.790 141.88905 ? 334 SER A N 1 ATOM 5850 C CA . SER A 1 334 ? 7.72868 43.19395 -4.39615 0.790 143.59363 ? 334 SER A CA 1 ATOM 5851 C C . SER A 1 334 ? 7.03007 43.61032 -5.68332 0.790 164.17618 ? 334 SER A C 1 ATOM 5852 O O . SER A 1 334 ? 7.55322 44.46160 -6.41081 0.790 163.45653 ? 334 SER A O 1 ATOM 5853 C CB . SER A 1 334 ? 9.19802 42.88134 -4.69243 0.790 128.54918 ? 334 SER A CB 1 ATOM 5854 O OG . SER A 1 334 ? 9.95919 42.81706 -3.50132 0.790 109.59682 ? 334 SER A OG 1 ATOM 5855 H H . SER A 1 334 ? 7.48721 41.30364 -3.89355 0.790 170.26686 ? 334 SER A H 1 ATOM 5856 H HA . SER A 1 334 ? 7.70535 43.94137 -3.77831 0.790 172.31235 ? 334 SER A HA 1 ATOM 5857 H HB2 . SER A 1 334 ? 9.25179 42.02566 -5.14610 0.790 154.25902 ? 334 SER A HB2 1 ATOM 5858 H HB3 . SER A 1 334 ? 9.55984 43.58058 -5.25905 0.790 154.25902 ? 334 SER A HB3 1 ATOM 5859 H HG . SER A 1 334 ? 9.95193 43.56299 -3.11513 0.790 131.51618 ? 334 SER A HG 1 ATOM 5860 N N . GLY A 1 335 ? 5.86774 43.03478 -5.97447 0.933 154.57732 ? 335 GLY A N 1 ATOM 5861 C CA . GLY A 1 335 ? 5.19386 43.28651 -7.23056 0.933 141.14571 ? 335 GLY A CA 1 ATOM 5862 C C . GLY A 1 335 ? 5.96093 42.67488 -8.38814 0.933 146.92789 ? 335 GLY A C 1 ATOM 5863 O O . GLY A 1 335 ? 6.98023 42.00629 -8.22542 0.933 149.35340 ? 335 GLY A O 1 ATOM 5864 H H . GLY A 1 335 ? 5.45033 42.49177 -5.45436 0.933 185.49278 ? 335 GLY A H 1 ATOM 5865 H HA2 . GLY A 1 335 ? 4.30418 42.90073 -7.20734 0.933 169.37485 ? 335 GLY A HA2 1 ATOM 5866 H HA3 . GLY A 1 335 ? 5.11976 44.24269 -7.37595 0.933 169.37485 ? 335 GLY A HA3 1 ATOM 5867 N N . GLY A 1 336 ? 5.43971 42.90932 -9.58721 0.623 138.51298 ? 336 GLY A N 1 ATOM 5868 C CA . GLY A 1 336 ? 6.13761 42.51534 -10.79045 0.623 135.65153 ? 336 GLY A CA 1 ATOM 5869 C C . GLY A 1 336 ? 7.11427 43.58161 -11.24606 0.623 145.33050 ? 336 GLY A C 1 ATOM 5870 O O . GLY A 1 336 ? 7.12726 44.70054 -10.73624 0.623 148.15386 ? 336 GLY A O 1 ATOM 5871 H H . GLY A 1 336 ? 4.68350 43.29511 -9.72476 0.623 166.21557 ? 336 GLY A H 1 ATOM 5872 H HA2 . GLY A 1 336 ? 6.62980 41.69591 -10.62558 0.623 162.78183 ? 336 GLY A HA2 1 ATOM 5873 H HA3 . GLY A 1 336 ? 5.49570 42.36064 -11.50103 0.623 162.78183 ? 336 GLY A HA3 1 ATOM 5874 N N . LEU A 1 337 ? 7.94686 43.21147 -12.21937 1.000 146.02934 ? 337 LEU A N 1 ATOM 5875 C CA . LEU A 1 337 ? 9.01465 44.08631 -12.69316 1.000 142.33134 ? 337 LEU A CA 1 ATOM 5876 C C . LEU A 1 337 ? 10.13481 44.15132 -11.66003 1.000 135.47281 ? 337 LEU A C 1 ATOM 5877 O O . LEU A 1 337 ? 11.30911 43.97609 -11.99932 1.000 127.22114 ? 337 LEU A O 1 ATOM 5878 C CB . LEU A 1 337 ? 8.48024 45.48748 -12.99645 1.000 136.99964 ? 337 LEU A CB 1 ATOM 5879 H H . LEU A 1 337 ? 7.91270 42.45305 -12.62340 1.000 175.23520 ? 337 LEU A H 1 ATOM 5880 H HA . LEU A 1 337 ? 9.37639 43.73002 -13.51966 1.000 170.79761 ? 337 LEU A HA 1 ATOM 5881 N N . GLU A 1 338 ? 9.78437 44.41394 -10.39827 0.784 139.20492 ? 338 GLU A N 1 ATOM 5882 C CA . GLU A 1 338 ? 10.76998 44.30761 -9.32787 0.784 138.36233 ? 338 GLU A CA 1 ATOM 5883 C C . GLU A 1 338 ? 11.23070 42.86505 -9.15815 0.784 132.98352 ? 338 GLU A C 1 ATOM 5884 O O . GLU A 1 338 ? 12.41129 42.61005 -8.89295 0.784 123.44992 ? 338 GLU A O 1 ATOM 5885 C CB . GLU A 1 338 ? 10.18706 44.84247 -8.02032 0.784 139.15407 ? 338 GLU A CB 1 ATOM 5886 H H . GLU A 1 338 ? 8.99806 44.65063 -10.14275 0.784 167.04590 ? 338 GLU A H 1 ATOM 5887 H HA . GLU A 1 338 ? 11.54138 44.85087 -9.55306 0.784 166.03480 ? 338 GLU A HA 1 ATOM 5888 N N . ILE A 1 339 ? 10.31430 41.90695 -9.31237 1.000 134.78553 ? 339 ILE A N 1 ATOM 5889 C CA . ILE A 1 339 ? 10.69650 40.50216 -9.21424 1.000 128.12297 ? 339 ILE A CA 1 ATOM 5890 C C . ILE A 1 339 ? 11.61854 40.12607 -10.36949 1.000 108.87859 ? 339 ILE A C 1 ATOM 5891 O O . ILE A 1 339 ? 12.61674 39.42210 -10.17911 1.000 101.62486 ? 339 ILE A O 1 ATOM 5892 C CB . ILE A 1 339 ? 9.43975 39.61223 -9.16158 1.000 125.97619 ? 339 ILE A CB 1 ATOM 5893 C CG1 . ILE A 1 339 ? 8.87275 39.57349 -7.73673 1.000 131.16006 ? 339 ILE A CG1 1 ATOM 5894 C CG2 . ILE A 1 339 ? 9.75489 38.19341 -9.60913 1.000 102.37672 ? 339 ILE A CG2 1 ATOM 5895 C CD1 . ILE A 1 339 ? 7.46854 38.99433 -7.63182 1.000 126.62920 ? 339 ILE A CD1 1 ATOM 5896 H H . ILE A 1 339 ? 9.48018 42.04295 -9.47163 1.000 161.74264 ? 339 ILE A H 1 ATOM 5897 H HA . ILE A 1 339 ? 11.18693 40.36585 -8.38853 1.000 153.74757 ? 339 ILE A HA 1 ATOM 5898 H HB . ILE A 1 339 ? 8.78494 39.99736 -9.76472 1.000 151.17143 ? 339 ILE A HB 1 ATOM 5899 H HG12 . ILE A 1 339 ? 9.45644 39.02804 -7.18656 1.000 157.39207 ? 339 ILE A HG12 1 ATOM 5900 H HG13 . ILE A 1 339 ? 8.84252 40.47944 -7.39140 1.000 157.39207 ? 339 ILE A HG13 1 ATOM 5901 H HG21 . ILE A 1 339 ? 9.00739 37.61779 -9.38373 1.000 122.85207 ? 339 ILE A HG21 1 ATOM 5902 H HG22 . ILE A 1 339 ? 9.89798 38.18933 -10.56851 1.000 122.85207 ? 339 ILE A HG22 1 ATOM 5903 H HG23 . ILE A 1 339 ? 10.55563 37.88920 -9.15397 1.000 122.85207 ? 339 ILE A HG23 1 ATOM 5904 H HD11 . ILE A 1 339 ? 7.12390 39.16114 -6.74058 1.000 151.95504 ? 339 ILE A HD11 1 ATOM 5905 H HD12 . ILE A 1 339 ? 6.90044 39.42201 -8.29156 1.000 151.95504 ? 339 ILE A HD12 1 ATOM 5906 H HD13 . ILE A 1 339 ? 7.50752 38.03948 -7.79804 1.000 151.95504 ? 339 ILE A HD13 1 ATOM 5907 N N . ALA A 1 340 ? 11.31857 40.61171 -11.57878 0.789 110.10734 ? 340 ALA A N 1 ATOM 5908 C CA . ALA A 1 340 ? 12.13309 40.26396 -12.74027 0.789 92.61043 ? 340 ALA A CA 1 ATOM 5909 C C . ALA A 1 340 ? 13.57058 40.74674 -12.57876 0.789 101.08463 ? 340 ALA A C 1 ATOM 5910 O O . ALA A 1 340 ? 14.51172 40.06983 -13.00998 0.789 80.55614 ? 340 ALA A O 1 ATOM 5911 C CB . ALA A 1 340 ? 11.51473 40.84789 -14.01133 0.789 91.31580 ? 340 ALA A CB 1 ATOM 5912 H H . ALA A 1 340 ? 10.65858 41.13619 -11.74885 0.789 132.12881 ? 340 ALA A H 1 ATOM 5913 H HA . ALA A 1 340 ? 12.14882 39.29798 -12.82712 0.789 111.13252 ? 340 ALA A HA 1 ATOM 5914 H HB1 . ALA A 1 340 ? 12.06913 40.60922 -14.77066 0.789 109.57896 ? 340 ALA A HB1 1 ATOM 5915 H HB2 . ALA A 1 340 ? 10.62314 40.48317 -14.12511 0.789 109.57896 ? 340 ALA A HB2 1 ATOM 5916 H HB3 . ALA A 1 340 ? 11.46887 41.81301 -13.92562 0.789 109.57896 ? 340 ALA A HB3 1 ATOM 5917 N N . ARG A 1 341 ? 13.76279 41.92310 -11.97618 0.907 99.52448 ? 341 ARG A N 1 ATOM 5918 C CA . ARG A 1 341 ? 15.11919 42.39170 -11.71017 0.907 96.10350 ? 341 ARG A CA 1 ATOM 5919 C C . ARG A 1 341 ? 15.81242 41.49541 -10.69046 0.907 97.43241 ? 341 ARG A C 1 ATOM 5920 O O . ARG A 1 341 ? 17.00143 41.18473 -10.83220 0.907 89.08706 ? 341 ARG A O 1 ATOM 5921 C CB . ARG A 1 341 ? 15.09347 43.84142 -11.22073 0.907 88.29822 ? 341 ARG A CB 1 ATOM 5922 H H . ARG A 1 341 ? 13.13833 42.45511 -11.71809 0.907 119.42937 ? 341 ARG A H 1 ATOM 5923 H HA . ARG A 1 341 ? 15.62754 42.36717 -12.53593 0.907 115.32420 ? 341 ARG A HA 1 ATOM 5924 N N . ASN A 1 342 ? 15.08067 41.06047 -9.66154 0.892 98.27618 ? 342 ASN A N 1 ATOM 5925 C CA . ASN A 1 342 ? 15.68029 40.21378 -8.63652 0.892 95.78028 ? 342 ASN A CA 1 ATOM 5926 C C . ASN A 1 342 ? 16.17852 38.90174 -9.22822 0.892 100.11120 ? 342 ASN A C 1 ATOM 5927 O O . ASN A 1 342 ? 17.25049 38.41056 -8.85531 0.892 91.17622 ? 342 ASN A O 1 ATOM 5928 C CB . ASN A 1 342 ? 14.66754 39.94847 -7.52246 0.892 95.23846 ? 342 ASN A CB 1 ATOM 5929 H H . ASN A 1 342 ? 14.24870 41.23954 -9.53761 0.892 117.93142 ? 342 ASN A H 1 ATOM 5930 H HA . ASN A 1 342 ? 16.44010 40.67735 -8.25093 0.892 114.93633 ? 342 ASN A HA 1 ATOM 5931 N N . ILE A 1 343 ? 15.41794 38.32365 -10.16052 0.816 87.02754 ? 343 ILE A N 1 ATOM 5932 C CA . ILE A 1 343 ? 15.78304 37.02452 -10.71768 0.816 86.83416 ? 343 ILE A CA 1 ATOM 5933 C C . ILE A 1 343 ? 17.08924 37.11866 -11.49877 0.816 83.51560 ? 343 ILE A C 1 ATOM 5934 O O . ILE A 1 343 ? 17.95679 36.24423 -11.38694 0.816 79.79627 ? 343 ILE A O 1 ATOM 5935 C CB . ILE A 1 343 ? 14.63189 36.48558 -11.58748 0.816 73.63937 ? 343 ILE A CB 1 ATOM 5936 C CG1 . ILE A 1 343 ? 13.49674 35.97229 -10.69467 0.816 82.11874 ? 343 ILE A CG1 1 ATOM 5937 C CG2 . ILE A 1 343 ? 15.11220 35.35932 -12.49363 0.816 78.82462 ? 343 ILE A CG2 1 ATOM 5938 C CD1 . ILE A 1 343 ? 12.11712 36.44907 -11.08681 0.816 86.83676 ? 343 ILE A CD1 1 ATOM 5939 H H . ILE A 1 343 ? 14.69476 38.65959 -10.48263 0.816 104.43305 ? 343 ILE A H 1 ATOM 5940 H HA . ILE A 1 343 ? 15.92673 36.40296 -9.98698 0.816 104.20099 ? 343 ILE A HA 1 ATOM 5941 H HB . ILE A 1 343 ? 14.30982 37.21479 -12.14012 0.816 88.36725 ? 343 ILE A HB 1 ATOM 5942 H HG12 . ILE A 1 343 ? 13.49136 35.00296 -10.73025 0.816 98.54248 ? 343 ILE A HG12 1 ATOM 5943 H HG13 . ILE A 1 343 ? 13.66092 36.27003 -9.78621 0.816 98.54248 ? 343 ILE A HG13 1 ATOM 5944 H HG21 . ILE A 1 343 ? 14.34225 34.87561 -12.83141 0.816 94.58954 ? 343 ILE A HG21 1 ATOM 5945 H HG22 . ILE A 1 343 ? 15.61365 35.73984 -13.23164 0.816 94.58954 ? 343 ILE A HG22 1 ATOM 5946 H HG23 . ILE A 1 343 ? 15.67946 34.76202 -11.98142 0.816 94.58954 ? 343 ILE A HG23 1 ATOM 5947 H HD11 . ILE A 1 343 ? 11.51431 36.32214 -10.33753 0.816 104.20412 ? 343 ILE A HD11 1 ATOM 5948 H HD12 . ILE A 1 343 ? 12.16231 37.38971 -11.31932 0.816 104.20412 ? 343 ILE A HD12 1 ATOM 5949 H HD13 . ILE A 1 343 ? 11.80997 35.93423 -11.84936 0.816 104.20412 ? 343 ILE A HD13 1 ATOM 5950 N N . GLY A 1 344 ? 17.25856 38.17989 -12.28988 0.841 81.68961 ? 344 GLY A N 1 ATOM 5951 C CA . GLY A 1 344 ? 18.46247 38.30583 -13.09522 0.841 82.52536 ? 344 GLY A CA 1 ATOM 5952 C C . GLY A 1 344 ? 19.72026 38.50203 -12.26731 0.841 81.18015 ? 344 GLY A C 1 ATOM 5953 O O . GLY A 1 344 ? 20.77966 37.96115 -12.59602 0.841 88.59638 ? 344 GLY A O 1 ATOM 5954 H H . GLY A 1 344 ? 16.69925 38.82766 -12.37453 0.841 98.02753 ? 344 GLY A H 1 ATOM 5955 H HA2 . GLY A 1 344 ? 18.57370 37.50276 -13.62776 0.841 99.03043 ? 344 GLY A HA2 1 ATOM 5956 H HA3 . GLY A 1 344 ? 18.36947 39.06771 -13.68834 0.841 99.03043 ? 344 GLY A HA3 1 ATOM 5957 N N . HIS A 1 345 ? 19.62784 39.27949 -11.18789 1.000 80.40953 ? 345 HIS A N 1 ATOM 5958 C CA . HIS A 1 345 ? 20.80196 39.50542 -10.34866 1.000 86.91110 ? 345 HIS A CA 1 ATOM 5959 C C . HIS A 1 345 ? 21.21327 38.22901 -9.62413 1.000 86.61318 ? 345 HIS A C 1 ATOM 5960 O O . HIS A 1 345 ? 22.40733 37.93328 -9.49860 1.000 84.71840 ? 345 HIS A O 1 ATOM 5961 C CB . HIS A 1 345 ? 20.52145 40.62281 -9.34465 1.000 85.29981 ? 345 HIS A CB 1 ATOM 5962 H H . HIS A 1 345 ? 18.91289 39.67892 -10.92541 1.000 96.49143 ? 345 HIS A H 1 ATOM 5963 H HA . HIS A 1 345 ? 21.54024 39.78541 -10.91208 1.000 104.29332 ? 345 HIS A HA 1 ATOM 5964 N N . TYR A 1 346 ? 20.23505 37.45937 -9.14617 1.000 76.27509 ? 346 TYR A N 1 ATOM 5965 C CA . TYR A 1 346 ? 20.53438 36.21115 -8.45229 1.000 80.21326 ? 346 TYR A CA 1 ATOM 5966 C C . TYR A 1 346 ? 21.19260 35.21021 -9.39175 1.000 87.82375 ? 346 TYR A C 1 ATOM 5967 O O . TYR A 1 346 ? 22.20183 34.58452 -9.04582 1.000 85.38469 ? 346 TYR A O 1 ATOM 5968 C CB . TYR A 1 346 ? 19.24261 35.64020 -7.86376 1.000 84.31329 ? 346 TYR A CB 1 ATOM 5969 C CG . TYR A 1 346 ? 19.37559 34.29194 -7.19470 1.000 80.16992 ? 346 TYR A CG 1 ATOM 5970 C CD1 . TYR A 1 346 ? 19.31049 33.10892 -7.92492 1.000 78.77376 ? 346 TYR A CD1 1 ATOM 5971 C CD2 . TYR A 1 346 ? 19.55498 34.20721 -5.82153 1.000 68.15125 ? 346 TYR A CD2 1 ATOM 5972 C CE1 . TYR A 1 346 ? 19.42539 31.87602 -7.29197 1.000 81.22510 ? 346 TYR A CE1 1 ATOM 5973 C CE2 . TYR A 1 346 ? 19.67408 33.00880 -5.18791 1.000 65.64997 ? 346 TYR A CE2 1 ATOM 5974 C CZ . TYR A 1 346 ? 19.60677 31.83297 -5.91974 1.000 71.36335 ? 346 TYR A CZ 1 ATOM 5975 O OH . TYR A 1 346 ? 19.72826 30.63207 -5.26243 1.000 68.66042 ? 346 TYR A OH 1 ATOM 5976 H H . TYR A 1 346 ? 19.39601 37.63681 -9.21048 1.000 91.53011 ? 346 TYR A H 1 ATOM 5977 H HA . TYR A 1 346 ? 21.15262 36.38457 -7.72523 1.000 96.25591 ? 346 TYR A HA 1 ATOM 5978 H HB2 . TYR A 1 346 ? 18.90953 36.26177 -7.19772 1.000 101.17595 ? 346 TYR A HB2 1 ATOM 5979 H HB3 . TYR A 1 346 ? 18.59640 35.54455 -8.58082 1.000 101.17595 ? 346 TYR A HB3 1 ATOM 5980 H HD1 . TYR A 1 346 ? 19.18881 33.14330 -8.84629 1.000 94.52852 ? 346 TYR A HD1 1 ATOM 5981 H HD2 . TYR A 1 346 ? 19.59489 34.98998 -5.32096 1.000 81.78150 ? 346 TYR A HD2 1 ATOM 5982 H HE1 . TYR A 1 346 ? 19.38089 31.08872 -7.78501 1.000 97.47012 ? 346 TYR A HE1 1 ATOM 5983 H HE2 . TYR A 1 346 ? 19.80022 32.97852 -4.26700 1.000 78.77996 ? 346 TYR A HE2 1 ATOM 5984 H HH . TYR A 1 346 ? 19.82067 30.76387 -4.43799 1.000 82.39251 ? 346 TYR A HH 1 ATOM 5985 N N . LEU A 1 347 ? 20.63637 35.04853 -10.59354 1.000 90.52714 ? 347 LEU A N 1 ATOM 5986 C CA . LEU A 1 347 ? 21.14171 34.04117 -11.51778 1.000 96.97751 ? 347 LEU A CA 1 ATOM 5987 C C . LEU A 1 347 ? 22.45922 34.46115 -12.15844 1.000 97.12820 ? 347 LEU A C 1 ATOM 5988 O O . LEU A 1 347 ? 23.25955 33.60099 -12.54058 1.000 95.52898 ? 347 LEU A O 1 ATOM 5989 C CB . LEU A 1 347 ? 20.09278 33.75450 -12.59221 1.000 100.55380 ? 347 LEU A CB 1 ATOM 5990 C CG . LEU A 1 347 ? 18.84310 33.02184 -12.08970 1.000 94.65033 ? 347 LEU A CG 1 ATOM 5991 C CD1 . LEU A 1 347 ? 17.84953 32.82092 -13.23167 1.000 85.19033 ? 347 LEU A CD1 1 ATOM 5992 C CD2 . LEU A 1 347 ? 19.20416 31.68977 -11.42348 1.000 77.99715 ? 347 LEU A CD2 1 ATOM 5993 H H . LEU A 1 347 ? 19.97224 35.50581 -10.89260 1.000 108.63257 ? 347 LEU A H 1 ATOM 5994 H HA . LEU A 1 347 ? 21.30376 33.21775 -11.03133 1.000 116.37301 ? 347 LEU A HA 1 ATOM 5995 H HB2 . LEU A 1 347 ? 19.80387 34.59871 -12.97265 1.000 120.66456 ? 347 LEU A HB2 1 ATOM 5996 H HB3 . LEU A 1 347 ? 20.49906 33.20289 -13.27892 1.000 120.66456 ? 347 LEU A HB3 1 ATOM 5997 H HG . LEU A 1 347 ? 18.41359 33.56689 -11.41196 1.000 113.58040 ? 347 LEU A HG 1 ATOM 5998 H HD11 . LEU A 1 347 ? 17.35316 32.00184 -13.07797 1.000 102.22840 ? 347 LEU A HD11 1 ATOM 5999 H HD12 . LEU A 1 347 ? 17.24148 33.57622 -13.25780 1.000 102.22840 ? 347 LEU A HD12 1 ATOM 6000 H HD13 . LEU A 1 347 ? 18.33750 32.76003 -14.06779 1.000 102.22840 ? 347 LEU A HD13 1 ATOM 6001 H HD21 . LEU A 1 347 ? 18.39356 31.17458 -11.28782 1.000 93.59657 ? 347 LEU A HD21 1 ATOM 6002 H HD22 . LEU A 1 347 ? 19.81291 31.20277 -12.00067 1.000 93.59657 ? 347 LEU A HD22 1 ATOM 6003 H HD23 . LEU A 1 347 ? 19.62922 31.86848 -10.57008 1.000 93.59657 ? 347 LEU A HD23 1 ATOM 6004 N N . GLU A 1 348 ? 22.70436 35.76561 -12.28282 0.928 98.43153 ? 348 GLU A N 1 ATOM 6005 C CA . GLU A 1 348 ? 24.00307 36.22363 -12.76751 0.928 107.59946 ? 348 GLU A CA 1 ATOM 6006 C C . GLU A 1 348 ? 25.13510 35.75434 -11.86143 0.928 109.44971 ? 348 GLU A C 1 ATOM 6007 O O . GLU A 1 348 ? 26.26321 35.56258 -12.33081 0.928 112.87094 ? 348 GLU A O 1 ATOM 6008 C CB . GLU A 1 348 ? 24.00702 37.75132 -12.87475 0.928 101.41753 ? 348 GLU A CB 1 ATOM 6009 C CG . GLU A 1 348 ? 25.32665 38.39705 -13.32706 0.928 119.40761 ? 348 GLU A CG 1 ATOM 6010 C CD . GLU A 1 348 ? 25.81851 37.94014 -14.69462 0.928 122.29525 ? 348 GLU A CD 1 ATOM 6011 O OE1 . GLU A 1 348 ? 26.46492 38.75709 -15.38476 0.928 120.17535 ? 348 GLU A OE1 1 ATOM 6012 O OE2 . GLU A 1 348 ? 25.57799 36.77899 -15.08306 0.928 132.76431 ? 348 GLU A OE2 1 ATOM 6013 H H . GLU A 1 348 ? 22.14661 36.39327 -12.09693 0.928 118.11784 ? 348 GLU A H 1 ATOM 6014 H HA . GLU A 1 348 ? 24.15669 35.85706 -13.65234 0.928 129.11935 ? 348 GLU A HA 1 ATOM 6015 H HB2 . GLU A 1 348 ? 23.32743 38.01097 -13.51634 0.928 121.70104 ? 348 GLU A HB2 1 ATOM 6016 H HB3 . GLU A 1 348 ? 23.79528 38.11611 -12.00126 0.928 121.70104 ? 348 GLU A HB3 1 ATOM 6017 H HG2 . GLU A 1 348 ? 25.20277 39.35827 -13.36711 0.928 143.28913 ? 348 GLU A HG2 1 ATOM 6018 H HG3 . GLU A 1 348 ? 26.01568 38.17801 -12.68041 0.928 143.28913 ? 348 GLU A HG3 1 ATOM 6019 N N . ARG A 1 349 ? 24.85642 35.54989 -10.57307 0.877 108.64212 ? 349 ARG A N 1 ATOM 6020 C CA . ARG A 1 349 ? 25.89365 35.31304 -9.57775 0.877 108.29914 ? 349 ARG A CA 1 ATOM 6021 C C . ARG A 1 349 ? 26.03390 33.85078 -9.16671 0.877 116.34971 ? 349 ARG A C 1 ATOM 6022 O O . ARG A 1 349 ? 26.93317 33.53363 -8.38106 0.877 126.20905 ? 349 ARG A O 1 ATOM 6023 C CB . ARG A 1 349 ? 25.62440 36.16910 -8.33324 0.877 101.91019 ? 349 ARG A CB 1 ATOM 6024 H H . ARG A 1 349 ? 24.05972 35.54429 -10.24927 0.877 130.37055 ? 349 ARG A H 1 ATOM 6025 H HA . ARG A 1 349 ? 26.74289 35.58276 -9.96109 0.877 129.95896 ? 349 ARG A HA 1 ATOM 6026 N N . VAL A 1 350 ? 25.17771 32.95783 -9.65977 1.000 109.68378 ? 350 VAL A N 1 ATOM 6027 C CA . VAL A 1 350 ? 25.35082 31.52752 -9.40736 1.000 109.17715 ? 350 VAL A CA 1 ATOM 6028 C C . VAL A 1 350 ? 25.94747 30.86526 -10.64681 1.000 114.97519 ? 350 VAL A C 1 ATOM 6029 O O . VAL A 1 350 ? 27.16635 30.77831 -10.79172 1.000 116.82650 ? 350 VAL A O 1 ATOM 6030 C CB . VAL A 1 350 ? 24.02751 30.83332 -9.01015 1.000 106.14116 ? 350 VAL A CB 1 ATOM 6031 C CG1 . VAL A 1 350 ? 23.24886 31.67589 -8.00780 1.000 102.03025 ? 350 VAL A CG1 1 ATOM 6032 C CG2 . VAL A 1 350 ? 23.18299 30.53070 -10.24445 1.000 103.89353 ? 350 VAL A CG2 1 ATOM 6033 H H . VAL A 1 350 ? 24.49217 33.15322 -10.14087 1.000 131.62053 ? 350 VAL A H 1 ATOM 6034 H HA . VAL A 1 350 ? 25.95782 31.42108 -8.65828 1.000 131.01257 ? 350 VAL A HA 1 ATOM 6035 H HB . VAL A 1 350 ? 24.23977 29.98937 -8.58166 1.000 127.36939 ? 350 VAL A HB 1 ATOM 6036 H HG11 . VAL A 1 350 ? 22.54256 31.13471 -7.62158 1.000 122.43630 ? 350 VAL A HG11 1 ATOM 6037 H HG12 . VAL A 1 350 ? 23.85325 31.97697 -7.31140 1.000 122.43630 ? 350 VAL A HG12 1 ATOM 6038 H HG13 . VAL A 1 350 ? 22.86656 32.43996 -8.46708 1.000 122.43630 ? 350 VAL A HG13 1 ATOM 6039 H HG21 . VAL A 1 350 ? 22.26358 30.38721 -9.97059 1.000 124.67224 ? 350 VAL A HG21 1 ATOM 6040 H HG22 . VAL A 1 350 ? 23.23296 31.28384 -10.85369 1.000 124.67224 ? 350 VAL A HG22 1 ATOM 6041 H HG23 . VAL A 1 350 ? 23.52807 29.73315 -10.67542 1.000 124.67224 ? 350 VAL A HG23 1 HETATM 6042 N N1 . FMN B 2 . ? -3.69131 -11.39316 -3.19788 1.000 51.26968 ? 401 FMN A N1 1 HETATM 6043 C C2 . FMN B 2 . ? -5.02551 -11.99788 -3.27436 1.000 56.74350 ? 401 FMN A C2 1 HETATM 6044 O O2 . FMN B 2 . ? -5.58653 -12.30746 -2.28041 1.000 59.82492 ? 401 FMN A O2 1 HETATM 6045 N N3 . FMN B 2 . ? -5.65721 -12.20881 -4.59757 1.000 50.58601 ? 401 FMN A N3 1 HETATM 6046 C C4 . FMN B 2 . ? -4.96151 -11.82534 -5.81464 1.000 48.52595 ? 401 FMN A C4 1 HETATM 6047 O O4 . FMN B 2 . ? -5.48126 -12.01840 -6.86506 1.000 49.76132 ? 401 FMN A O4 1 HETATM 6048 C C4A . FMN B 2 . ? -3.59133 -11.19784 -5.70919 1.000 47.45712 ? 401 FMN A C4A 1 HETATM 6049 N N5 . FMN B 2 . ? -2.86469 -10.79752 -6.88373 1.000 46.03138 ? 401 FMN A N5 1 HETATM 6050 C C5A . FMN B 2 . ? -1.52284 -10.18256 -6.75227 1.000 49.02414 ? 401 FMN A C5A 1 HETATM 6051 C C6 . FMN B 2 . ? -0.85015 -9.79967 -7.91781 1.000 44.21743 ? 401 FMN A C6 1 HETATM 6052 C C7 . FMN B 2 . ? 0.41151 -9.23052 -7.80179 1.000 47.67161 ? 401 FMN A C7 1 HETATM 6053 C C7M . FMN B 2 . ? 0.86388 -8.93432 -9.22560 1.000 46.58216 ? 401 FMN A C7M 1 HETATM 6054 C C8 . FMN B 2 . ? 0.99607 -9.03728 -6.54688 1.000 47.21575 ? 401 FMN A C8 1 HETATM 6055 C C8M . FMN B 2 . ? 2.37555 -8.39824 -6.54530 1.000 44.83931 ? 401 FMN A C8M 1 HETATM 6056 C C9 . FMN B 2 . ? 0.32678 -9.42061 -5.39105 1.000 47.72845 ? 401 FMN A C9 1 HETATM 6057 C C9A . FMN B 2 . ? -0.93945 -9.99247 -5.49327 1.000 46.45754 ? 401 FMN A C9A 1 HETATM 6058 N N10 . FMN B 2 . ? -1.69030 -10.40931 -4.27356 1.000 44.08411 ? 401 FMN A N10 1 HETATM 6059 C C10 . FMN B 2 . ? -2.99091 -10.99801 -4.40872 1.000 46.05781 ? 401 FMN A C10 1 HETATM 6060 C "C1'" . FMN B 2 . ? -1.12565 -10.28178 -2.93736 1.000 48.62760 ? 401 FMN A "C1'" 1 HETATM 6061 C "C2'" . FMN B 2 . ? -1.65031 -9.14436 -2.09794 1.000 51.18209 ? 401 FMN A "C2'" 1 HETATM 6062 O "O2'" . FMN B 2 . ? -1.01735 -7.98932 -2.57979 1.000 50.49376 ? 401 FMN A "O2'" 1 HETATM 6063 C "C3'" . FMN B 2 . ? -1.25496 -9.42603 -0.64733 1.000 52.71990 ? 401 FMN A "C3'" 1 HETATM 6064 O "O3'" . FMN B 2 . ? 0.10338 -9.76463 -0.56046 1.000 47.86233 ? 401 FMN A "O3'" 1 HETATM 6065 C "C4'" . FMN B 2 . ? -2.00484 -10.62703 -0.07471 1.000 55.44356 ? 401 FMN A "C4'" 1 HETATM 6066 O "O4'" . FMN B 2 . ? -3.35600 -10.60238 -0.43220 1.000 56.43080 ? 401 FMN A "O4'" 1 HETATM 6067 C "C5'" . FMN B 2 . ? -1.88282 -10.58881 1.44397 1.000 62.57861 ? 401 FMN A "C5'" 1 HETATM 6068 O "O5'" . FMN B 2 . ? -2.22384 -11.85802 1.90089 1.000 79.20009 ? 401 FMN A "O5'" 1 HETATM 6069 P P . FMN B 2 . ? -2.16743 -12.11871 3.52046 1.000 80.16439 ? 401 FMN A P 1 HETATM 6070 O O1P . FMN B 2 . ? -3.03963 -13.30872 3.84830 1.000 66.02147 ? 401 FMN A O1P 1 HETATM 6071 O O2P . FMN B 2 . ? -0.74056 -12.38608 3.92676 1.000 77.70826 ? 401 FMN A O2P 1 HETATM 6072 O O3P . FMN B 2 . ? -2.68023 -10.86948 4.19646 1.000 66.14294 ? 401 FMN A O3P 1 HETATM 6073 H HN3 . FMN B 2 . ? -6.56900 -12.61805 -4.65382 1.000 60.70322 ? 401 FMN A HN3 1 HETATM 6074 H H6 . FMN B 2 . ? -1.30390 -9.94411 -8.89050 1.000 53.06091 ? 401 FMN A H6 1 HETATM 6075 H HM71 . FMN B 2 . ? 1.12419 -9.86372 -9.72345 1.000 55.89859 ? 401 FMN A HM71 1 HETATM 6076 H HM72 . FMN B 2 . ? 1.73130 -8.28133 -9.20137 1.000 55.89859 ? 401 FMN A HM72 1 HETATM 6077 H HM73 . FMN B 2 . ? 0.05869 -8.44671 -9.76719 1.000 55.89859 ? 401 FMN A HM73 1 HETATM 6078 H HM81 . FMN B 2 . ? 2.30142 -7.37616 -6.90481 1.000 53.80718 ? 401 FMN A HM81 1 HETATM 6079 H HM82 . FMN B 2 . ? 3.03708 -8.96350 -7.19512 1.000 53.80718 ? 401 FMN A HM82 1 HETATM 6080 H HM83 . FMN B 2 . ? 2.77350 -8.39862 -5.53483 1.000 53.80718 ? 401 FMN A HM83 1 HETATM 6081 H H9 . FMN B 2 . ? 0.78450 -9.27640 -4.42130 1.000 57.27413 ? 401 FMN A H9 1 HETATM 6082 H "H1'1" . FMN B 2 . ? -1.32447 -11.20394 -2.40538 1.000 58.35312 ? 401 FMN A "H1'1" 1 HETATM 6083 H "H1'2" . FMN B 2 . ? -0.05595 -10.14891 -3.04212 1.000 58.35312 ? 401 FMN A "H1'2" 1 HETATM 6084 H "H2'" . FMN B 2 . ? -2.72687 -9.02742 -2.14685 1.000 61.41851 ? 401 FMN A "H2'" 1 HETATM 6085 H "HO2'" . FMN B 2 . ? -1.57885 -7.23766 -2.46082 1.000 60.59251 ? 401 FMN A "HO2'" 1 HETATM 6086 H "H3'" . FMN B 2 . ? -1.48955 -8.52192 -0.09918 1.000 63.26388 ? 401 FMN A "H3'" 1 HETATM 6087 H "H4'" . FMN B 2 . ? -1.57161 -11.53514 -0.47539 1.000 66.53227 ? 401 FMN A "H4'" 1 HETATM 6088 H "HO4'" . FMN B 2 . ? -3.78136 -9.92150 0.06302 1.000 67.71696 ? 401 FMN A "HO4'" 1 HETATM 6089 H "H5'1" . FMN B 2 . ? -2.56014 -9.84791 1.85569 1.000 75.09433 ? 401 FMN A "H5'1" 1 HETATM 6090 H "H5'2" . FMN B 2 . ? -0.86488 -10.34792 1.73206 1.000 75.09433 ? 401 FMN A "H5'2" 1 HETATM 6091 P PG A ATP C 3 . ? 7.02636 36.50957 -18.12333 0.582 37.87138 ? 402 ATP A PG 1 HETATM 6092 P PG B ATP C 3 . ? 6.96717 36.75154 -18.37383 0.418 39.29942 ? 402 ATP A PG 1 HETATM 6093 O O1G A ATP C 3 . ? 7.29060 36.90215 -16.70256 0.582 36.44251 ? 402 ATP A O1G 1 HETATM 6094 O O1G B ATP C 3 . ? 7.35177 37.32663 -17.04644 0.418 39.27172 ? 402 ATP A O1G 1 HETATM 6095 O O2G A ATP C 3 . ? 6.23647 35.21247 -18.28049 0.582 38.50040 ? 402 ATP A O2G 1 HETATM 6096 O O2G B ATP C 3 . ? 6.17984 35.45487 -18.27192 0.418 37.99536 ? 402 ATP A O2G 1 HETATM 6097 O O3G A ATP C 3 . ? 6.37453 37.60935 -18.96287 0.582 38.25113 ? 402 ATP A O3G 1 HETATM 6098 O O3G B ATP C 3 . ? 6.21954 37.73500 -19.27172 0.418 38.57914 ? 402 ATP A O3G 1 HETATM 6099 P PB A ATP C 3 . ? 9.20013 35.00261 -19.39713 0.582 39.27871 ? 402 ATP A PB 1 HETATM 6100 P PB B ATP C 3 . ? 9.04243 35.06962 -19.66163 0.418 39.24690 ? 402 ATP A PB 1 HETATM 6101 O O1B A ATP C 3 . ? 8.85649 33.80084 -18.60474 0.582 39.41981 ? 402 ATP A O1B 1 HETATM 6102 O O1B B ATP C 3 . ? 8.74425 33.93184 -18.76570 0.418 39.00890 ? 402 ATP A O1B 1 HETATM 6103 O O2B A ATP C 3 . ? 10.66835 35.38688 -19.47596 0.582 41.87281 ? 402 ATP A O2B 1 HETATM 6104 O O2B B ATP C 3 . ? 10.51275 35.42442 -19.84085 0.418 41.13518 ? 402 ATP A O2B 1 HETATM 6105 O O3B A ATP C 3 . ? 8.40303 36.21929 -18.85185 0.582 40.56116 ? 402 ATP A O3B 1 HETATM 6106 O O3B B ATP C 3 . ? 8.27068 36.35785 -19.20036 0.418 38.74517 ? 402 ATP A O3B 1 HETATM 6107 P PA A ATP C 3 . ? 7.46130 34.05934 -21.58743 0.582 39.30894 ? 402 ATP A PA 1 HETATM 6108 P PA B ATP C 3 . ? 7.20860 34.02148 -21.71298 0.418 39.36909 ? 402 ATP A PA 1 HETATM 6109 O O1A A ATP C 3 . ? 6.65720 34.98013 -22.41708 0.582 39.44655 ? 402 ATP A O1A 1 HETATM 6110 O O1A B ATP C 3 . ? 6.56212 34.81643 -22.77687 0.418 42.39520 ? 402 ATP A O1A 1 HETATM 6111 O O2A A ATP C 3 . ? 6.67506 33.32695 -20.48620 0.582 35.89717 ? 402 ATP A O2A 1 HETATM 6112 O O2A B ATP C 3 . ? 6.30033 33.60901 -20.54964 0.418 35.51632 ? 402 ATP A O2A 1 HETATM 6113 O O3A A ATP C 3 . ? 8.62532 34.87254 -20.87224 0.582 42.33131 ? 402 ATP A O3A 1 HETATM 6114 O O3A B ATP C 3 . ? 8.42060 34.83216 -21.10335 0.418 41.47537 ? 402 ATP A O3A 1 HETATM 6115 O "O5'" A ATP C 3 . ? 8.22471 32.98438 -22.46135 0.582 41.64765 ? 402 ATP A "O5'" 1 HETATM 6116 O "O5'" B ATP C 3 . ? 7.90126 32.72098 -22.28135 0.418 42.77709 ? 402 ATP A "O5'" 1 HETATM 6117 C "C5'" A ATP C 3 . ? 8.73396 31.76544 -21.87488 0.582 41.04690 ? 402 ATP A "C5'" 1 HETATM 6118 C "C5'" B ATP C 3 . ? 8.93965 32.03689 -21.54623 0.418 41.35016 ? 402 ATP A "C5'" 1 HETATM 6119 C "C4'" A ATP C 3 . ? 8.62848 30.59196 -22.82715 0.582 39.22174 ? 402 ATP A "C4'" 1 HETATM 6120 C "C4'" B ATP C 3 . ? 9.63998 31.11254 -22.51112 0.418 41.51654 ? 402 ATP A "C4'" 1 HETATM 6121 O "O4'" A ATP C 3 . ? 7.23917 30.43582 -23.16146 0.582 37.57819 ? 402 ATP A "O4'" 1 HETATM 6122 O "O4'" B ATP C 3 . ? 8.63649 30.21874 -23.03760 0.418 38.46393 ? 402 ATP A "O4'" 1 HETATM 6123 C "C3'" A ATP C 3 . ? 9.25897 30.91499 -24.16946 0.582 39.51057 ? 402 ATP A "C3'" 1 HETATM 6124 C "C3'" B ATP C 3 . ? 10.12355 31.93465 -23.70661 0.418 40.07710 ? 402 ATP A "C3'" 1 HETATM 6125 O "O3'" A ATP C 3 . ? 10.57876 30.38405 -24.09452 0.582 41.54407 ? 402 ATP A "O3'" 1 HETATM 6126 O "O3'" B ATP C 3 . ? 11.29048 31.29879 -24.21499 0.418 40.97675 ? 402 ATP A "O3'" 1 HETATM 6127 C "C2'" A ATP C 3 . ? 8.50146 29.98909 -25.11195 0.582 38.98084 ? 402 ATP A "C2'" 1 HETATM 6128 C "C2'" B ATP C 3 . ? 9.04375 31.67352 -24.74721 0.418 40.34533 ? 402 ATP A "C2'" 1 HETATM 6129 O "O2'" A ATP C 3 . ? 8.93897 28.65217 -24.87810 0.582 37.38024 ? 402 ATP A "O2'" 1 HETATM 6130 O "O2'" B ATP C 3 . ? 9.68326 31.62315 -26.01975 0.418 41.33769 ? 402 ATP A "O2'" 1 HETATM 6131 C "C1'" A ATP C 3 . ? 7.09732 30.00044 -24.50287 0.582 40.09202 ? 402 ATP A "C1'" 1 HETATM 6132 C "C1'" B ATP C 3 . ? 8.74662 30.22226 -24.43773 0.418 39.36958 ? 402 ATP A "C1'" 1 HETATM 6133 N N9 A ATP C 3 . ? 6.24752 30.98115 -25.16962 0.582 40.00580 ? 402 ATP A N9 1 HETATM 6134 N N9 B ATP C 3 . ? 7.46644 29.83136 -24.99992 0.418 37.31797 ? 402 ATP A N9 1 HETATM 6135 C C8 A ATP C 3 . ? 6.33025 32.34690 -25.08676 0.582 41.48907 ? 402 ATP A C8 1 HETATM 6136 C C8 B ATP C 3 . ? 6.32459 30.57810 -25.12822 0.418 40.43910 ? 402 ATP A C8 1 HETATM 6137 N N7 A ATP C 3 . ? 5.43646 32.98179 -25.80453 0.582 44.58276 ? 402 ATP A N7 1 HETATM 6138 N N7 B ATP C 3 . ? 5.33702 29.94619 -25.71471 0.418 43.16418 ? 402 ATP A N7 1 HETATM 6139 C C5 A ATP C 3 . ? 4.68722 31.95863 -26.37142 0.582 46.36343 ? 402 ATP A C5 1 HETATM 6140 C C5 B ATP C 3 . ? 5.87370 28.70208 -26.00718 0.418 39.11870 ? 402 ATP A C5 1 HETATM 6141 C C6 A ATP C 3 . ? 3.57912 31.95686 -27.24083 0.582 48.47254 ? 402 ATP A C6 1 HETATM 6142 C C6 B ATP C 3 . ? 5.34408 27.55940 -26.63328 0.418 37.75272 ? 402 ATP A C6 1 HETATM 6143 N N6 A ATP C 3 . ? 2.97856 33.06556 -27.68699 0.582 50.77484 ? 402 ATP A N6 1 HETATM 6144 N N6 B ATP C 3 . ? 4.09483 27.46984 -27.09689 0.418 43.00339 ? 402 ATP A N6 1 HETATM 6145 N N1 A ATP C 3 . ? 3.07953 30.75881 -27.62059 0.582 36.62165 ? 402 ATP A N1 1 HETATM 6146 N N1 B ATP C 3 . ? 6.15114 26.49036 -26.76605 0.418 37.86211 ? 402 ATP A N1 1 HETATM 6147 C C2 A ATP C 3 . ? 3.67268 29.64621 -27.18711 0.582 41.75060 ? 402 ATP A C2 1 HETATM 6148 C C2 B ATP C 3 . ? 7.40048 26.56583 -26.30240 0.418 27.87366 ? 402 ATP A C2 1 HETATM 6149 N N3 A ATP C 3 . ? 4.72491 29.52412 -26.37497 0.582 39.36482 ? 402 ATP A N3 1 HETATM 6150 N N3 B ATP C 3 . ? 8.01290 27.58417 -25.70617 0.418 38.52425 ? 402 ATP A N3 1 HETATM 6151 C C4 A ATP C 3 . ? 5.18695 30.72128 -26.00068 0.582 40.40120 ? 402 ATP A C4 1 HETATM 6152 C C4 B ATP C 3 . ? 7.19001 28.62577 -25.58514 0.418 41.04010 ? 402 ATP A C4 1 HETATM 6153 H "H5'1" A ATP C 3 . ? 8.22424 31.56483 -21.07436 0.582 49.25628 ? 402 ATP A "H5'1" 1 HETATM 6154 H "H5'1" B ATP C 3 . ? 8.55074 31.52430 -20.82035 0.418 49.62019 ? 402 ATP A "H5'1" 1 HETATM 6155 H "H5'2" A ATP C 3 . ? 9.66634 31.89482 -21.64073 0.582 49.25628 ? 402 ATP A "H5'2" 1 HETATM 6156 H "H5'2" B ATP C 3 . ? 9.57098 32.67947 -21.18649 0.418 49.62019 ? 402 ATP A "H5'2" 1 HETATM 6157 H "H4'" A ATP C 3 . ? 8.98552 29.77833 -22.43801 0.582 47.06609 ? 402 ATP A "H4'" 1 HETATM 6158 H "H4'" B ATP C 3 . ? 10.35055 30.58209 -22.11790 0.418 49.81985 ? 402 ATP A "H4'" 1 HETATM 6159 H "H3'" A ATP C 3 . ? 9.17224 31.85115 -24.40818 0.582 47.41268 ? 402 ATP A "H3'" 1 HETATM 6160 H "H3'" B ATP C 3 . ? 10.21530 32.87036 -23.46804 0.418 48.09252 ? 402 ATP A "H3'" 1 HETATM 6161 H "H2'" A ATP C 3 . ? 8.54958 30.31374 -26.02474 0.582 46.77701 ? 402 ATP A "H2'" 1 HETATM 6162 H "H2'" B ATP C 3 . ? 8.28784 32.27631 -24.66879 0.418 48.41440 ? 402 ATP A "H2'" 1 HETATM 6163 H "HO2'" A ATP C 3 . ? 8.59319 28.40904 -24.13882 0.582 44.85629 ? 402 ATP A "HO2'" 1 HETATM 6164 H "HO2'" B ATP C 3 . ? 10.21747 30.96202 -26.00652 0.418 49.60523 ? 402 ATP A "HO2'" 1 HETATM 6165 H "H1'" A ATP C 3 . ? 6.71266 29.11005 -24.51431 0.582 48.11042 ? 402 ATP A "H1'" 1 HETATM 6166 H "H1'" B ATP C 3 . ? 9.44176 29.61111 -24.72787 0.418 47.24350 ? 402 ATP A "H1'" 1 HETATM 6167 H H8 A ATP C 3 . ? 6.96503 32.78453 -24.56673 0.582 49.78689 ? 402 ATP A H8 1 HETATM 6168 H H8 B ATP C 3 . ? 6.25635 31.45503 -24.82614 0.418 48.52692 ? 402 ATP A H8 1 HETATM 6169 H HN61 A ATP C 3 . ? 2.28511 33.00351 -28.19146 0.582 60.92981 ? 402 ATP A HN61 1 HETATM 6170 H HN61 B ATP C 3 . ? 3.73058 28.14189 -27.49012 0.418 51.60407 ? 402 ATP A HN61 1 HETATM 6171 H HN62 A ATP C 3 . ? 3.27381 33.83903 -27.45587 0.582 60.92981 ? 402 ATP A HN62 1 HETATM 6172 H HN62 B ATP C 3 . ? 3.65605 26.73568 -27.00232 0.418 51.60407 ? 402 ATP A HN62 1 HETATM 6173 H H2 A ATP C 3 . ? 3.30395 28.84845 -27.49128 0.582 50.10073 ? 402 ATP A H2 1 HETATM 6174 H H2 B ATP C 3 . ? 7.91459 25.79861 -26.41172 0.418 33.44840 ? 402 ATP A H2 1 HETATM 6175 MG MG . MG D 4 . ? 6.79082 33.23447 -18.32738 1.000 35.90075 ? 403 MG A MG 1 HETATM 6176 MG MG . MG E 4 . ? 4.90008 31.83127 -21.16886 1.000 40.01441 ? 404 MG A MG 1 HETATM 6177 O O . HOH F 5 . ? 2.36202 40.04248 -9.40991 1.000 54.92817 ? 501 HOH A O 1 HETATM 6178 O O . HOH F 5 . ? 0.50389 9.50521 -18.46731 1.000 51.97015 ? 502 HOH A O 1 HETATM 6179 O O . HOH F 5 . ? -11.28966 45.91410 -11.76847 1.000 64.92902 ? 503 HOH A O 1 HETATM 6180 O O . HOH F 5 . ? 4.34857 34.76088 -19.93863 1.000 38.16097 ? 504 HOH A O 1 HETATM 6181 O O . HOH F 5 . ? -0.92451 19.60369 -29.15834 1.000 38.93139 ? 505 HOH A O 1 HETATM 6182 O O . HOH F 5 . ? -2.73897 14.47685 -27.13588 1.000 58.24776 ? 506 HOH A O 1 HETATM 6183 O O . HOH F 5 . ? 1.76430 -20.67972 -7.95108 1.000 68.84093 ? 507 HOH A O 1 HETATM 6184 O O . HOH F 5 . ? -16.41549 33.30373 -29.36927 1.000 71.57681 ? 508 HOH A O 1 HETATM 6185 O O . HOH F 5 . ? 5.07436 36.55043 -21.28849 1.000 55.23393 ? 509 HOH A O 1 HETATM 6186 O O . HOH F 5 . ? -3.06159 15.90417 -42.12865 1.000 64.22134 ? 510 HOH A O 1 HETATM 6187 O O . HOH F 5 . ? 3.57694 -23.24497 -5.79342 1.000 59.33927 ? 511 HOH A O 1 HETATM 6188 O O . HOH F 5 . ? 8.65991 -12.04656 -2.55790 1.000 70.50150 ? 512 HOH A O 1 HETATM 6189 O O . HOH F 5 . ? 7.09018 22.74962 -1.73416 1.000 53.32013 ? 513 HOH A O 1 HETATM 6190 O O . HOH F 5 . ? -12.22094 -19.19632 -7.01535 1.000 61.82291 ? 514 HOH A O 1 HETATM 6191 O O . HOH F 5 . ? 8.90423 39.28955 -16.41083 1.000 56.46472 ? 515 HOH A O 1 HETATM 6192 O O . HOH F 5 . ? -5.069 21.661 -2.886 1.000 52.83294 ? 516 HOH A O 1 HETATM 6193 O O . HOH F 5 . ? 18.03592 22.96336 -7.13071 1.000 61.96741 ? 517 HOH A O 1 HETATM 6194 O O . HOH F 5 . ? 0.45013 4.88259 -16.68356 1.000 57.80665 ? 518 HOH A O 1 HETATM 6195 O O . HOH F 5 . ? -0.47273 16.91573 -36.74429 1.000 58.63906 ? 519 HOH A O 1 HETATM 6196 O O . HOH F 5 . ? -0.54921 34.64711 -19.53546 1.000 46.33740 ? 520 HOH A O 1 HETATM 6197 O O . HOH F 5 . ? 0.66407 23.74443 -0.66839 1.000 53.21021 ? 521 HOH A O 1 HETATM 6198 O O . HOH F 5 . ? -13.02093 20.30653 -8.78820 1.000 54.47923 ? 522 HOH A O 1 HETATM 6199 O O . HOH F 5 . ? -14.04435 19.61571 -16.37320 1.000 54.35814 ? 523 HOH A O 1 HETATM 6200 O O . HOH F 5 . ? 13.32694 34.39507 -3.65856 1.000 47.01071 ? 524 HOH A O 1 HETATM 6201 O O . HOH F 5 . ? -19.01883 22.02904 -16.34722 1.000 61.82766 ? 525 HOH A O 1 HETATM 6202 O O . HOH F 5 . ? -11.46859 -6.33792 -17.53705 1.000 53.48741 ? 526 HOH A O 1 HETATM 6203 O O . HOH F 5 . ? -19.50006 34.85105 -4.32134 1.000 61.55510 ? 527 HOH A O 1 HETATM 6204 O O . HOH F 5 . ? 2.58653 35.78836 -18.65202 1.000 46.74923 ? 528 HOH A O 1 HETATM 6205 O O . HOH F 5 . ? -8.89988 -21.32862 0.03359 1.000 51.31918 ? 529 HOH A O 1 HETATM 6206 O O . HOH F 5 . ? -5.64743 20.53240 -30.06743 1.000 45.17605 ? 530 HOH A O 1 HETATM 6207 O O . HOH F 5 . ? -13.83767 15.96571 -32.97529 1.000 53.46817 ? 531 HOH A O 1 HETATM 6208 O O . HOH F 5 . ? -18.91153 33.72295 -1.60770 1.000 62.65931 ? 532 HOH A O 1 HETATM 6209 O O . HOH F 5 . ? -16.61966 36.63844 1.50835 1.000 57.30975 ? 533 HOH A O 1 HETATM 6210 O O . HOH F 5 . ? 4.21873 31.97647 -4.25616 1.000 44.51448 ? 534 HOH A O 1 HETATM 6211 O O . HOH F 5 . ? 10.03348 33.47097 -1.08920 1.000 53.34137 ? 535 HOH A O 1 HETATM 6212 O O . HOH F 5 . ? 7.21780 -20.75907 -3.87841 1.000 57.94996 ? 536 HOH A O 1 HETATM 6213 O O . HOH F 5 . ? -6.478 23.051 0.744 1.000 60.15236 ? 537 HOH A O 1 HETATM 6214 O O . HOH F 5 . ? -15.76253 31.32750 -23.25688 1.000 50.94787 ? 538 HOH A O 1 HETATM 6215 O O . HOH F 5 . ? 8.66264 0.53220 -21.95348 1.000 56.07784 ? 539 HOH A O 1 HETATM 6216 O O . HOH F 5 . ? -5.22938 11.47684 -34.81840 1.000 56.48114 ? 540 HOH A O 1 HETATM 6217 O O . HOH F 5 . ? -14.94736 35.08440 -16.85585 1.000 50.07511 ? 541 HOH A O 1 HETATM 6218 O O . HOH F 5 . ? 3.74955 30.46483 -22.78338 1.000 43.32166 ? 542 HOH A O 1 HETATM 6219 O O . HOH F 5 . ? -8.18859 14.79494 -3.54979 1.000 59.86986 ? 543 HOH A O 1 HETATM 6220 O O . HOH F 5 . ? -14.76469 15.50890 -30.46413 1.000 50.12666 ? 544 HOH A O 1 HETATM 6221 O O . HOH F 5 . ? 10.48455 32.67494 -11.65502 1.000 43.30561 ? 545 HOH A O 1 HETATM 6222 O O . HOH F 5 . ? 4.11646 3.65990 -17.80329 1.000 58.34165 ? 546 HOH A O 1 HETATM 6223 O O . HOH F 5 . ? -7.75660 17.56041 -21.46222 1.000 49.47057 ? 547 HOH A O 1 HETATM 6224 O O . HOH F 5 . ? -16.85054 16.32772 -25.70706 1.000 52.31120 ? 548 HOH A O 1 HETATM 6225 O O . HOH F 5 . ? -3.21729 27.76163 1.01179 1.000 58.68994 ? 549 HOH A O 1 HETATM 6226 O O . HOH F 5 . ? 17.13635 17.94222 -16.68539 1.000 65.70678 ? 550 HOH A O 1 HETATM 6227 O O . HOH F 5 . ? -14.113 40.060 0.954 1.000 48.48133 ? 551 HOH A O 1 HETATM 6228 O O . HOH F 5 . ? -2.30051 14.66852 -7.06340 1.000 53.07201 ? 552 HOH A O 1 HETATM 6229 O O . HOH F 5 . ? -13.45384 20.01916 -11.94024 1.000 48.12858 ? 553 HOH A O 1 HETATM 6230 O O . HOH F 5 . ? 3.47862 38.56377 -19.09721 1.000 55.52053 ? 554 HOH A O 1 HETATM 6231 O O . HOH F 5 . ? 20.36540 27.25720 -21.48626 1.000 62.02437 ? 555 HOH A O 1 HETATM 6232 O O . HOH F 5 . ? 17.59862 25.34404 2.92833 1.000 60.81234 ? 556 HOH A O 1 HETATM 6233 O O . HOH F 5 . ? 7.56026 -19.86232 -25.50193 1.000 69.20402 ? 557 HOH A O 1 HETATM 6234 O O . HOH F 5 . ? -8.63009 15.23362 -12.00423 1.000 72.16072 ? 558 HOH A O 1 HETATM 6235 O O . HOH F 5 . ? 0.96898 32.75883 -20.91106 1.000 49.35773 ? 559 HOH A O 1 HETATM 6236 O O . HOH F 5 . ? -23.16473 21.25837 -27.07039 1.000 58.43594 ? 560 HOH A O 1 HETATM 6237 O O . HOH F 5 . ? -5.40133 2.76778 -13.22779 1.000 52.95368 ? 561 HOH A O 1 HETATM 6238 O O . HOH F 5 . ? -2.97892 41.41489 -19.90092 1.000 62.56074 ? 562 HOH A O 1 HETATM 6239 O O . HOH F 5 . ? 6.32558 23.20889 -22.79554 1.000 47.83730 ? 563 HOH A O 1 HETATM 6240 O O . HOH F 5 . ? 8.58390 -1.82817 -28.23168 1.000 56.27719 ? 564 HOH A O 1 HETATM 6241 O O . HOH F 5 . ? 1.62777 18.57183 -3.25617 1.000 59.23442 ? 565 HOH A O 1 HETATM 6242 O O . HOH F 5 . ? 3.81123 33.76854 -22.29227 1.000 48.44210 ? 566 HOH A O 1 HETATM 6243 O O . HOH F 5 . ? -19.22887 32.36317 -22.05880 1.000 58.19237 ? 567 HOH A O 1 HETATM 6244 O O . HOH F 5 . ? -9.65395 33.72470 1.87253 1.000 47.09557 ? 568 HOH A O 1 HETATM 6245 O O . HOH F 5 . ? -3.81361 41.18595 -1.83768 1.000 65.11125 ? 569 HOH A O 1 HETATM 6246 O O . HOH F 5 . ? -15.83124 31.10749 -27.54992 1.000 61.94781 ? 570 HOH A O 1 HETATM 6247 O O . HOH F 5 . ? -17.17082 4.20256 -27.75963 1.000 73.53609 ? 571 HOH A O 1 HETATM 6248 O O . HOH F 5 . ? 12.78915 18.30301 -12.16174 1.000 58.12691 ? 572 HOH A O 1 HETATM 6249 O O . HOH F 5 . ? 2.67782 19.96847 -5.36497 1.000 53.19074 ? 573 HOH A O 1 HETATM 6250 O O . HOH F 5 . ? -7.16199 3.62929 -15.48920 1.000 65.21793 ? 574 HOH A O 1 HETATM 6251 O O . HOH F 5 . ? -22.29464 23.52526 -18.67016 1.000 66.19124 ? 575 HOH A O 1 HETATM 6252 O O . HOH F 5 . ? 4.88398 32.67826 -6.91189 1.000 50.34218 ? 576 HOH A O 1 HETATM 6253 O O . HOH F 5 . ? -20.34575 38.64251 -13.25006 1.000 74.49340 ? 577 HOH A O 1 HETATM 6254 O O . HOH F 5 . ? 13.53267 16.58135 -14.90045 1.000 68.73839 ? 578 HOH A O 1 HETATM 6255 O O . HOH F 5 . ? -21.75530 27.84539 -10.56771 1.000 73.75503 ? 579 HOH A O 1 HETATM 6256 O O . HOH F 5 . ? -0.00000 19.37364 -26.32500 0.50 54.26062 ? 580 HOH A O 1 HETATM 6257 O O . HOH F 5 . ? -14.50877 18.09426 -7.60300 1.000 75.25862 ? 581 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 . MET A 1 ? 0.62901 1.16766 1.19270 -0.03931 0.03334 0.32472 1 MET A N 2 C CA . MET A 1 ? 0.65460 1.09128 1.12141 -0.04973 0.02936 0.27978 1 MET A CA 3 C C . MET A 1 ? 0.66939 1.04615 1.09033 -0.02216 0.02630 0.25171 1 MET A C 4 O O . MET A 1 ? 0.62302 1.02313 1.07572 -0.01183 0.00932 0.26656 1 MET A O 5 C CB . MET A 1 ? 0.63610 1.04190 1.07620 -0.10486 -0.01314 0.27609 1 MET A CB 6 C CG . MET A 1 ? 0.80733 1.13593 1.17331 -0.11632 -0.00581 0.24483 1 MET A CG 7 S SD . MET A 1 ? 0.99818 1.29647 1.34692 -0.17672 -0.04142 0.24912 1 MET A SD 8 C CE . MET A 1 ? 0.80102 1.19665 1.24430 -0.21187 -0.06805 0.29882 1 MET A CE 20 N N . LYS A 2 ? 0.65299 0.95513 1.00149 -0.01283 0.04059 0.21503 2 LYS A N 21 C CA . LYS A 2 ? 0.59642 0.83689 0.89798 0.00720 0.03835 0.18843 2 LYS A CA 22 C C . LYS A 2 ? 0.60391 0.77919 0.83934 -0.02078 0.01670 0.16150 2 LYS A C 23 O O . LYS A 2 ? 0.62120 0.78083 0.83298 -0.04053 0.01816 0.15388 2 LYS A O 24 C CB . LYS A 2 ? 0.71596 0.93043 0.99562 0.04820 0.07851 0.17026 2 LYS A CB 25 C CG . LYS A 2 ? 0.76018 0.91438 1.00300 0.06905 0.07722 0.14850 2 LYS A CG 26 C CD . LYS A 2 ? 0.81950 0.94208 1.03691 0.10621 0.11511 0.12896 2 LYS A CD 27 C CE . LYS A 2 ? 0.93963 1.00212 1.13142 0.12686 0.11317 0.11294 2 LYS A CE 28 N NZ . LYS A 2 ? 0.80648 0.83658 0.97961 0.16688 0.14964 0.09623 2 LYS A NZ 42 N N . ARG A 3 ? 0.60913 0.74799 0.81645 -0.02066 -0.00180 0.15019 3 ARG A N 43 C CA . ARG A 3 ? 0.56945 0.65035 0.71581 -0.03962 -0.01568 0.12516 3 ARG A CA 44 C C . ARG A 3 ? 0.65179 0.68942 0.76517 -0.02033 -0.00968 0.10813 3 ARG A C 45 O O . ARG A 3 ? 0.65898 0.70350 0.78839 -0.00851 -0.01695 0.11970 3 ARG A O 46 C CB . ARG A 3 ? 0.60063 0.68261 0.73901 -0.07266 -0.05081 0.13151 3 ARG A CB 47 C CG . ARG A 3 ? 0.65109 0.67297 0.72509 -0.08669 -0.05965 0.10521 3 ARG A CG 48 C CD . ARG A 3 ? 0.75470 0.76733 0.81170 -0.12114 -0.08895 0.10616 3 ARG A CD 49 N NE . ARG A 3 ? 0.79939 0.84627 0.87765 -0.13304 -0.11634 0.12610 3 ARG A NE 50 C CZ . ARG A 3 ? 0.83809 0.92254 0.94965 -0.16051 -0.14116 0.14678 3 ARG A CZ 51 N NH1 . ARG A 3 ? 0.87452 0.96113 0.99968 -0.18224 -0.14196 0.14987 3 ARG A NH1 52 N NH2 . ARG A 3 ? 0.81434 0.93668 0.94770 -0.16892 -0.16834 0.16828 3 ARG A NH2 66 N N . LEU A 4 ? 0.63811 0.63330 0.70857 -0.01921 0.00159 0.08447 4 LEU A N 67 C CA . LEU A 4 ? 0.67280 0.62715 0.71300 -0.00746 0.00689 0.06878 4 LEU A CA 68 C C . LEU A 4 ? 0.66269 0.58781 0.66378 -0.02511 -0.00580 0.05617 4 LEU A C 69 O O . LEU A 4 ? 0.64575 0.56438 0.63029 -0.03777 -0.00741 0.04857 4 LEU A O 70 C CB . LEU A 4 ? 0.67103 0.60552 0.69520 0.00830 0.03009 0.05313 4 LEU A CB 71 C CG . LEU A 4 ? 0.89994 0.81948 0.93143 0.03513 0.04569 0.05098 4 LEU A CG 72 C CD1 . LEU A 4 ? 0.97501 0.93822 1.05758 0.05325 0.05280 0.07380 4 LEU A CD1 73 C CD2 . LEU A 4 ? 0.92483 0.81759 0.92318 0.04451 0.06543 0.03010 4 LEU A CD2 85 N N . THR A 5 ? 0.62401 0.53112 0.61143 -0.02357 -0.01226 0.05619 5 THR A N 86 C CA . THR A 5 ? 0.63008 0.51522 0.58269 -0.03501 -0.01774 0.04657 5 THR A CA 87 C C . THR A 5 ? 0.68115 0.54323 0.62438 -0.02810 -0.00955 0.04132 5 THR A C 88 O O . THR A 5 ? 0.67203 0.52726 0.62636 -0.02015 -0.01067 0.05123 5 THR A O 89 C CB . THR A 5 ? 0.68329 0.57393 0.62336 -0.04613 -0.03531 0.05650 5 THR A CB 90 O OG1 . THR A 5 ? 0.66474 0.57563 0.61587 -0.05795 -0.04908 0.06305 5 THR A OG1 91 C CG2 . THR A 5 ? 0.73163 0.60162 0.63179 -0.05357 -0.03380 0.04504 5 THR A CG2 99 N N . TYR A 6 ? 0.66413 0.51398 0.58997 -0.03228 -0.00344 0.02867 6 TYR A N 100 C CA . TYR A 6 ? 0.64635 0.47766 0.56613 -0.03327 -0.00041 0.02591 6 TYR A CA 101 C C . TYR A 6 ? 0.64189 0.47793 0.54824 -0.04251 0.00021 0.02355 6 TYR A C 102 O O . TYR A 6 ? 0.63603 0.48129 0.53395 -0.04294 0.00157 0.01944 6 TYR A O 103 C CB . TYR A 6 ? 0.68372 0.49862 0.60272 -0.02704 0.00667 0.01421 6 TYR A CB 104 C CG . TYR A 6 ? 0.62717 0.44868 0.53437 -0.03097 0.00947 0.00365 6 TYR A CG 105 C CD1 . TYR A 6 ? 0.63414 0.45424 0.53264 -0.04115 0.00526 0.00045 6 TYR A CD1 106 C CD2 . TYR A 6 ? 0.70673 0.54112 0.61576 -0.02537 0.01537 0.00195 6 TYR A CD2 107 C CE1 . TYR A 6 ? 0.75253 0.58243 0.64309 -0.04310 0.00498 -0.00420 6 TYR A CE1 108 C CE2 . TYR A 6 ? 0.68281 0.52168 0.57929 -0.02878 0.01672 -0.00294 6 TYR A CE2 109 C CZ . TYR A 6 ? 0.71395 0.54974 0.60050 -0.03636 0.01057 -0.00604 6 TYR A CZ 110 O OH . TYR A 6 ? 0.72506 0.56884 0.60209 -0.03805 0.00921 -0.00615 6 TYR A OH 120 N N . ILE A 7 ? 0.65811 0.48694 0.56533 -0.04931 -0.00006 0.02841 7 ILE A N 121 C CA . ILE A 7 ? 0.66296 0.50670 0.56930 -0.05694 0.00305 0.03090 7 ILE A CA 122 C C . ILE A 7 ? 0.70889 0.54432 0.62307 -0.06716 -0.00165 0.02802 7 ILE A C 123 O O . ILE A 7 ? 0.68022 0.48672 0.59264 -0.07006 -0.00639 0.02475 7 ILE A O 124 C CB . ILE A 7 ? 0.67588 0.52989 0.57714 -0.06136 0.00645 0.04622 7 ILE A CB 125 C CG1 . ILE A 7 ? 0.74044 0.57982 0.65087 -0.07214 0.00183 0.06021 7 ILE A CG1 126 C CG2 . ILE A 7 ? 0.81933 0.67295 0.70196 -0.05502 0.00494 0.04695 7 ILE A CG2 127 C CD1 . ILE A 7 ? 0.84867 0.70673 0.75637 -0.08051 0.00831 0.08032 7 ILE A CD1 139 N N . SER A 8 ? 0.62994 0.48855 0.55155 -0.07226 -0.00159 0.02925 8 SER A N 140 C CA . SER A 8 ? 0.64127 0.49781 0.56970 -0.08807 -0.01225 0.02853 8 SER A CA 141 C C . SER A 8 ? 0.66022 0.56024 0.61250 -0.09544 -0.01138 0.04384 8 SER A C 142 O O . SER A 8 ? 0.63372 0.55985 0.59182 -0.08194 0.00177 0.05051 8 SER A O 143 C CB . SER A 8 ? 0.68137 0.52468 0.59354 -0.08475 -0.01786 0.01238 8 SER A CB 144 O OG . SER A 8 ? 0.70668 0.57710 0.62227 -0.07441 -0.01388 0.01393 8 SER A OG 150 N N . LYS A 9 ? 0.67898 0.58603 0.64479 -0.11695 -0.02564 0.04955 9 LYS A N 151 C CA . LYS A 9 ? 0.64665 0.60672 0.64768 -0.12699 -0.02738 0.06995 9 LYS A CA 152 C C . LYS A 9 ? 0.68659 0.66648 0.69302 -0.13062 -0.04259 0.06728 9 LYS A C 153 O O . LYS A 9 ? 0.70882 0.65459 0.68861 -0.14177 -0.05906 0.05131 9 LYS A O 154 C CB . LYS A 9 ? 0.73780 0.69973 0.75866 -0.15696 -0.03724 0.08672 9 LYS A CB 155 C CG . LYS A 9 ? 0.85206 0.88354 0.92115 -0.16747 -0.03413 0.11590 9 LYS A CG 156 C CD . LYS A 9 ? 1.01203 1.04674 1.10579 -0.20686 -0.05008 0.13579 9 LYS A CD 157 C CE . LYS A 9 ? 1.40535 1.44295 1.50949 -0.23839 -0.08295 0.13431 9 LYS A CE 158 N NZ . LYS A 9 ? 1.29472 1.41461 1.46151 -0.25957 -0.08943 0.16964 9 LYS A NZ 172 N N . PHE A 10 ? 0.67125 0.70527 0.70894 -0.11869 -0.03609 0.08374 10 PHE A N 173 C CA . PHE A 10 ? 0.61707 0.68151 0.66889 -0.12407 -0.05451 0.09051 10 PHE A CA 174 C C . PHE A 10 ? 0.69442 0.76256 0.75481 -0.16339 -0.08370 0.09622 10 PHE A C 175 O O . PHE A 10 ? 0.66014 0.75300 0.75324 -0.18371 -0.08562 0.11448 10 PHE A O 176 C CB . PHE A 10 ? 0.70896 0.83895 0.80715 -0.10374 -0.04186 0.11507 10 PHE A CB 177 C CG . PHE A 10 ? 0.63308 0.75017 0.71689 -0.06558 -0.01824 0.10734 10 PHE A CG 178 C CD1 . PHE A 10 ? 0.62900 0.69015 0.66933 -0.05547 -0.00744 0.08436 10 PHE A CD1 179 C CD2 . PHE A 10 ? 0.70819 0.86958 0.82579 -0.04029 -0.00792 0.12549 10 PHE A CD2 180 C CE1 . PHE A 10 ? 0.64862 0.69261 0.67441 -0.02714 0.00978 0.07749 10 PHE A CE1 181 C CE2 . PHE A 10 ? 0.72599 0.86240 0.82593 -0.00652 0.01269 0.11684 10 PHE A CE2 182 C CZ . PHE A 10 ? 0.73259 0.80766 0.78428 -0.00307 0.01995 0.09186 10 PHE A CZ 192 N N A SER A 11 ? 0.72010 0.76127 0.74695 -0.17662 -0.10705 0.08111 11 SER A N 193 N N B SER A 11 ? 0.72102 0.76217 0.74778 -0.17644 -0.10696 0.08106 11 SER A N 194 C CA A SER A 11 ? 0.75181 0.79260 0.77907 -0.21759 -0.14050 0.08430 11 SER A CA 195 C CA B SER A 11 ? 0.75271 0.79336 0.77931 -0.21724 -0.14059 0.08404 11 SER A CA 196 C C A SER A 11 ? 0.70452 0.82980 0.79081 -0.23011 -0.15756 0.11799 11 SER A C 197 C C B SER A 11 ? 0.70751 0.83239 0.79273 -0.22986 -0.15796 0.11759 11 SER A C 198 O O A SER A 11 ? 0.76364 0.90851 0.87266 -0.26966 -0.18473 0.13159 11 SER A O 199 O O B SER A 11 ? 0.76521 0.90892 0.87211 -0.26958 -0.18561 0.13072 11 SER A O 200 C CB A SER A 11 ? 0.80447 0.78979 0.76682 -0.22650 -0.15959 0.05604 11 SER A CB 201 C CB B SER A 11 ? 0.80557 0.79066 0.76697 -0.22555 -0.15921 0.05567 11 SER A CB 202 O OG A SER A 11 ? 0.85503 0.87618 0.81480 -0.21454 -0.16815 0.06367 11 SER A OG 203 O OG B SER A 11 ? 0.86242 0.77077 0.77734 -0.22239 -0.14811 0.02763 11 SER A OG 214 N N A ARG A 12 ? 0.71733 0.89223 0.83182 -0.19732 -0.14282 0.13361 12 ARG A N 215 N N B ARG A 12 ? 0.71853 0.89357 0.83260 -0.19717 -0.14319 0.13355 12 ARG A N 216 C CA A ARG A 12 ? 0.75865 1.02122 0.93686 -0.19890 -0.15527 0.16965 12 ARG A CA 217 C CA B ARG A 12 ? 0.75812 1.02094 0.93611 -0.19918 -0.15593 0.16971 12 ARG A CA 218 C C A ARG A 12 ? 0.69950 0.99568 0.90705 -0.14949 -0.12074 0.18244 12 ARG A C 219 C C B ARG A 12 ? 0.70094 0.99719 0.90751 -0.14962 -0.12222 0.18241 12 ARG A C 220 O O A ARG A 12 ? 0.66523 0.90981 0.83297 -0.12139 -0.09659 0.16013 12 ARG A O 221 O O B ARG A 12 ? 0.67393 0.91835 0.83941 -0.12148 -0.09962 0.16002 12 ARG A O 222 C CB A ARG A 12 ? 0.77948 1.05153 0.93856 -0.21844 -0.19498 0.17159 12 ARG A CB 223 C CB B ARG A 12 ? 0.77946 1.05180 0.93867 -0.22111 -0.19693 0.17178 12 ARG A CB 224 C CG A ARG A 12 ? 0.85392 1.10568 0.97635 -0.18473 -0.18723 0.16215 12 ARG A CG 225 C CG B ARG A 12 ? 0.85640 1.15076 1.01425 -0.18645 -0.19343 0.18107 12 ARG A CG 226 C CD A ARG A 12 ? 0.97075 1.21767 1.05281 -0.20898 -0.22747 0.15978 12 ARG A CD 227 C CD B ARG A 12 ? 0.90993 1.20442 1.03207 -0.21199 -0.23623 0.18125 12 ARG A CD 228 N NE A ARG A 12 ? 1.04029 1.24312 1.06474 -0.18430 -0.21743 0.14300 12 ARG A NE 229 N NE B ARG A 12 ? 1.00830 1.25895 1.07220 -0.18736 -0.22855 0.16510 12 ARG A NE 230 C CZ A ARG A 12 ? 1.05732 1.28470 1.10131 -0.14854 -0.20318 0.16129 12 ARG A CZ 231 C CZ B ARG A 12 ? 1.05181 1.22399 1.04051 -0.18930 -0.22008 0.12866 12 ARG A CZ 232 N NH1 A ARG A 12 ? 1.00431 1.29728 1.12163 -0.12676 -0.19457 0.19414 12 ARG A NH1 233 N NH1 B ARG A 12 ? 1.01314 1.13313 0.97182 -0.21072 -0.21817 0.10162 12 ARG A NH1 234 N NH2 A ARG A 12 ? 1.06430 1.24780 1.05354 -0.13313 -0.19551 0.14780 12 ARG A NH2 235 N NH2 B ARG A 12 ? 1.06108 1.20804 1.00683 -0.16790 -0.21195 0.12235 12 ARG A NH2 262 N N . PRO A 13 ? 0.72064 1.10124 0.99822 -0.13778 -0.11743 0.21851 13 PRO A N 263 C CA . PRO A 13 ? 0.68296 1.08536 0.98249 -0.08597 -0.08473 0.22851 13 PRO A CA 264 C C . PRO A 13 ? 0.77235 1.12977 1.02723 -0.06498 -0.09064 0.21365 13 PRO A C 265 O O . PRO A 13 ? 0.80737 1.17412 1.05303 -0.08196 -0.12391 0.22029 13 PRO A O 266 C CB . PRO A 13 ? 0.72582 1.23423 1.11327 -0.08060 -0.08912 0.27424 13 PRO A CB 267 C CG . PRO A 13 ? 0.76428 1.31107 1.18015 -0.13609 -0.12407 0.28980 13 PRO A CG 268 C CD . PRO A 13 ? 0.82806 1.28586 1.17270 -0.16993 -0.13554 0.25249 13 PRO A CD 276 N N . LEU A 14 ? 0.76214 1.06942 0.98575 -0.03095 -0.05961 0.19478 14 LEU A N 277 C CA . LEU A 14 ? 0.67698 0.94135 0.86448 -0.00913 -0.05963 0.18542 14 LEU A CA 278 C C . LEU A 14 ? 0.75234 1.02988 0.96965 0.03835 -0.03104 0.19976 14 LEU A C 279 O O . LEU A 14 ? 0.71767 0.98871 0.94032 0.05820 0.00057 0.19281 14 LEU A O 280 C CB . LEU A 14 ? 0.67246 0.85555 0.79303 -0.01503 -0.05133 0.14943 14 LEU A CB 281 C CG . LEU A 14 ? 0.67965 0.83352 0.76390 -0.05284 -0.06999 0.12941 14 LEU A CG 282 C CD1 . LEU A 14 ? 0.75921 0.84474 0.79109 -0.04841 -0.05569 0.10013 14 LEU A CD1 283 C CD2 . LEU A 14 ? 0.86878 1.03577 0.93934 -0.07667 -0.10483 0.13579 14 LEU A CD2 295 N N . SER A 15 ? 0.66369 0.95453 0.89493 0.05774 -0.04164 0.21961 15 SER A N 296 C CA . SER A 15 ? 0.75017 1.03859 1.00506 0.10705 -0.01421 0.23194 15 SER A CA 297 C C . SER A 15 ? 0.72801 0.92333 0.92184 0.12179 0.00508 0.20111 15 SER A C 298 O O . SER A 15 ? 0.65938 0.80534 0.80184 0.09567 -0.00606 0.17793 15 SER A O 299 C CB . SER A 15 ? 0.74040 1.07211 1.03432 0.12447 -0.03397 0.26874 15 SER A CB 300 O OG . SER A 15 ? 0.83999 1.15199 1.09399 0.09485 -0.06869 0.26712 15 SER A OG 306 N N . GLY A 16 ? 0.71318 0.88422 0.91364 0.16440 0.03465 0.20157 16 GLY A N 307 C CA . GLY A 16 ? 0.82284 0.90234 0.96658 0.17477 0.04823 0.17451 16 GLY A CA 308 C C . GLY A 16 ? 0.79349 0.83621 0.91018 0.16216 0.02474 0.17912 16 GLY A C 309 O O . GLY A 16 ? 0.75422 0.73608 0.82180 0.14477 0.02331 0.15624 16 GLY A O 313 N N A ASP A 17 ? 0.74416 0.82990 0.89428 0.16921 0.00522 0.21251 17 ASP A N 314 N N B ASP A 17 ? 0.74475 0.82964 0.89502 0.17015 0.00574 0.21261 17 ASP A N 315 C CA A ASP A 17 ? 0.80273 0.85567 0.92345 0.15921 -0.01508 0.22216 17 ASP A CA 316 C CA B ASP A 17 ? 0.80237 0.85628 0.92342 0.15891 -0.01539 0.22236 17 ASP A CA 317 C C A ASP A 17 ? 0.77678 0.82947 0.85722 0.11387 -0.03628 0.20658 17 ASP A C 318 C C B ASP A 17 ? 0.77821 0.82799 0.85720 0.11370 -0.03466 0.20426 17 ASP A C 319 O O A ASP A 17 ? 0.76275 0.76932 0.80095 0.10163 -0.04074 0.20013 17 ASP A O 320 O O B ASP A 17 ? 0.76140 0.76069 0.79664 0.10119 -0.03650 0.19391 17 ASP A O 321 C CB A ASP A 17 ? 0.79140 0.89314 0.95591 0.18005 -0.03238 0.26612 17 ASP A CB 322 C CB B ASP A 17 ? 0.78977 0.89867 0.95418 0.17496 -0.03567 0.26609 17 ASP A CB 323 C CG A ASP A 17 ? 0.80321 0.99755 1.00743 0.15893 -0.05889 0.28721 17 ASP A CG 324 C CG B ASP A 17 ? 0.85603 0.94695 1.05368 0.22713 -0.01530 0.28671 17 ASP A CG 325 O OD1 A ASP A 17 ? 0.79891 1.04329 1.04515 0.16235 -0.04821 0.28744 17 ASP A OD1 326 O OD1 B ASP A 17 ? 0.94498 0.96296 1.11669 0.24719 0.01244 0.26286 17 ASP A OD1 327 O OD2 A ASP A 17 ? 0.85131 1.06870 1.04297 0.13725 -0.09148 0.30558 17 ASP A OD2 328 O OD2 B ASP A 17 ? 0.95658 1.10366 1.20472 0.24855 -0.02836 0.32715 17 ASP A OD2 337 N N . GLU A 18 ? 0.71128 0.81165 0.80355 0.08929 -0.04727 0.20071 18 GLU A N 338 C CA . GLU A 18 ? 0.79569 0.88442 0.84453 0.05093 -0.06339 0.18115 18 GLU A CA 339 C C . GLU A 18 ? 0.71173 0.74270 0.72330 0.04406 -0.04358 0.14801 18 GLU A C 340 O O . GLU A 18 ? 0.74926 0.75023 0.71951 0.02598 -0.04808 0.13487 18 GLU A O 341 C CB . GLU A 18 ? 0.75253 0.89499 0.82241 0.02522 -0.08157 0.18276 18 GLU A CB 342 C CG . GLU A 18 ? 0.82991 1.03955 0.93813 0.02271 -0.10987 0.21802 18 GLU A CG 343 C CD . GLU A 18 ? 1.02485 1.28410 1.15499 -0.01045 -0.13148 0.21967 18 GLU A CD 344 O OE1 . GLU A 18 ? 1.00070 1.24675 1.08699 -0.04521 -0.15690 0.20664 18 GLU A OE1 345 O OE2 . GLU A 18 ? 0.81118 1.11914 0.99956 -0.00240 -0.12162 0.23365 18 GLU A OE2 352 N N . ILE A 19 ? 0.70709 0.72631 0.73240 0.05890 -0.02121 0.13608 19 ILE A N 353 C CA . ILE A 19 ? 0.73500 0.70384 0.72668 0.05164 -0.00670 0.10823 19 ILE A CA 354 C C . ILE A 19 ? 0.72952 0.64480 0.69430 0.05818 -0.00256 0.10644 19 ILE A C 355 O O . ILE A 19 ? 0.72149 0.60759 0.65718 0.04051 -0.00290 0.09216 19 ILE A O 356 C CB . ILE A 19 ? 0.83916 0.80781 0.84331 0.06591 0.01460 0.09809 19 ILE A CB 357 C CG1 . ILE A 19 ? 0.78323 0.80089 0.81025 0.04924 0.01013 0.10025 19 ILE A CG1 358 C CG2 . ILE A 19 ? 0.72336 0.63577 0.68952 0.06129 0.02601 0.07302 19 ILE A CG2 359 C CD1 . ILE A 19 ? 0.86782 0.92379 0.93189 0.07063 0.02913 0.11203 19 ILE A CD1 371 N N A GLU A 20 ? 0.76107 0.66311 0.73925 0.08394 0.00185 0.12364 20 GLU A N 372 N N B GLU A 20 ? 0.76216 0.66472 0.74024 0.08355 0.00138 0.12400 20 GLU A N 373 C CA A GLU A 20 ? 0.82997 0.67626 0.78455 0.08659 0.00291 0.12701 20 GLU A CA 374 C CA B GLU A 20 ? 0.83008 0.67555 0.78400 0.08616 0.00314 0.12627 20 GLU A CA 375 C C A GLU A 20 ? 0.79565 0.65049 0.73054 0.06347 -0.01315 0.13802 20 GLU A C 376 C C B GLU A 20 ? 0.79600 0.64947 0.73174 0.06517 -0.01321 0.13985 20 GLU A C 377 O O A GLU A 20 ? 0.75463 0.57356 0.66450 0.04900 -0.01089 0.13269 20 GLU A O 378 O O B GLU A 20 ? 0.76656 0.58116 0.67837 0.05320 -0.01126 0.13781 20 GLU A O 379 C CB A GLU A 20 ? 0.81070 0.63918 0.78528 0.12099 0.00862 0.14826 20 GLU A CB 380 C CB B GLU A 20 ? 0.82421 0.64613 0.79617 0.12140 0.01141 0.14383 20 GLU A CB 381 C CG A GLU A 20 ? 0.93077 0.69803 0.89352 0.14351 0.03006 0.13014 20 GLU A CG 382 C CG B GLU A 20 ? 0.90068 0.68913 0.87164 0.14630 0.03487 0.12466 20 GLU A CG 383 C CD A GLU A 20 ? 1.09148 0.78761 1.01327 0.12272 0.02922 0.11269 20 GLU A CD 384 C CD B GLU A 20 ? 0.98992 0.72323 0.91925 0.12677 0.04090 0.09313 20 GLU A CD 385 O OE1 A GLU A 20 ? 0.99254 0.65875 0.90605 0.11538 0.01970 0.12994 20 GLU A OE1 386 O OE1 B GLU A 20 ? 1.04851 0.72933 0.95330 0.11261 0.03421 0.09157 20 GLU A OE1 387 O OE2 A GLU A 20 ? 1.05222 0.72600 0.95158 0.11146 0.03647 0.08505 20 GLU A OE2 388 O OE2 B GLU A 20 ? 1.00283 0.74859 0.92578 0.12373 0.05074 0.07336 20 GLU A OE2 401 N N . ALA A 21 ? 0.70314 0.60780 0.64743 0.05853 -0.02962 0.15475 21 ALA A N 402 C CA . ALA A 21 ? 0.72696 0.63806 0.64079 0.03897 -0.04316 0.16469 21 ALA A CA 403 C C . ALA A 21 ? 0.70630 0.60967 0.59033 0.01494 -0.03780 0.13838 21 ALA A C 404 O O . ALA A 21 ? 0.74469 0.63338 0.59986 0.00320 -0.03511 0.14070 21 ALA A O 405 C CB . ALA A 21 ? 0.83928 0.80339 0.76153 0.03608 -0.06627 0.18575 21 ALA A CB 412 N N . ILE A 22 ? 0.72242 0.63714 0.61569 0.00937 -0.03416 0.11642 22 ILE A N 413 C CA . ILE A 22 ? 0.72560 0.62808 0.59697 -0.00716 -0.02686 0.09296 22 ILE A CA 414 C C . ILE A 22 ? 0.80448 0.67128 0.67103 -0.00695 -0.01279 0.08801 22 ILE A C 415 O O . ILE A 22 ? 0.74547 0.60671 0.59397 -0.01837 -0.00723 0.08419 22 ILE A O 416 C CB . ILE A 22 ? 0.76502 0.68094 0.65107 -0.01162 -0.02627 0.07567 22 ILE A CB 417 C CG1 . ILE A 22 ? 0.77074 0.71992 0.65684 -0.02323 -0.04489 0.07964 22 ILE A CG1 418 C CG2 . ILE A 22 ? 0.79992 0.69573 0.67113 -0.02142 -0.01597 0.05459 22 ILE A CG2 419 C CD1 . ILE A 22 ? 0.79177 0.76092 0.70530 -0.02785 -0.04650 0.07389 22 ILE A CD1 431 N N . GLY A 23 ? 0.74101 0.58346 0.62297 0.00570 -0.00681 0.08863 23 GLY A N 432 C CA . GLY A 23 ? 0.75575 0.55943 0.63058 -0.00010 0.00043 0.08386 23 GLY A CA 433 C C . GLY A 23 ? 0.73628 0.52426 0.60114 -0.00686 -0.00134 0.10464 23 GLY A C 434 O O . GLY A 23 ? 0.77113 0.54760 0.63089 -0.02289 0.00258 0.10469 23 GLY A O 438 N N . ARG A 24 ? 0.76756 0.55895 0.63344 0.00457 -0.00782 0.12706 24 ARG A N 439 C CA . ARG A 24 ? 0.79086 0.56824 0.64474 -0.00251 -0.00979 0.15283 24 ARG A CA 440 C C . ARG A 24 ? 0.83044 0.63834 0.66322 -0.02073 -0.00626 0.15470 24 ARG A C 441 O O . ARG A 24 ? 0.79527 0.59377 0.62299 -0.03521 0.00132 0.16475 24 ARG A O 442 C CB . ARG A 24 ? 0.97337 0.75643 0.83187 0.01510 -0.02008 0.18062 24 ARG A CB 443 C CG . ARG A 24 ? 0.99003 0.72737 0.86625 0.03740 -0.01823 0.18906 24 ARG A CG 444 C CD . ARG A 24 ? 0.92920 0.66048 0.80860 0.05144 -0.02773 0.22770 24 ARG A CD 445 N NE . ARG A 24 ? 0.81727 0.60882 0.70235 0.05845 -0.04210 0.24468 24 ARG A NE 446 C CZ . ARG A 24 ? 0.90376 0.73161 0.81750 0.07681 -0.04649 0.24119 24 ARG A CZ 447 N NH1 . ARG A 24 ? 0.77920 0.59163 0.71466 0.09326 -0.03278 0.21975 24 ARG A NH1 448 N NH2 . ARG A 24 ? 0.86241 0.74624 0.78193 0.07686 -0.06567 0.26158 24 ARG A NH2 462 N N . ILE A 25 ? 0.70775 0.55163 0.52672 -0.02041 -0.01104 0.14633 25 ILE A N 463 C CA . ILE A 25 ? 0.79864 0.66363 0.58688 -0.03254 -0.00405 0.14412 25 ILE A CA 464 C C . ILE A 25 ? 0.73627 0.59955 0.53373 -0.04018 0.01157 0.12516 25 ILE A C 465 O O . ILE A 25 ? 0.75112 0.62470 0.53826 -0.04813 0.02544 0.13266 25 ILE A O 466 C CB . ILE A 25 ? 0.81720 0.70773 0.58065 -0.03271 -0.01570 0.13358 25 ILE A CB 467 C CG1 . ILE A 25 ? 0.91057 0.81421 0.66003 -0.02942 -0.03382 0.16105 25 ILE A CG1 468 C CG2 . ILE A 25 ? 0.85716 0.75618 0.58288 -0.04092 -0.00314 0.11781 25 ILE A CG2 469 C CD1 . ILE A 25 ? 0.99929 0.92888 0.74282 -0.03153 -0.05528 0.15384 25 ILE A CD1 481 N N . SER A 26 ? 0.72735 0.58316 0.54651 -0.03687 0.01023 0.10408 26 SER A N 482 C CA A SER A 26 ? 0.77123 0.62863 0.60371 -0.04306 0.02078 0.08997 26 SER A CA 483 C CA B SER A 26 ? 0.77103 0.62891 0.60294 -0.04313 0.02096 0.09021 26 SER A CA 484 C C . SER A 26 ? 0.76132 0.60717 0.60966 -0.05459 0.02549 0.10592 26 SER A C 485 O O . SER A 26 ? 0.73681 0.60215 0.59440 -0.06290 0.03666 0.10948 26 SER A O 486 C CB A SER A 26 ? 0.72526 0.57409 0.57440 -0.03847 0.01564 0.07001 26 SER A CB 487 C CB B SER A 26 ? 0.72837 0.57903 0.57626 -0.03857 0.01608 0.06964 26 SER A CB 488 O OG A SER A 26 ? 0.69478 0.55642 0.53525 -0.03365 0.01086 0.05737 26 SER A OG 489 O OG B SER A 26 ? 0.74292 0.59498 0.60593 -0.04501 0.02219 0.06238 26 SER A OG 500 N N . SER A 27 ? 0.77718 0.59027 0.63144 -0.05524 0.01689 0.11673 27 SER A N 501 C CA A SER A 27 ? 0.85209 0.64330 0.71848 -0.07213 0.01659 0.13284 27 SER A CA 502 C CA B SER A 27 ? 0.85194 0.64323 0.71837 -0.07215 0.01660 0.13279 27 SER A CA 503 C C . SER A 27 ? 0.83177 0.64779 0.69347 -0.08307 0.02685 0.15987 27 SER A C 504 O O . SER A 27 ? 0.85661 0.68862 0.73719 -0.10060 0.03374 0.17111 27 SER A O 505 C CB A SER A 27 ? 0.90308 0.64094 0.76704 -0.06709 0.00641 0.13874 27 SER A CB 506 C CB B SER A 27 ? 0.90315 0.64097 0.76722 -0.06716 0.00640 0.13848 27 SER A CB 507 O OG A SER A 27 ? 1.05575 0.75952 0.92782 -0.08857 0.00201 0.15063 27 SER A OG 508 O OG B SER A 27 ? 1.05213 0.75408 0.92485 -0.08806 0.00120 0.14474 27 SER A OG 519 N N . GLN A 28 ? 0.79218 0.61687 0.62922 -0.07378 0.02769 0.17371 28 GLN A N 520 C CA . GLN A 28 ? 0.78634 0.63308 0.60912 -0.08318 0.03919 0.20251 28 GLN A CA 521 C C . GLN A 28 ? 0.83111 0.72340 0.65202 -0.08519 0.05989 0.19526 28 GLN A C 522 O O . GLN A 28 ? 0.83938 0.75504 0.67216 -0.09835 0.07496 0.21814 28 GLN A O 523 C CB . GLN A 28 ? 0.80552 0.65521 0.59345 -0.07188 0.03254 0.21666 28 GLN A CB 524 C CG . GLN A 28 ? 0.91610 0.72499 0.71148 -0.06594 0.01601 0.23595 28 GLN A CG 525 C CD . GLN A 28 ? 0.99320 0.81463 0.76358 -0.05101 0.00329 0.24768 28 GLN A CD 526 O OE1 . GLN A 28 ? 0.94997 0.80512 0.68481 -0.05305 0.00613 0.25106 28 GLN A OE1 527 N NE2 . GLN A 28 ? 0.96410 0.75877 0.75149 -0.03515 -0.01110 0.25455 28 GLN A NE2 536 N N A LYS A 29 ? 0.74494 0.65005 0.55307 -0.07123 0.06241 0.16562 29 LYS A N 537 N N B LYS A 29 ? 0.74407 0.64918 0.55218 -0.07123 0.06241 0.16565 29 LYS A N 538 C CA A LYS A 29 ? 0.81823 0.75797 0.62040 -0.06579 0.08492 0.15633 29 LYS A CA 539 C CA B LYS A 29 ? 0.81814 0.75789 0.62037 -0.06581 0.08492 0.15636 29 LYS A CA 540 C C A LYS A 29 ? 0.79521 0.75117 0.64659 -0.07250 0.09134 0.15515 29 LYS A C 541 C C B LYS A 29 ? 0.79542 0.75135 0.64691 -0.07259 0.09130 0.15529 29 LYS A C 542 O O A LYS A 29 ? 0.75963 0.75363 0.62756 -0.07432 0.11287 0.16960 29 LYS A O 543 O O B LYS A 29 ? 0.75895 0.75286 0.62724 -0.07469 0.11272 0.17010 29 LYS A O 544 C CB A LYS A 29 ? 0.85196 0.78681 0.62158 -0.05041 0.08255 0.12483 29 LYS A CB 545 C CB B LYS A 29 ? 0.85194 0.78678 0.62166 -0.05043 0.08254 0.12485 29 LYS A CB 546 C CG A LYS A 29 ? 0.88576 0.81444 0.60283 -0.04792 0.07355 0.12789 29 LYS A CG 547 C CG B LYS A 29 ? 0.88562 0.81467 0.60243 -0.04794 0.07395 0.12816 29 LYS A CG 548 C CD A LYS A 29 ? 0.93117 0.85089 0.61391 -0.03992 0.06723 0.09623 29 LYS A CD 549 C CD B LYS A 29 ? 0.92990 0.84810 0.61578 -0.04053 0.06428 0.09688 29 LYS A CD 550 C CE A LYS A 29 ? 0.98066 0.90875 0.62480 -0.03061 0.09327 0.08161 29 LYS A CE 551 C CE B LYS A 29 ? 0.98256 0.90607 0.62976 -0.03125 0.08758 0.07800 29 LYS A CE 552 N NZ A LYS A 29 ? 0.98039 0.88571 0.60533 -0.02355 0.08866 0.04595 29 LYS A NZ 553 N NZ B LYS A 29 ? 1.02870 0.96760 0.62679 -0.03103 0.10460 0.09520 29 LYS A NZ 580 N N . ASN A 30 ? 0.74934 0.68163 0.62486 -0.07610 0.07300 0.14078 30 ASN A N 581 C CA . ASN A 30 ? 0.75366 0.70256 0.67205 -0.08478 0.07261 0.14032 30 ASN A CA 582 C C . ASN A 30 ? 0.74016 0.70476 0.69009 -0.10891 0.07390 0.17216 30 ASN A C 583 O O . ASN A 30 ? 0.72886 0.73743 0.71686 -0.11547 0.08423 0.18491 30 ASN A O 584 C CB . ASN A 30 ? 0.69910 0.61414 0.62383 -0.08615 0.05102 0.11983 30 ASN A CB 585 C CG . ASN A 30 ? 0.73765 0.64864 0.64563 -0.06707 0.05097 0.09298 30 ASN A CG 586 O OD1 . ASN A 30 ? 0.69585 0.62077 0.58410 -0.05381 0.06413 0.08587 30 ASN A OD1 587 N ND2 . ASN A 30 ? 0.70102 0.58881 0.61242 -0.06716 0.03626 0.07795 30 ASN A ND2 595 N N . GLN A 31 ? 0.75078 0.68082 0.68973 -0.12282 0.06281 0.18855 31 GLN A N 596 C CA . GLN A 31 ? 0.74565 0.68262 0.71311 -0.15134 0.06156 0.22188 31 GLN A CA 597 C C . GLN A 31 ? 0.80913 0.81152 0.79233 -0.15220 0.09014 0.24833 31 GLN A C 598 O O . GLN A 31 ? 0.82953 0.87108 0.85998 -0.17312 0.09410 0.27193 31 GLN A O 599 C CB . GLN A 31 ? 0.85624 0.73912 0.80084 -0.16003 0.04937 0.23774 31 GLN A CB 600 C CG . GLN A 31 ? 1.10696 0.97875 1.07866 -0.19508 0.04262 0.27239 31 GLN A CG 601 C CD . GLN A 31 ? 1.33140 1.11929 1.28701 -0.20436 0.01940 0.27185 31 GLN A CD 602 O OE1 . GLN A 31 ? 1.28789 1.04210 1.21306 -0.18667 0.01881 0.27586 31 GLN A OE1 603 N NE2 . GLN A 31 ? 1.52655 1.27796 1.50047 -0.23091 -0.00084 0.26651 31 GLN A NE2 612 N N . GLN A 32 ? 0.79055 0.80792 0.73329 -0.13022 0.11052 0.24583 32 GLN A N 613 C CA . GLN A 32 ? 0.81938 0.89617 0.76511 -0.12569 0.14395 0.26857 32 GLN A CA 614 C C . GLN A 32 ? 0.84075 0.96817 0.82439 -0.11188 0.16201 0.25835 32 GLN A C 615 O O . GLN A 32 ? 0.82396 1.01217 0.84187 -0.11460 0.18810 0.28601 32 GLN A O 616 C CB . GLN A 32 ? 0.97517 1.04719 0.85339 -0.10435 0.15929 0.26133 32 GLN A CB 617 C CG . GLN A 32 ? 0.96663 1.00074 0.80998 -0.11456 0.14329 0.28026 32 GLN A CG 618 C CD . GLN A 32 ? 0.84623 0.88374 0.61971 -0.09697 0.15479 0.27592 32 GLN A CD 619 O OE1 . GLN A 32 ? 0.95275 1.02703 0.70181 -0.09523 0.18288 0.29686 32 GLN A OE1 620 N NE2 . GLN A 32 ? 1.05731 1.05981 0.79662 -0.08479 0.13316 0.24897 32 GLN A NE2 629 N N . ALA A 33 ? 0.82696 0.93359 0.80815 -0.09550 0.15012 0.22288 33 ALA A N 630 C CA . ALA A 33 ? 0.80650 0.95254 0.82035 -0.07662 0.16545 0.21257 33 ALA A CA 631 C C . ALA A 33 ? 0.83750 1.00312 0.91675 -0.09664 0.14457 0.22329 33 ALA A C 632 O O . ALA A 33 ? 0.81036 1.00891 0.92386 -0.08106 0.15120 0.21810 33 ALA A O 633 C CB . ALA A 33 ? 0.79818 0.90768 0.77053 -0.04937 0.16317 0.17151 33 ALA A CB 639 N N A ASN A 34 ? 0.77416 0.91664 0.86843 -0.13088 0.11797 0.23861 34 ASN A N 640 N N B ASN A 34 ? 0.77425 0.91631 0.86820 -0.13081 0.11785 0.23839 34 ASN A N 641 C CA A ASN A 34 ? 0.74987 0.90049 0.89327 -0.15624 0.09080 0.24544 34 ASN A CA 642 C CA B ASN A 34 ? 0.74990 0.90018 0.89302 -0.15624 0.09075 0.24536 34 ASN A CA 643 C C A ASN A 34 ? 0.75417 0.88140 0.88814 -0.13924 0.07521 0.21199 34 ASN A C 644 C C B ASN A 34 ? 0.75406 0.88134 0.88801 -0.13921 0.07527 0.21200 34 ASN A C 645 O O A ASN A 34 ? 0.74503 0.90951 0.92244 -0.14047 0.06775 0.21706 34 ASN A O 646 O O B ASN A 34 ? 0.74502 0.90990 0.92254 -0.14027 0.06804 0.21715 34 ASN A O 647 C CB A ASN A 34 ? 0.74077 0.97636 0.95560 -0.16754 0.10478 0.28256 34 ASN A CB 648 C CB B ASN A 34 ? 0.74099 0.97611 0.95534 -0.16768 0.10481 0.28263 34 ASN A CB 649 C CG A ASN A 34 ? 0.76988 1.02919 1.00303 -0.19619 0.11410 0.32303 34 ASN A CG 650 C CG B ASN A 34 ? 0.77573 1.01763 1.03848 -0.21075 0.06903 0.30100 34 ASN A CG 651 O OD1 A ASN A 34 ? 0.82633 1.02953 1.03602 -0.22363 0.09281 0.32756 34 ASN A OD1 652 O OD1 B ASN A 34 ? 0.83377 1.00920 1.06940 -0.23803 0.03915 0.29244 34 ASN A OD1 653 N ND2 A ASN A 34 ? 0.77660 1.11856 1.05283 -0.18838 0.14811 0.35488 34 ASN A ND2 654 N ND2 B ASN A 34 ? 0.73935 1.06056 1.07309 -0.21656 0.07116 0.32659 34 ASN A ND2 667 N N . VAL A 35 ? 0.70466 0.77479 0.78427 -0.12360 0.07001 0.18181 35 VAL A N 668 C CA . VAL A 35 ? 0.72782 0.76988 0.79220 -0.11015 0.05582 0.15229 35 VAL A CA 669 C C . VAL A 35 ? 0.68079 0.66335 0.72006 -0.12819 0.02820 0.13994 35 VAL A C 670 O O . VAL A 35 ? 0.70064 0.64889 0.71674 -0.13625 0.02586 0.14439 35 VAL A O 671 C CB . VAL A 35 ? 0.65160 0.67937 0.67655 -0.07874 0.07320 0.12892 35 VAL A CB 672 C CG1 . VAL A 35 ? 0.67019 0.65996 0.67462 -0.07127 0.05623 0.10220 35 VAL A CG1 673 C CG2 . VAL A 35 ? 0.73677 0.81138 0.78062 -0.05558 0.10174 0.13415 35 VAL A CG2 684 N N . THR A 36 ? 0.66615 0.63489 0.70764 -0.13267 0.00856 0.12596 36 THR A N 685 C CA . THR A 36 ? 0.63826 0.54695 0.64717 -0.14422 -0.01299 0.10936 36 THR A CA 686 C C . THR A 36 ? 0.71954 0.61301 0.70579 -0.12502 -0.01579 0.08460 36 THR A C 687 O O . THR A 36 ? 0.69987 0.62643 0.70194 -0.11010 -0.00803 0.08339 36 THR A O 688 C CB . THR A 36 ? 0.72434 0.62351 0.74842 -0.17906 -0.03892 0.11903 36 THR A CB 689 O OG1 . THR A 36 ? 0.71831 0.66874 0.77932 -0.18425 -0.04758 0.12788 36 THR A OG1 690 C CG2 . THR A 36 ? 0.78511 0.68970 0.83046 -0.20400 -0.03863 0.14605 36 THR A CG2 698 N N . GLY A 37 ? 0.69814 0.54011 0.64789 -0.12396 -0.02489 0.06669 37 GLY A N 699 C CA . GLY A 37 ? 0.76202 0.59411 0.69146 -0.10809 -0.02540 0.04759 37 GLY A CA 700 C C . GLY A 37 ? 0.79145 0.57406 0.68351 -0.09930 -0.02538 0.03125 37 GLY A C 701 O O . GLY A 37 ? 0.76748 0.51360 0.64660 -0.10494 -0.02787 0.03265 37 GLY A O 705 N N . VAL A 38 ? 0.75928 0.54231 0.63733 -0.08374 -0.02078 0.01842 38 VAL A N 706 C CA A VAL A 38 ? 0.75549 0.50419 0.60418 -0.07035 -0.01601 0.00482 38 VAL A CA 707 C CA B VAL A 38 ? 0.75947 0.50820 0.60788 -0.07043 -0.01615 0.00460 38 VAL A CA 708 C C . VAL A 38 ? 0.79690 0.57101 0.65198 -0.05216 -0.00423 0.00299 38 VAL A C 709 O O . VAL A 38 ? 0.72718 0.52925 0.59588 -0.05253 -0.00386 0.00543 38 VAL A O 710 C CB A VAL A 38 ? 0.86080 0.57769 0.67679 -0.07857 -0.02637 -0.00891 38 VAL A CB 711 C CB B VAL A 38 ? 0.86154 0.58056 0.67757 -0.07789 -0.02604 -0.00914 38 VAL A CB 712 C CG1 A VAL A 38 ? 0.82794 0.57437 0.64541 -0.07861 -0.02931 -0.00923 38 VAL A CG1 713 C CG1 B VAL A 38 ? 0.92816 0.61290 0.71218 -0.05799 -0.01379 -0.02347 38 VAL A CG1 714 C CG2 A VAL A 38 ? 0.92880 0.60198 0.71089 -0.06139 -0.01627 -0.02332 38 VAL A CG2 715 C CG2 B VAL A 38 ? 0.90648 0.59883 0.71512 -0.10397 -0.04468 -0.00762 38 VAL A CG2 734 N N . LEU A 39 ? 0.73807 0.50158 0.58645 -0.03666 0.00430 0.00101 39 LEU A N 735 C CA . LEU A 39 ? 0.68061 0.47127 0.53966 -0.02412 0.01199 0.00274 39 LEU A CA 736 C C . LEU A 39 ? 0.75471 0.53365 0.60100 -0.00862 0.02141 -0.00309 39 LEU A C 737 O O . LEU A 39 ? 0.76052 0.51335 0.59841 0.00365 0.02634 -0.00389 39 LEU A O 738 C CB . LEU A 39 ? 0.68273 0.48907 0.55535 -0.02000 0.01248 0.01319 39 LEU A CB 739 C CG . LEU A 39 ? 0.76969 0.60495 0.65466 -0.01277 0.01400 0.01719 39 LEU A CG 740 C CD1 . LEU A 39 ? 0.71285 0.56381 0.60170 -0.02171 0.01222 0.01226 39 LEU A CD1 741 C CD2 . LEU A 39 ? 0.85440 0.70237 0.74349 -0.01204 0.00897 0.02821 39 LEU A CD2 753 N N . LEU A 40 ? 0.74524 0.54191 0.58980 -0.00716 0.02625 -0.00531 40 LEU A N 754 C CA . LEU A 40 ? 0.72425 0.52019 0.55789 0.00966 0.04109 -0.00822 40 LEU A CA 755 C C . LEU A 40 ? 0.73922 0.58164 0.60423 0.01402 0.04710 0.00492 40 LEU A C 756 O O . LEU A 40 ? 0.71766 0.58082 0.59846 -0.00063 0.03797 0.01045 40 LEU A O 757 C CB . LEU A 40 ? 0.82654 0.60565 0.62519 0.00487 0.04284 -0.01840 40 LEU A CB 758 C CG . LEU A 40 ? 1.01616 0.74798 0.78003 -0.00557 0.03135 -0.03185 40 LEU A CG 759 C CD1 . LEU A 40 ? 1.04353 0.78667 0.80864 -0.02774 0.01371 -0.02835 40 LEU A CD1 760 C CD2 . LEU A 40 ? 1.08271 0.77666 0.79694 0.00683 0.04318 -0.04807 40 LEU A CD2 772 N N . CYS A 41 ? 0.69555 0.55339 0.57122 0.03414 0.06236 0.01083 41 CYS A N 773 C CA . CYS A 41 ? 0.71709 0.62692 0.62706 0.03408 0.06752 0.02707 41 CYS A CA 774 C C . CYS A 41 ? 0.72162 0.64553 0.62593 0.05375 0.09250 0.02971 41 CYS A C 775 O O . CYS A 41 ? 0.76724 0.66030 0.64530 0.07657 0.10814 0.01881 41 CYS A O 776 C CB . CYS A 41 ? 0.73941 0.68071 0.68721 0.03725 0.05921 0.04230 41 CYS A CB 777 S SG . CYS A 41 ? 0.81161 0.75075 0.77189 0.07182 0.07307 0.04987 41 CYS A SG 783 N N . LEU A 42 ? 0.68278 0.64959 0.60831 0.04409 0.09734 0.04427 42 LEU A N 784 C CA . LEU A 42 ? 0.71744 0.70957 0.63980 0.06108 0.12515 0.05184 42 LEU A CA 785 C C . LEU A 42 ? 0.69663 0.75374 0.67019 0.04601 0.12484 0.07916 42 LEU A C 786 O O . LEU A 42 ? 0.67075 0.72805 0.64618 0.01749 0.10871 0.08398 42 LEU A O 787 C CB . LEU A 42 ? 0.73669 0.69241 0.60122 0.05663 0.13141 0.03714 42 LEU A CB 788 C CG . LEU A 42 ? 0.83390 0.80899 0.67703 0.07556 0.16414 0.04216 42 LEU A CG 789 C CD1 . LEU A 42 ? 0.93540 0.90002 0.77001 0.11497 0.19138 0.03321 42 LEU A CD1 790 C CD2 . LEU A 42 ? 0.91722 0.85410 0.69500 0.06434 0.16164 0.02875 42 LEU A CD2 802 N N . ASP A 43 ? 0.70846 0.81947 0.72651 0.06448 0.14135 0.09889 43 ASP A N 803 C CA . ASP A 43 ? 0.76864 0.95166 0.84241 0.04876 0.14310 0.13006 43 ASP A CA 804 C C . ASP A 43 ? 0.76108 0.94226 0.85139 0.00699 0.10772 0.13488 43 ASP A C 805 O O . ASP A 43 ? 0.70791 0.89787 0.80223 -0.01890 0.10340 0.14601 43 ASP A O 806 C CB . ASP A 43 ? 0.87586 1.08022 0.93499 0.05204 0.17199 0.14042 43 ASP A CB 807 C CG . ASP A 43 ? 0.96097 1.25192 1.08792 0.04093 0.18145 0.17926 43 ASP A CG 808 O OD1 . ASP A 43 ? 0.83512 1.18008 1.02082 0.05194 0.18104 0.19770 43 ASP A OD1 809 O OD2 . ASP A 43 ? 0.84990 1.15781 0.97523 0.01889 0.18688 0.19518 43 ASP A OD2 814 N N . GLY A 44 ? 0.65141 0.81465 0.74573 0.00172 0.08321 0.12601 44 GLY A N 815 C CA . GLY A 44 ? 0.66477 0.82395 0.76972 -0.03383 0.05123 0.12785 44 GLY A CA 816 C C . GLY A 44 ? 0.63434 0.73091 0.69401 -0.05038 0.03917 0.10616 44 GLY A C 817 O O . GLY A 44 ? 0.62059 0.70439 0.68247 -0.07806 0.01705 0.10553 44 GLY A O 821 N N . ILE A 45 ? 0.65395 0.71042 0.67269 -0.03415 0.05235 0.08901 45 ILE A N 822 C CA . ILE A 45 ? 0.63150 0.63695 0.61466 -0.04456 0.04175 0.07216 45 ILE A CA 823 C C . ILE A 45 ? 0.65148 0.62261 0.60915 -0.03030 0.03893 0.05286 45 ILE A C 824 O O . ILE A 45 ? 0.63677 0.60428 0.58441 -0.00960 0.05198 0.04839 45 ILE A O 825 C CB . ILE A 45 ? 0.65596 0.65058 0.61538 -0.04446 0.05420 0.07492 45 ILE A CB 826 C CG1 . ILE A 45 ? 0.67767 0.71070 0.66422 -0.05913 0.06085 0.10011 45 ILE A CG1 827 C CG2 . ILE A 45 ? 0.70749 0.65804 0.64117 -0.05346 0.04044 0.06332 45 ILE A CG2 828 C CD1 . ILE A 45 ? 0.81015 0.83519 0.81755 -0.08890 0.03847 0.10771 45 ILE A CD1 840 N N . PHE A 46 ? 0.60970 0.55333 0.55643 -0.04110 0.02346 0.04232 46 PHE A N 841 C CA . PHE A 46 ? 0.62983 0.54358 0.55468 -0.03299 0.02130 0.02827 46 PHE A CA 842 C C . PHE A 46 ? 0.62929 0.51862 0.53401 -0.03612 0.02105 0.02200 46 PHE A C 843 O O . PHE A 46 ? 0.66377 0.54961 0.57136 -0.04621 0.01665 0.02631 46 PHE A O 844 C CB . PHE A 46 ? 0.61077 0.51669 0.53538 -0.04034 0.00855 0.02333 46 PHE A CB 845 C CG . PHE A 46 ? 0.66964 0.59626 0.60643 -0.03619 0.00378 0.03031 46 PHE A CG 846 C CD1 . PHE A 46 ? 0.69832 0.62355 0.63459 -0.01907 0.01072 0.03290 46 PHE A CD1 847 C CD2 . PHE A 46 ? 0.63096 0.57340 0.57666 -0.05081 -0.01073 0.03500 46 PHE A CD2 848 C CE1 . PHE A 46 ? 0.67454 0.61987 0.62481 -0.01297 0.00456 0.04437 46 PHE A CE1 849 C CE2 . PHE A 46 ? 0.71136 0.67811 0.66801 -0.04859 -0.01997 0.04528 46 PHE A CE2 850 C CZ . PHE A 46 ? 0.68404 0.65509 0.64575 -0.02784 -0.01169 0.05206 46 PHE A CZ 860 N N . PHE A 47 ? 0.64100 0.51185 0.52674 -0.02897 0.02299 0.01393 47 PHE A N 861 C CA . PHE A 47 ? 0.67608 0.53025 0.54820 -0.03451 0.01632 0.01051 47 PHE A CA 862 C C . PHE A 47 ? 0.68991 0.53224 0.56218 -0.03489 0.01096 0.00490 47 PHE A C 863 O O . PHE A 47 ? 0.70368 0.53583 0.56885 -0.02949 0.01386 0.00123 47 PHE A O 864 C CB . PHE A 47 ? 0.69623 0.54055 0.54013 -0.03293 0.01939 0.00835 47 PHE A CB 865 C CG . PHE A 47 ? 0.78873 0.64864 0.62664 -0.02867 0.03223 0.01564 47 PHE A CG 866 C CD1 . PHE A 47 ? 0.72732 0.60154 0.57278 -0.01598 0.04718 0.01662 47 PHE A CD1 867 C CD2 . PHE A 47 ? 0.83192 0.69610 0.65813 -0.03585 0.03068 0.02541 47 PHE A CD2 868 C CE1 . PHE A 47 ? 0.73640 0.63505 0.58244 -0.01097 0.06311 0.02729 47 PHE A CE1 869 C CE2 . PHE A 47 ? 0.80938 0.69251 0.62961 -0.03335 0.04548 0.03627 47 PHE A CE2 870 C CZ . PHE A 47 ? 0.73075 0.63381 0.56220 -0.02092 0.06329 0.03704 47 PHE A CZ 880 N N . GLN A 48 ? 0.67654 0.52040 0.55891 -0.03971 0.00510 0.00685 48 GLN A N 881 C CA . GLN A 48 ? 0.68739 0.52926 0.57484 -0.04179 0.00291 0.00670 48 GLN A CA 882 C C . GLN A 48 ? 0.70330 0.55345 0.60240 -0.04725 -0.00403 0.01299 48 GLN A C 883 O O . GLN A 48 ? 0.65886 0.51661 0.56799 -0.04426 -0.00517 0.01792 48 GLN A O 884 C CB . GLN A 48 ? 0.72589 0.57425 0.62055 -0.03825 0.00790 0.00655 48 GLN A CB 885 C CG . GLN A 48 ? 0.70149 0.55252 0.60012 -0.04062 0.00958 0.01109 48 GLN A CG 886 C CD . GLN A 48 ? 0.67908 0.53435 0.57109 -0.03690 0.01499 0.01140 48 GLN A CD 887 O OE1 . GLN A 48 ? 0.71491 0.57167 0.60141 -0.03371 0.01761 0.00578 48 GLN A OE1 888 N NE2 . GLN A 48 ? 0.69699 0.54891 0.58438 -0.03851 0.01514 0.01831 48 GLN A NE2 897 N N . ILE A 49 ? 0.70357 0.55258 0.60478 -0.05608 -0.01014 0.01584 49 ILE A N 898 C CA . ILE A 49 ? 0.67092 0.54105 0.59555 -0.06388 -0.01827 0.02753 49 ILE A CA 899 C C . ILE A 49 ? 0.68354 0.56712 0.62686 -0.06592 -0.01095 0.03475 49 ILE A C 900 O O . ILE A 49 ? 0.67851 0.54421 0.60928 -0.07240 -0.01089 0.03266 49 ILE A O 901 C CB . ILE A 49 ? 0.73772 0.59883 0.64862 -0.08100 -0.03712 0.02860 49 ILE A CB 902 C CG1 . ILE A 49 ? 0.67507 0.52495 0.55880 -0.07828 -0.04172 0.02341 49 ILE A CG1 903 C CG2 . ILE A 49 ? 0.72708 0.62267 0.67318 -0.09209 -0.04962 0.04657 49 ILE A CG2 904 C CD1 . ILE A 49 ? 0.80467 0.62862 0.64910 -0.09360 -0.05729 0.01534 49 ILE A CD1 916 N N . LEU A 50 ? 0.61514 0.52927 0.58771 -0.05824 -0.00262 0.04524 50 LEU A N 917 C CA . LEU A 50 ? 0.61725 0.55378 0.60860 -0.05860 0.00933 0.05611 50 LEU A CA 918 C C . LEU A 50 ? 0.71286 0.69365 0.74906 -0.06286 0.00665 0.07681 50 LEU A C 919 O O . LEU A 50 ? 0.64086 0.63861 0.69649 -0.05105 0.00559 0.08154 50 LEU A O 920 C CB . LEU A 50 ? 0.69803 0.63389 0.67842 -0.03920 0.03001 0.04869 50 LEU A CB 921 C CG . LEU A 50 ? 0.81031 0.71534 0.75396 -0.03604 0.03117 0.03318 50 LEU A CG 922 C CD1 . LEU A 50 ? 0.83059 0.72919 0.75999 -0.02020 0.04398 0.02229 50 LEU A CD1 923 C CD2 . LEU A 50 ? 0.82520 0.72611 0.75689 -0.04400 0.03263 0.03910 50 LEU A CD2 935 N N . GLU A 51 ? 0.66499 0.66778 0.72269 -0.07958 0.00547 0.09327 51 GLU A N 936 C CA . GLU A 51 ? 0.60466 0.66217 0.71600 -0.08775 0.00087 0.11899 51 GLU A CA 937 C C . GLU A 51 ? 0.67880 0.77279 0.81755 -0.09181 0.01965 0.13917 51 GLU A C 938 O O . GLU A 51 ? 0.63688 0.70616 0.75209 -0.10457 0.02188 0.13789 51 GLU A O 939 C CB . GLU A 51 ? 0.76957 0.82305 0.88559 -0.11903 -0.03341 0.12529 51 GLU A CB 940 C CG . GLU A 51 ? 0.74140 0.75353 0.82943 -0.14725 -0.04700 0.11998 51 GLU A CG 941 C CD . GLU A 51 ? 0.85218 0.83497 0.91840 -0.17534 -0.08127 0.11352 51 GLU A CD 942 O OE1 . GLU A 51 ? 0.79767 0.80444 0.87579 -0.17735 -0.09792 0.11884 51 GLU A OE1 943 O OE2 . GLU A 51 ? 0.79111 0.72206 0.82337 -0.19479 -0.09199 0.10303 51 GLU A OE2 950 N N . GLY A 52 ? 0.64605 0.80069 0.83570 -0.07796 0.03546 0.16051 52 GLY A N 951 C CA . GLY A 52 ? 0.65910 0.86235 0.88102 -0.07854 0.05935 0.18474 52 GLY A CA 952 C C . GLY A 52 ? 0.65532 0.91840 0.92476 -0.04561 0.08633 0.19997 52 GLY A C 953 O O . GLY A 52 ? 0.60738 0.87420 0.89220 -0.02735 0.07992 0.19623 52 GLY A O 957 N N A GLU A 53 ? 0.66197 0.97048 0.95283 -0.03600 0.11895 0.21902 53 GLU A N 958 N N B GLU A 53 ? 0.66089 0.97035 0.95285 -0.03616 0.11874 0.21947 53 GLU A N 959 C CA A GLU A 53 ? 0.66321 1.02764 0.99553 0.00324 0.15441 0.23250 53 GLU A CA 960 C CA B GLU A 53 ? 0.66098 1.02741 0.99658 0.00266 0.15293 0.23353 53 GLU A CA 961 C C A GLU A 53 ? 0.72847 1.03740 1.01090 0.04340 0.17035 0.19712 53 GLU A C 962 C C B GLU A 53 ? 0.72731 1.03788 1.01119 0.04328 0.17052 0.19790 53 GLU A C 963 O O A GLU A 53 ? 0.73124 0.97578 0.94227 0.04497 0.17302 0.16655 53 GLU A O 964 O O B GLU A 53 ? 0.72930 0.97690 0.94191 0.04483 0.17429 0.16796 53 GLU A O 965 C CB A GLU A 53 ? 0.70531 1.11821 1.04970 0.00893 0.19331 0.25415 53 GLU A CB 966 C CB B GLU A 53 ? 0.69814 1.12080 1.05475 0.00817 0.19137 0.25858 53 GLU A CB 967 C CG A GLU A 53 ? 0.70490 1.15403 1.08382 -0.03875 0.17647 0.28769 53 GLU A CG 968 C CG B GLU A 53 ? 0.58413 1.08981 1.02310 -0.02585 0.18040 0.30649 53 GLU A CG 969 C CD A GLU A 53 ? 0.73061 1.11325 1.04012 -0.06251 0.16736 0.27186 53 GLU A CD 970 C CD B GLU A 53 ? 0.56959 1.14600 1.09370 -0.01702 0.16958 0.33322 53 GLU A CD 971 O OE1 A GLU A 53 ? 0.62678 0.93891 0.89191 -0.07557 0.13582 0.24432 53 GLU A OE1 972 O OE1 B GLU A 53 ? 0.69791 1.25229 1.22699 -0.03814 0.12572 0.32775 53 GLU A OE1 973 O OE2 A GLU A 53 ? 0.75256 1.15669 1.05362 -0.06637 0.19298 0.29002 53 GLU A OE2 974 O OE2 B GLU A 53 ? 0.64764 1.30458 1.23334 0.01258 0.20561 0.36168 53 GLU A OE2 987 N N . ALA A 54 ? 0.75688 1.09043 1.07984 0.07466 0.17855 0.20389 54 ALA A N 988 C CA . ALA A 54 ? 0.84620 1.11719 1.12438 0.10929 0.18914 0.17200 54 ALA A CA 989 C C . ALA A 54 ? 0.86447 1.09308 1.07525 0.13183 0.22472 0.14421 54 ALA A C 990 O O . ALA A 54 ? 0.81034 0.96367 0.95468 0.13453 0.21808 0.10974 54 ALA A O 991 C CB . ALA A 54 ? 0.88859 1.19800 1.22799 0.14646 0.20082 0.19068 54 ALA A CB 998 N N . GLU A 55 ? 0.93227 1.21101 1.15754 0.14623 0.26200 0.16040 55 GLU A N 999 C CA . GLU A 55 ? 1.03276 1.27252 1.18345 0.16693 0.29636 0.13431 55 GLU A CA 1000 C C . GLU A 55 ? 0.94398 1.12571 1.02207 0.13339 0.27192 0.11201 55 GLU A C 1001 O O . GLU A 55 ? 0.96433 1.08023 0.96723 0.14358 0.27626 0.07750 55 GLU A O 1002 C CB . GLU A 55 ? 1.15587 1.47032 1.33493 0.18162 0.34012 0.16252 55 GLU A CB 1003 C CG . GLU A 55 ? 1.48232 1.85419 1.72512 0.22928 0.37822 0.18137 55 GLU A CG 1004 C CD . GLU A 55 ? 1.60770 2.05255 1.95760 0.21709 0.35251 0.22153 55 GLU A CD 1005 O OE1 . GLU A 55 ? 1.05840 1.52771 1.43681 0.16754 0.31398 0.24164 55 GLU A OE1 1006 O OE2 . GLU A 55 ? 1.80604 2.28079 2.20920 0.25745 0.36955 0.23325 55 GLU A OE2 1013 N N . LYS A 56 ? 0.88367 1.08735 0.98410 0.09305 0.24454 0.13235 56 LYS A N 1014 C CA A LYS A 56 ? 0.91574 1.07037 0.95662 0.06568 0.22305 0.11707 56 LYS A CA 1015 C CA B LYS A 56 ? 0.91605 1.07054 0.95672 0.06579 0.22314 0.11697 56 LYS A CA 1016 C C . LYS A 56 ? 0.91625 1.00772 0.92810 0.05864 0.19071 0.08887 56 LYS A C 1017 O O . LYS A 56 ? 0.82585 0.86711 0.77616 0.05546 0.18392 0.06488 56 LYS A O 1018 C CB A LYS A 56 ? 0.87412 1.06153 0.94841 0.02801 0.20518 0.14764 56 LYS A CB 1019 C CB B LYS A 56 ? 0.87523 1.06243 0.94886 0.02820 0.20548 0.14749 56 LYS A CB 1020 C CG A LYS A 56 ? 0.86932 1.12830 0.98291 0.02730 0.23528 0.18409 56 LYS A CG 1021 C CG B LYS A 56 ? 0.91864 1.14012 0.98079 0.02397 0.23296 0.16985 56 LYS A CG 1022 C CD A LYS A 56 ? 0.93882 1.18899 0.98866 0.04000 0.26718 0.17903 56 LYS A CD 1023 C CD B LYS A 56 ? 0.91448 1.19449 1.00294 0.05704 0.27921 0.18393 56 LYS A CD 1024 C CE A LYS A 56 ? 0.97003 1.28364 1.05167 0.02272 0.28725 0.22214 56 LYS A CE 1025 C CE B LYS A 56 ? 0.95874 1.28978 1.04995 0.04760 0.30763 0.21701 56 LYS A CE 1026 N NZ A LYS A 56 ? 0.92761 1.21308 0.93912 0.01204 0.29300 0.22274 56 LYS A NZ 1027 N NZ B LYS A 56 ? 0.89245 1.25311 1.03550 0.00208 0.28127 0.25371 56 LYS A NZ 1054 N N . ILE A 57 ? 0.82694 0.92544 0.88342 0.05474 0.16985 0.09467 57 ILE A N 1055 C CA . ILE A 57 ? 0.86711 0.91319 0.89969 0.04722 0.14198 0.07320 57 ILE A CA 1056 C C . ILE A 57 ? 0.82629 0.82240 0.81342 0.07186 0.15445 0.04446 57 ILE A C 1057 O O . ILE A 57 ? 0.82578 0.77356 0.76757 0.06152 0.13902 0.02312 57 ILE A O 1058 C CB . ILE A 57 ? 0.80888 0.87668 0.89341 0.04022 0.11999 0.08855 57 ILE A CB 1059 C CG1 . ILE A 57 ? 0.77968 0.88469 0.89895 0.00861 0.10137 0.11280 57 ILE A CG1 1060 C CG2 . ILE A 57 ? 0.87185 0.88962 0.92959 0.03456 0.09639 0.06963 57 ILE A CG2 1061 C CD1 . ILE A 57 ? 0.79683 0.86301 0.87576 -0.01784 0.08321 0.10225 57 ILE A CD1 1073 N N . ASP A 58 ? 0.84961 0.85546 0.85045 0.10469 0.18201 0.04451 58 ASP A N 1074 C CA . ASP A 58 ? 1.01584 0.96000 0.96879 0.12787 0.19305 0.01463 58 ASP A CA 1075 C C . ASP A 58 ? 1.03530 0.93842 0.91129 0.11963 0.19705 -0.01058 58 ASP A C 1076 O O . ASP A 58 ? 1.00112 0.84530 0.83122 0.11163 0.18072 -0.03551 58 ASP A O 1077 C CB . ASP A 58 ? 1.02402 0.98360 1.00248 0.17077 0.22845 0.01939 58 ASP A CB 1078 C CG . ASP A 58 ? 0.91167 0.89299 0.95748 0.18258 0.21722 0.04035 58 ASP A CG 1079 O OD1 . ASP A 58 ? 0.90287 0.89980 0.97670 0.15394 0.18338 0.05458 58 ASP A OD1 1080 O OD2 . ASP A 58 ? 0.99437 0.97680 1.06275 0.22242 0.24286 0.04360 58 ASP A OD2 1085 N N A ARG A 59 ? 0.99392 0.93030 0.85545 0.11850 0.21627 -0.00114 59 ARG A N 1086 N N B ARG A 59 ? 0.99348 0.93054 0.85583 0.11795 0.21579 -0.00069 59 ARG A N 1087 C CA A ARG A 59 ? 1.00055 0.90263 0.78479 0.10960 0.21710 -0.02105 59 ARG A CA 1088 C CA B ARG A 59 ? 1.00011 0.90417 0.78557 0.10971 0.21773 -0.02015 59 ARG A CA 1089 C C A ARG A 59 ? 1.00319 0.88562 0.77379 0.07542 0.17795 -0.02352 59 ARG A C 1090 C C B ARG A 59 ? 1.00321 0.88703 0.77283 0.07550 0.17891 -0.02300 59 ARG A C 1091 O O A ARG A 59 ? 1.04918 0.88387 0.76674 0.06701 0.16272 -0.04703 59 ARG A O 1092 O O B ARG A 59 ? 1.04612 0.88376 0.75911 0.06720 0.16512 -0.04616 59 ARG A O 1093 C CB A ARG A 59 ? 1.08533 1.03373 0.85961 0.11352 0.24534 -0.00268 59 ARG A CB 1094 C CB B ARG A 59 ? 1.08241 1.03479 0.86100 0.11358 0.24603 -0.00064 59 ARG A CB 1095 C CG A ARG A 59 ? 1.18130 1.10352 0.87446 0.09993 0.24161 -0.01522 59 ARG A CG 1096 C CG B ARG A 59 ? 1.06540 1.04742 0.85610 0.15193 0.29305 0.00422 59 ARG A CG 1097 C CD A ARG A 59 ? 1.25703 1.10505 0.87549 0.10173 0.22896 -0.05538 59 ARG A CD 1098 C CD B ARG A 59 ? 1.14775 1.06440 0.86588 0.18305 0.31526 -0.03494 59 ARG A CD 1099 N NE A ARG A 59 ? 1.44798 1.27701 0.98095 0.09503 0.23208 -0.06719 59 ARG A NE 1100 N NE B ARG A 59 ? 1.16731 1.09179 0.92938 0.22359 0.34369 -0.03373 59 ARG A NE 1101 C CZ A ARG A 59 ? 1.54204 1.30773 0.99419 0.09493 0.22436 -0.10271 59 ARG A CZ 1102 C CZ B ARG A 59 ? 1.03813 0.93840 0.84102 0.22971 0.32527 -0.03683 59 ARG A CZ 1103 N NH1 A ARG A 59 ? 1.46215 1.17218 0.90949 0.10040 0.21397 -0.12984 59 ARG A NH1 1104 N NH1 B ARG A 59 ? 1.09660 0.95798 0.89394 0.19866 0.28182 -0.04605 59 ARG A NH1 1105 N NH2 A ARG A 59 ? 1.64691 1.40217 1.01834 0.08621 0.22441 -0.10967 59 ARG A NH2 1106 N NH2 B ARG A 59 ? 1.05746 0.97643 0.90957 0.26984 0.35271 -0.02719 59 ARG A NH2 1133 N N . ILE A 60 ? 0.94195 0.86017 0.76051 0.05546 0.16103 0.00100 60 ILE A N 1134 C CA . ILE A 60 ? 0.94667 0.84800 0.75513 0.02984 0.12944 0.00006 60 ILE A CA 1135 C C . ILE A 60 ? 0.89156 0.75385 0.69488 0.02695 0.10959 -0.01891 60 ILE A C 1136 O O . ILE A 60 ? 0.90483 0.74191 0.67628 0.01366 0.09122 -0.03026 60 ILE A O 1137 C CB . ILE A 60 ? 0.88640 0.82045 0.74290 0.01246 0.11732 0.02592 60 ILE A CB 1138 C CG1 . ILE A 60 ? 0.94346 0.90628 0.79508 0.00586 0.13040 0.04729 60 ILE A CG1 1139 C CG2 . ILE A 60 ? 0.84919 0.76106 0.70323 -0.00504 0.08859 0.02225 60 ILE A CG2 1140 C CD1 . ILE A 60 ? 0.90572 0.91198 0.81473 -0.00243 0.13552 0.07523 60 ILE A CD1 1152 N N . TYR A 61 ? 0.94715 0.80841 0.78527 0.03814 0.11197 -0.01823 61 TYR A N 1153 C CA . TYR A 61 ? 0.87053 0.69502 0.70532 0.03374 0.09446 -0.03103 61 TYR A CA 1154 C C . TYR A 61 ? 0.94855 0.72211 0.72762 0.03609 0.09511 -0.05725 61 TYR A C 1155 O O . TYR A 61 ? 0.87364 0.62228 0.63585 0.01761 0.07319 -0.06584 61 TYR A O 1156 C CB . TYR A 61 ? 0.93597 0.76762 0.81424 0.04836 0.09850 -0.02152 61 TYR A CB 1157 C CG . TYR A 61 ? 0.96236 0.76190 0.84352 0.04099 0.07985 -0.02609 61 TYR A CG 1158 C CD1 . TYR A 61 ? 0.85333 0.65985 0.74141 0.01884 0.05839 -0.01980 61 TYR A CD1 1159 C CD2 . TYR A 61 ? 0.93011 0.69096 0.80699 0.05788 0.08623 -0.03457 61 TYR A CD2 1160 C CE1 . TYR A 61 ? 0.89958 0.68369 0.79092 0.01123 0.04471 -0.01948 61 TYR A CE1 1161 C CE2 . TYR A 61 ? 1.03540 0.76672 0.91623 0.04811 0.06906 -0.03341 61 TYR A CE2 1162 C CZ . TYR A 61 ? 1.02218 0.76980 0.91078 0.02354 0.04884 -0.02456 61 TYR A CZ 1163 O OH . TYR A 61 ? 1.00047 0.72573 0.89316 0.01289 0.03508 -0.01927 61 TYR A OH 1173 N N . GLU A 62 ? 0.98782 0.74565 0.73567 0.05754 0.12016 -0.07005 62 GLU A N 1174 C CA . GLU A 62 ? 1.00768 0.70466 0.68936 0.05795 0.11920 -0.10006 62 GLU A CA 1175 C C . GLU A 62 ? 1.04162 0.73625 0.68075 0.03041 0.09671 -0.10532 62 GLU A C 1176 O O . GLU A 62 ? 1.06718 0.71990 0.67213 0.01244 0.07473 -0.12247 62 GLU A O 1177 C CB . GLU A 62 ? 1.14625 0.82680 0.79245 0.09002 0.15559 -0.11443 62 GLU A CB 1180 N N A ARG A 63 ? 1.03307 0.77388 0.67793 0.02502 0.09940 -0.08703 63 ARG A N 1181 N N B ARG A 63 ? 1.03405 0.77442 0.67735 0.02542 0.10002 -0.08743 63 ARG A N 1182 C CA A ARG A 63 ? 1.06155 0.80704 0.67312 0.00214 0.07682 -0.08507 63 ARG A CA 1183 C CA B ARG A 63 ? 1.06134 0.80708 0.67319 0.00210 0.07678 -0.08493 63 ARG A CA 1184 C C A ARG A 63 ? 0.98676 0.74101 0.63550 -0.01917 0.04625 -0.07524 63 ARG A C 1185 C C B ARG A 63 ? 0.98781 0.73954 0.63614 -0.01896 0.04625 -0.07648 63 ARG A C 1186 O O A ARG A 63 ? 0.97099 0.71497 0.59499 -0.03867 0.02176 -0.08029 63 ARG A O 1187 O O B ARG A 63 ? 0.97409 0.71155 0.59719 -0.03846 0.02179 -0.08345 63 ARG A O 1188 C CB A ARG A 63 ? 1.06341 0.85290 0.67680 0.00432 0.08929 -0.06253 63 ARG A CB 1189 C CB B ARG A 63 ? 1.06078 0.85239 0.67909 0.00252 0.08665 -0.06074 63 ARG A CB 1190 C CG A ARG A 63 ? 1.06823 0.87564 0.67357 -0.01621 0.06410 -0.04701 63 ARG A CG 1191 C CG B ARG A 63 ? 1.14321 0.94533 0.73179 0.02244 0.12151 -0.06050 63 ARG A CG 1192 C CD A ARG A 63 ? 1.11139 0.89150 0.64869 -0.02950 0.04534 -0.06410 63 ARG A CD 1193 C CD B ARG A 63 ? 1.19232 1.02185 0.75204 0.01235 0.12086 -0.04088 63 ARG A CD 1194 N NE A ARG A 63 ? 1.11732 0.89385 0.67464 -0.04973 0.01148 -0.06403 63 ARG A NE 1195 N NE B ARG A 63 ? 1.13133 0.99018 0.74231 -0.00323 0.10129 -0.01317 63 ARG A NE 1196 C CZ A ARG A 63 ? 1.15278 0.90243 0.66733 -0.06802 -0.01290 -0.08076 63 ARG A CZ 1197 C CZ B ARG A 63 ? 1.00227 0.89071 0.67290 -0.00177 0.10996 0.00848 63 ARG A CZ 1198 N NH1 A ARG A 63 ? 1.28342 0.99550 0.72032 -0.06865 -0.00893 -0.10467 63 ARG A NH1 1199 N NH1 B ARG A 63 ? 1.09864 1.00752 0.79414 0.01311 0.13767 0.01323 63 ARG A NH1 1200 N NH2 A ARG A 63 ? 1.15901 0.92012 0.70767 -0.08723 -0.04188 -0.07299 63 ARG A NH2 1201 N NH2 B ARG A 63 ? 1.02155 0.91878 0.72768 -0.01542 0.08977 0.02616 63 ARG A NH2 1228 N N . ILE A 64 ? 0.87934 0.65607 0.58666 -0.01596 0.04735 -0.05988 64 ILE A N 1229 C CA . ILE A 64 ? 0.83320 0.61870 0.57254 -0.03132 0.02527 -0.05120 64 ILE A CA 1230 C C . ILE A 64 ? 0.92416 0.67388 0.65292 -0.04176 0.01181 -0.06611 64 ILE A C 1231 O O . ILE A 64 ? 0.85552 0.61224 0.59325 -0.06038 -0.00928 -0.06113 64 ILE A O 1232 C CB . ILE A 64 ? 0.83634 0.64590 0.62652 -0.02528 0.03084 -0.03518 64 ILE A CB 1233 C CG1 . ILE A 64 ? 0.90491 0.74365 0.70694 -0.02476 0.03523 -0.01804 64 ILE A CG1 1234 C CG2 . ILE A 64 ? 0.85900 0.67030 0.67407 -0.03603 0.01514 -0.03046 64 ILE A CG2 1235 C CD1 . ILE A 64 ? 0.82585 0.68139 0.66658 -0.02044 0.04233 -0.00593 64 ILE A CD1 1249 N N . LEU A 65 ? 0.88893 0.60026 0.60249 -0.02965 0.02428 -0.08181 65 LEU A N 1250 C CA . LEU A 65 ? 0.96401 0.62884 0.66453 -0.04186 0.01057 -0.09528 65 LEU A CA 1251 C C . LEU A 65 ? 1.07439 0.71380 0.72468 -0.06491 -0.01050 -0.11079 65 LEU A C 1252 O O . LEU A 65 ? 1.04120 0.65565 0.69033 -0.08806 -0.03218 -0.11455 65 LEU A O 1253 C CB . LEU A 65 ? 1.06410 0.68209 0.75339 -0.01930 0.02987 -0.10958 65 LEU A CB 1254 C CG . LEU A 65 ? 1.11344 0.75632 0.85543 0.00208 0.04552 -0.09152 65 LEU A CG 1255 C CD1 . LEU A 65 ? 1.14574 0.74747 0.87745 0.03139 0.06761 -0.10333 65 LEU A CD1 1256 C CD2 . LEU A 65 ? 1.11631 0.76867 0.89689 -0.01371 0.02805 -0.07470 65 LEU A CD2 1268 N N . ALA A 66 ? 1.00392 0.65002 0.61103 -0.06184 -0.00633 -0.11770 66 ALA A N 1269 C CA . ALA A 66 ? 1.01467 0.63824 0.56480 -0.08539 -0.03005 -0.13207 66 ALA A CA 1270 C C . ALA A 66 ? 1.00536 0.68225 0.58129 -0.10808 -0.05766 -0.10880 66 ALA A C 1271 O O . ALA A 66 ? 1.04150 0.71004 0.57995 -0.13306 -0.08532 -0.11485 66 ALA A O 1272 C CB . ALA A 66 ? 1.15054 0.75523 0.63121 -0.07022 -0.01164 -0.14947 66 ALA A CB 1278 N N . ASP A 67 ? 0.90554 0.63471 0.54283 -0.09946 -0.05183 -0.08247 67 ASP A N 1279 C CA . ASP A 67 ? 0.91415 0.69425 0.58056 -0.11159 -0.07196 -0.05828 67 ASP A CA 1280 C C . ASP A 67 ? 0.95481 0.74259 0.64759 -0.13795 -0.09878 -0.05257 67 ASP A C 1281 O O . ASP A 67 ? 0.89646 0.67964 0.62604 -0.13894 -0.09361 -0.04973 67 ASP A O 1282 C CB . ASP A 67 ? 0.82244 0.64097 0.54087 -0.09253 -0.05535 -0.03653 67 ASP A CB 1283 C CG . ASP A 67 ? 0.84302 0.70520 0.57923 -0.09353 -0.06798 -0.01228 67 ASP A CG 1284 O OD1 . ASP A 67 ? 0.82645 0.71453 0.58508 -0.10812 -0.09013 -0.00042 67 ASP A OD1 1285 O OD2 . ASP A 67 ? 0.84320 0.71555 0.57615 -0.07937 -0.05565 -0.00167 67 ASP A OD2 1290 N N A GLU A 68 ? 0.97632 0.78098 0.65224 -0.16134 -0.12876 -0.04696 68 GLU A N 1291 N N B GLU A 68 ? 0.97794 0.78282 0.65380 -0.16126 -0.12874 -0.04687 68 GLU A N 1292 C CA A GLU A 68 ? 1.02655 0.84572 0.73175 -0.19221 -0.15736 -0.03791 68 GLU A CA 1293 C CA B GLU A 68 ? 1.02676 0.84756 0.73185 -0.19229 -0.15793 -0.03732 68 GLU A CA 1294 C C A GLU A 68 ? 0.92897 0.81198 0.71466 -0.18614 -0.15372 -0.00610 68 GLU A C 1295 C C B GLU A 68 ? 0.93046 0.81242 0.71618 -0.18581 -0.15305 -0.00649 68 GLU A C 1296 O O A GLU A 68 ? 0.94209 0.84755 0.76479 -0.20986 -0.17129 0.00692 68 GLU A O 1297 O O B GLU A 68 ? 0.94061 0.84182 0.76283 -0.20897 -0.16914 0.00541 68 GLU A O 1298 C CB A GLU A 68 ? 1.10115 0.92902 0.76841 -0.22182 -0.19523 -0.03731 68 GLU A CB 1299 C CB B GLU A 68 ? 1.10058 0.93727 0.77285 -0.22002 -0.19528 -0.03342 68 GLU A CB 1300 C CG A GLU A 68 ? 1.16064 1.05533 0.85111 -0.21360 -0.20536 -0.00723 68 GLU A CG 1301 C CG B GLU A 68 ? 1.15750 1.05495 0.84807 -0.20610 -0.19942 -0.00561 68 GLU A CG 1302 C CD A GLU A 68 ? 1.28020 1.16764 0.90179 -0.23165 -0.23375 -0.01290 68 GLU A CD 1303 C CD B GLU A 68 ? 1.13691 1.10534 0.88875 -0.22431 -0.22945 0.02846 68 GLU A CD 1304 O OE1 A GLU A 68 ? 1.31262 1.13477 0.85417 -0.24029 -0.23376 -0.04671 68 GLU A OE1 1305 O OE1 B GLU A 68 ? 1.08630 1.07865 0.89789 -0.23217 -0.22870 0.04032 68 GLU A OE1 1306 O OE2 A GLU A 68 ? 1.35324 1.29932 0.99781 -0.23513 -0.25546 0.01719 68 GLU A OE2 1307 O OE2 B GLU A 68 ? 1.16430 1.16956 0.90686 -0.22974 -0.25304 0.04692 68 GLU A OE2 1320 N N . ARG A 69 ? 0.85434 0.76406 0.66620 -0.15577 -0.13013 0.00655 69 ARG A N 1321 C CA . ARG A 69 ? 0.78220 0.74578 0.65974 -0.14532 -0.12350 0.03323 69 ARG A CA 1322 C C . ARG A 69 ? 0.81604 0.76971 0.72123 -0.13904 -0.10325 0.03154 69 ARG A C 1323 O O . ARG A 69 ? 0.72176 0.71716 0.67437 -0.13028 -0.09437 0.05142 69 ARG A O 1324 C CB . ARG A 69 ? 0.79473 0.78008 0.68185 -0.11661 -0.10931 0.04643 69 ARG A CB 1325 C CG . ARG A 69 ? 0.96675 0.97451 0.83589 -0.12210 -0.13170 0.05908 69 ARG A CG 1326 C CD . ARG A 69 ? 0.87361 0.88710 0.74377 -0.09485 -0.11720 0.07198 69 ARG A CD 1327 N NE . ARG A 69 ? 0.87247 0.84136 0.69152 -0.08913 -0.10192 0.05304 69 ARG A NE 1328 C CZ . ARG A 69 ? 0.88654 0.85127 0.69223 -0.07375 -0.09193 0.06310 69 ARG A CZ 1329 N NH1 . ARG A 69 ? 0.85588 0.84872 0.68845 -0.06127 -0.09799 0.09039 69 ARG A NH1 1330 N NH2 . ARG A 69 ? 0.84821 0.78077 0.61596 -0.07009 -0.07461 0.04842 69 ARG A NH2 1344 N N . HIS A 70 ? 0.80055 0.70169 0.67651 -0.14069 -0.09441 0.01038 70 HIS A N 1345 C CA . HIS A 70 ? 0.74456 0.63793 0.64480 -0.13803 -0.08015 0.01358 70 HIS A CA 1346 C C . HIS A 70 ? 0.82673 0.66363 0.69937 -0.15501 -0.08725 -0.00350 70 HIS A C 1347 O O . HIS A 70 ? 0.78724 0.58433 0.61543 -0.16362 -0.09819 -0.02333 70 HIS A O 1348 C CB . HIS A 70 ? 0.65932 0.55108 0.56371 -0.10905 -0.05446 0.01267 70 HIS A CB 1349 C CG . HIS A 70 ? 0.69858 0.55273 0.56787 -0.09555 -0.04427 -0.00557 70 HIS A CG 1350 N ND1 . HIS A 70 ? 0.68984 0.53910 0.56402 -0.07703 -0.02647 -0.00614 70 HIS A ND1 1351 C CD2 . HIS A 70 ? 0.75249 0.57690 0.58207 -0.09765 -0.04808 -0.02208 70 HIS A CD2 1352 C CE1 . HIS A 70 ? 0.78068 0.60677 0.63001 -0.06830 -0.01918 -0.01842 70 HIS A CE1 1353 N NE2 . HIS A 70 ? 0.77553 0.58482 0.59492 -0.07804 -0.02902 -0.02925 70 HIS A NE2 1361 N N . THR A 71 ? 0.73339 0.56381 0.62918 -0.15991 -0.08102 0.00536 71 THR A N 1362 C CA . THR A 71 ? 0.77574 0.54914 0.65364 -0.17733 -0.08908 -0.00452 71 THR A CA 1363 C C . THR A 71 ? 0.75598 0.52423 0.65528 -0.16616 -0.07193 0.00778 71 THR A C 1364 O O . THR A 71 ? 0.72231 0.52946 0.64229 -0.14742 -0.05569 0.01983 71 THR A O 1365 C CB . THR A 71 ? 0.89172 0.66963 0.77979 -0.21747 -0.11759 0.00403 71 THR A CB 1366 O OG1 . THR A 71 ? 0.96428 0.66608 0.82147 -0.23565 -0.12810 -0.01170 71 THR A OG1 1367 C CG2 . THR A 71 ? 0.81822 0.65996 0.76601 -0.22920 -0.11599 0.03795 71 THR A CG2 1375 N N . ASP A 72 ? 0.82088 0.53504 0.70971 -0.17795 -0.07692 0.00461 72 ASP A N 1376 C CA . ASP A 72 ? 0.86869 0.57143 0.77221 -0.16764 -0.06376 0.01897 72 ASP A CA 1377 C C . ASP A 72 ? 0.80869 0.52735 0.70996 -0.13302 -0.04375 0.01570 72 ASP A C 1378 O O . ASP A 72 ? 0.73936 0.49456 0.65919 -0.12459 -0.03359 0.03248 72 ASP A O 1379 C CB . ASP A 72 ? 0.88521 0.63528 0.82748 -0.18637 -0.06428 0.05028 72 ASP A CB 1380 C CG . ASP A 72 ? 1.05203 0.79368 1.00698 -0.22690 -0.08657 0.06020 72 ASP A CG 1381 O OD1 . ASP A 72 ? 1.31746 0.99740 1.24212 -0.24201 -0.10381 0.03974 72 ASP A OD1 1382 O OD2 . ASP A 72 ? 1.17095 0.96693 1.16497 -0.24458 -0.08641 0.08894 72 ASP A OD2 1387 N N A ILE A 73 ? 0.81232 0.50402 0.68771 -0.11482 -0.03851 -0.00614 73 ILE A N 1388 N N B ILE A 73 ? 0.81252 0.50308 0.68808 -0.11452 -0.03829 -0.00589 73 ILE A N 1389 C CA A ILE A 73 ? 0.76034 0.46835 0.63850 -0.08683 -0.02254 -0.00709 73 ILE A CA 1390 C CA B ILE A 73 ? 0.75847 0.46863 0.63701 -0.08679 -0.02245 -0.00694 73 ILE A CA 1391 C C A ILE A 73 ? 0.79619 0.48035 0.68360 -0.07483 -0.01701 0.00337 73 ILE A C 1392 C C B ILE A 73 ? 0.79564 0.48043 0.68165 -0.07231 -0.01583 0.00136 73 ILE A C 1393 O O A ILE A 73 ? 0.80385 0.43547 0.68156 -0.07552 -0.01985 -0.00096 73 ILE A O 1394 O O B ILE A 73 ? 0.80177 0.43414 0.67516 -0.06770 -0.01602 -0.00694 73 ILE A O 1395 C CB A ILE A 73 ? 0.82344 0.51768 0.67583 -0.07199 -0.01581 -0.02832 73 ILE A CB 1396 C CB B ILE A 73 ? 0.82279 0.52507 0.67651 -0.07371 -0.01669 -0.02736 73 ILE A CB 1397 C CG1 A ILE A 73 ? 0.80737 0.53737 0.65412 -0.07957 -0.02096 -0.03076 73 ILE A CG1 1398 C CG1 B ILE A 73 ? 0.81764 0.54437 0.66213 -0.08897 -0.02752 -0.03109 73 ILE A CG1 1399 C CG2 A ILE A 73 ? 0.78336 0.48834 0.64595 -0.04562 0.00013 -0.02558 73 ILE A CG2 1400 C CG2 B ILE A 73 ? 0.78461 0.51397 0.64977 -0.05098 -0.00215 -0.02327 73 ILE A CG2 1401 C CD1 A ILE A 73 ? 0.84536 0.57020 0.68255 -0.10619 -0.04049 -0.03325 73 ILE A CD1 1402 C CD1 B ILE A 73 ? 0.85408 0.56574 0.66188 -0.08170 -0.02474 -0.05014 73 ILE A CD1 1425 N N . LEU A 74 ? 0.78973 0.50809 0.69313 -0.06404 -0.01100 0.01787 74 LEU A N 1426 C CA . LEU A 74 ? 0.74568 0.45135 0.65939 -0.05094 -0.00895 0.03220 74 LEU A CA 1427 C C . LEU A 74 ? 0.70932 0.44903 0.63222 -0.03358 -0.00347 0.03489 74 LEU A C 1428 O O . LEU A 74 ? 0.67615 0.45079 0.59840 -0.03896 -0.00444 0.03856 74 LEU A O 1429 C CB . LEU A 74 ? 0.75348 0.46583 0.67478 -0.06551 -0.01454 0.05629 74 LEU A CB 1430 C CG . LEU A 74 ? 0.78483 0.48653 0.71469 -0.05272 -0.01618 0.07661 74 LEU A CG 1431 C CD1 . LEU A 74 ? 0.89028 0.53327 0.82205 -0.04120 -0.01630 0.07335 74 LEU A CD1 1432 C CD2 . LEU A 74 ? 0.84754 0.56428 0.77670 -0.06844 -0.02001 0.10326 74 LEU A CD2 1445 N N . CYS A 75 ? 0.74349 0.47181 0.67590 -0.01288 0.00243 0.03388 75 CYS A N 1446 C CA . CYS A 75 ? 0.71231 0.47875 0.66324 -0.00032 0.00426 0.04253 75 CYS A CA 1447 C C . CYS A 75 ? 0.70839 0.48915 0.67117 -0.00192 -0.00710 0.06738 75 CYS A C 1448 O O . CYS A 75 ? 0.72432 0.48132 0.69665 0.00704 -0.00944 0.08155 75 CYS A O 1449 C CB . CYS A 75 ? 0.78426 0.54482 0.74912 0.02456 0.01758 0.03748 75 CYS A CB 1450 S SG . CYS A 75 ? 0.80094 0.62143 0.80397 0.03607 0.01762 0.05608 75 CYS A SG 1456 N N . LEU A 76 ? 0.72071 0.53471 0.67742 -0.01333 -0.01503 0.07273 76 LEU A N 1457 C CA . LEU A 76 ? 0.65329 0.48141 0.60758 -0.01842 -0.02830 0.09477 76 LEU A CA 1458 C C . LEU A 76 ? 0.71635 0.57417 0.69691 -0.00861 -0.03841 0.11056 76 LEU A C 1459 O O . LEU A 76 ? 0.73188 0.59812 0.71827 -0.00711 -0.05181 0.13465 76 LEU A O 1460 C CB . LEU A 76 ? 0.74168 0.58365 0.66477 -0.03558 -0.03167 0.08972 76 LEU A CB 1461 C CG . LEU A 76 ? 0.85440 0.68494 0.75902 -0.04541 -0.02178 0.08206 76 LEU A CG 1462 C CD1 . LEU A 76 ? 0.88311 0.72881 0.75909 -0.05280 -0.01932 0.07420 76 LEU A CD1 1463 C CD2 . LEU A 76 ? 0.86867 0.68444 0.77222 -0.05065 -0.02285 0.10195 76 LEU A CD2 1475 N N . LYS A 77 ? 0.61770 0.49689 0.61693 -0.00354 -0.03356 0.10175 77 LYS A N 1476 C CA . LYS A 77 ? 0.60531 0.52582 0.63810 0.00058 -0.04511 0.12066 77 LYS A CA 1477 C C . LYS A 77 ? 0.70050 0.63952 0.76361 0.01371 -0.02892 0.11391 77 LYS A C 1478 O O . LYS A 77 ? 0.66233 0.59350 0.70803 0.00626 -0.01855 0.09385 77 LYS A O 1479 C CB . LYS A 77 ? 0.69238 0.63307 0.70279 -0.02446 -0.06602 0.12272 77 LYS A CB 1480 C CG . LYS A 77 ? 0.80992 0.78924 0.84390 -0.02890 -0.09105 0.15105 77 LYS A CG 1481 C CD . LYS A 77 ? 0.83389 0.82420 0.83723 -0.05829 -0.11383 0.14622 77 LYS A CD 1482 C CE . LYS A 77 ? 1.31517 1.35686 1.35807 -0.06775 -0.14085 0.17322 77 LYS A CE 1483 N NZ . LYS A 77 ? 1.34952 1.39094 1.34679 -0.09917 -0.17321 0.17354 77 LYS A NZ 1497 N N . SER A 78 ? 0.65316 0.61955 0.76255 0.03546 -0.02512 0.13380 78 SER A N 1498 C CA . SER A 78 ? 0.76446 0.75972 0.90793 0.05175 -0.00529 0.13347 78 SER A CA 1499 C C . SER A 78 ? 0.75867 0.82115 0.95821 0.05124 -0.02009 0.16591 78 SER A C 1500 O O . SER A 78 ? 0.69436 0.77581 0.93151 0.07214 -0.02437 0.19096 78 SER A O 1501 C CB . SER A 78 ? 0.76729 0.72942 0.91505 0.08640 0.02191 0.12494 78 SER A CB 1502 O OG . SER A 78 ? 0.93120 0.92237 1.10371 0.10480 0.04680 0.12336 78 SER A OG 1508 N N . GLU A 79 ? 0.57576 0.67390 0.78351 0.02605 -0.03026 0.16830 79 GLU A N 1509 C CA . GLU A 79 ? 0.58933 0.75668 0.85260 0.01557 -0.05012 0.20064 79 GLU A CA 1510 C C . GLU A 79 ? 0.64720 0.86477 0.96435 0.03180 -0.02417 0.21245 79 GLU A C 1511 O O . GLU A 79 ? 0.56140 0.76673 0.85844 0.02474 -0.00590 0.19454 79 GLU A O 1512 C CB . GLU A 79 ? 0.70157 0.87089 0.93681 -0.02889 -0.08220 0.19726 79 GLU A CB 1513 C CG . GLU A 79 ? 0.65052 0.76678 0.81948 -0.04359 -0.09962 0.18013 79 GLU A CG 1514 C CD . GLU A 79 ? 0.76314 0.86263 0.88898 -0.08201 -0.12276 0.16648 79 GLU A CD 1515 O OE1 . GLU A 79 ? 0.79521 0.92732 0.93451 -0.10693 -0.15451 0.18450 79 GLU A OE1 1516 O OE2 . GLU A 79 ? 0.73598 0.78699 0.81321 -0.08693 -0.11045 0.13795 79 GLU A OE2 1523 N N . VAL A 80 ? 0.60363 0.88140 0.99038 0.05514 -0.02131 0.24588 80 VAL A N 1524 C CA . VAL A 80 ? 0.62189 0.96485 1.07132 0.07257 0.00538 0.26533 80 VAL A CA 1525 C C . VAL A 80 ? 0.66066 1.09220 1.18111 0.04803 -0.02623 0.30786 80 VAL A C 1526 O O . VAL A 80 ? 0.75139 1.19180 1.27443 0.02982 -0.06571 0.32350 80 VAL A O 1527 C CB . VAL A 80 ? 0.73892 1.07902 1.21485 0.13021 0.04507 0.26821 80 VAL A CB 1528 C CG1 . VAL A 80 ? 0.70161 0.94270 1.09915 0.14543 0.06370 0.22560 80 VAL A CG1 1529 C CG2 . VAL A 80 ? 0.64119 1.01791 1.17464 0.15380 0.02923 0.30396 80 VAL A CG2 1539 N N . GLU A 81 ? 0.71711 1.21683 1.29343 0.04392 -0.01041 0.32854 81 GLU A N 1540 C CA . GLU A 81 ? 0.73403 1.32423 1.38345 0.01163 -0.04322 0.37134 81 GLU A CA 1541 C C . GLU A 81 ? 0.80053 1.35676 1.39890 -0.05017 -0.09050 0.35832 81 GLU A C 1542 O O . GLU A 81 ? 0.84955 1.44445 1.47304 -0.08207 -0.13606 0.38294 81 GLU A O 1543 C CB . GLU A 81 ? 0.84084 1.49004 1.55750 0.03588 -0.06085 0.41049 81 GLU A CB 1544 C CG . GLU A 81 ? 0.88711 1.66021 1.71246 0.02192 -0.07796 0.46586 81 GLU A CG 1545 C CD . GLU A 81 ? 1.09430 1.93118 1.99568 0.06015 -0.08645 0.50845 81 GLU A CD 1546 O OE1 . GLU A 81 ? 1.24845 2.04729 2.11453 0.05630 -0.12067 0.50700 81 GLU A OE1 1547 O OE2 . GLU A 81 ? 0.88227 1.80457 1.87439 0.09508 -0.05700 0.54425 81 GLU A OE2 1554 N N . VAL A 82 ? 0.63633 1.11648 1.15893 -0.06588 -0.08046 0.31902 82 VAL A N 1555 C CA . VAL A 82 ? 0.80900 1.24679 1.27935 -0.11876 -0.11759 0.30313 82 VAL A CA 1556 C C . VAL A 82 ? 0.85091 1.34436 1.37198 -0.15632 -0.12682 0.32890 82 VAL A C 1557 O O . VAL A 82 ? 0.76776 1.29874 1.32800 -0.14108 -0.09043 0.34107 82 VAL A O 1558 C CB . VAL A 82 ? 0.80870 1.14880 1.18798 -0.11601 -0.10136 0.25620 82 VAL A CB 1559 C CG1 . VAL A 82 ? 0.86816 1.16025 1.19545 -0.16416 -0.13274 0.23946 82 VAL A CG1 1560 C CG2 . VAL A 82 ? 0.76167 1.05147 1.09539 -0.08752 -0.09721 0.23561 82 VAL A CG2 1570 N N . GLN A 83 ? 0.85893 1.35513 1.37499 -0.20806 -0.17607 0.33774 83 GLN A N 1571 C CA . GLN A 83 ? 0.88144 1.43406 1.45362 -0.25313 -0.19478 0.36866 83 GLN A CA 1572 C C . GLN A 83 ? 0.95685 1.42874 1.45975 -0.30343 -0.21990 0.34228 83 GLN A C 1573 O O . GLN A 83 ? 0.91088 1.41308 1.45038 -0.35115 -0.24410 0.36603 83 GLN A O 1574 C CB . GLN A 83 ? 0.81900 1.46246 1.46629 -0.27630 -0.23797 0.41333 83 GLN A CB 1575 C CG . GLN A 83 ? 1.12491 1.72353 1.71253 -0.31953 -0.29867 0.40052 83 GLN A CG 1576 C CD . GLN A 83 ? 1.27654 1.79993 1.78070 -0.28827 -0.29523 0.36493 83 GLN A CD 1577 O OE1 . GLN A 83 ? 1.06225 1.52065 1.51494 -0.25423 -0.25549 0.33072 83 GLN A OE1 1578 N NE2 . GLN A 83 ? 1.31435 1.85007 1.80526 -0.30260 -0.33885 0.37614 83 GLN A NE2 1587 N N . GLU A 84 ? 1.02901 1.39881 1.43627 -0.29374 -0.21410 0.29592 84 GLU A N 1588 C CA . GLU A 84 ? 0.97766 1.26108 1.31422 -0.33421 -0.23658 0.26856 84 GLU A CA 1589 C C . GLU A 84 ? 1.02321 1.21693 1.27839 -0.30237 -0.20735 0.22454 84 GLU A C 1590 O O . GLU A 84 ? 0.96593 1.13948 1.18712 -0.27177 -0.19994 0.20638 84 GLU A O 1591 C CB . GLU A 84 ? 1.24905 1.51201 1.55198 -0.37737 -0.29337 0.26511 84 GLU A CB 1592 C CG . GLU A 84 ? 1.51339 1.66747 1.72454 -0.41327 -0.31658 0.22814 84 GLU A CG 1593 C CD . GLU A 84 ? 1.80194 1.91572 1.94570 -0.43658 -0.36104 0.20974 84 GLU A CD 1594 O OE1 . GLU A 84 ? 1.89674 1.92758 1.96943 -0.47417 -0.38851 0.18357 84 GLU A OE1 1595 O OE2 . GLU A 84 ? 1.59558 1.75606 1.75261 -0.41670 -0.36822 0.22164 84 GLU A OE2 1602 N N . ARG A 85 ? 0.91568 1.06003 1.14466 -0.31061 -0.19190 0.21205 85 ARG A N 1603 C CA . ARG A 85 ? 0.85228 0.92160 1.01420 -0.28116 -0.16555 0.17605 85 ARG A CA 1604 C C . ARG A 85 ? 0.85281 0.83907 0.93368 -0.29317 -0.18949 0.14189 85 ARG A C 1605 O O . ARG A 85 ? 0.90095 0.85619 0.95926 -0.33404 -0.22514 0.13936 85 ARG A O 1606 C CB . ARG A 85 ? 0.84844 0.89285 1.00864 -0.28578 -0.14455 0.17854 85 ARG A CB 1607 C CG . ARG A 85 ? 0.86349 0.96513 1.06768 -0.25431 -0.10381 0.19660 85 ARG A CG 1608 C CD . ARG A 85 ? 0.81672 0.89547 1.01437 -0.26430 -0.08753 0.20452 85 ARG A CD 1609 N NE . ARG A 85 ? 0.79276 0.94789 1.04644 -0.25141 -0.05642 0.23545 85 ARG A NE 1610 C CZ . ARG A 85 ? 0.75962 0.92656 1.00219 -0.21140 -0.01900 0.22855 85 ARG A CZ 1611 N NH1 . ARG A 85 ? 0.73416 0.84629 0.91961 -0.18400 -0.01093 0.19503 85 ARG A NH1 1612 N NH2 . ARG A 85 ? 0.73121 0.96784 1.01974 -0.19970 0.01112 0.25647 85 ARG A NH2 1626 N N A MET A 86 ? 0.86302 0.81339 0.89839 -0.25784 -0.16894 0.11579 86 MET A N 1627 N N B MET A 86 ? 0.86428 0.81279 0.89835 -0.25825 -0.16906 0.11526 86 MET A N 1628 C CA A MET A 86 ? 0.90339 0.77782 0.85945 -0.25971 -0.18001 0.08287 86 MET A CA 1629 C CA B MET A 86 ? 0.90424 0.77752 0.85934 -0.26169 -0.18178 0.08285 86 MET A CA 1630 C C A MET A 86 ? 0.95099 0.75026 0.86446 -0.26356 -0.17114 0.06276 86 MET A C 1631 C C B MET A 86 ? 0.95336 0.75032 0.86220 -0.25880 -0.16838 0.06001 86 MET A C 1632 O O A MET A 86 ? 1.00466 0.73589 0.86134 -0.28409 -0.19106 0.04217 86 MET A O 1633 O O B MET A 86 ? 1.04130 0.76786 0.88561 -0.26930 -0.18190 0.03475 86 MET A O 1634 C CB A MET A 86 ? 0.89848 0.77385 0.83330 -0.22112 -0.15860 0.06952 86 MET A CB 1635 C CB B MET A 86 ? 0.89509 0.77315 0.82803 -0.22743 -0.16689 0.07111 86 MET A CB 1636 C CG A MET A 86 ? 0.97790 0.83306 0.86282 -0.22568 -0.17838 0.05721 86 MET A CG 1637 C CG B MET A 86 ? 0.90207 0.82771 0.85299 -0.23375 -0.19018 0.08832 86 MET A CG 1638 S SD A MET A 86 ? 0.92737 0.79878 0.80837 -0.18375 -0.15121 0.05406 86 MET A SD 1639 S SD B MET A 86 ? 0.95748 0.85531 0.84735 -0.21128 -0.18620 0.07019 86 MET A SD 1640 C CE A MET A 86 ? 0.97106 0.90655 0.89102 -0.19046 -0.17686 0.08453 86 MET A CE 1641 C CE B MET A 86 ? 1.07190 0.87799 0.86644 -0.22775 -0.19443 0.03278 86 MET A CE 1660 N N . PHE A 87 ? 0.94868 0.75588 0.88528 -0.24292 -0.14189 0.06888 87 PHE A N 1661 C CA . PHE A 87 ? 0.98798 0.72894 0.88960 -0.23743 -0.12986 0.05471 87 PHE A CA 1662 C C . PHE A 87 ? 0.98380 0.74376 0.92779 -0.25299 -0.12418 0.08117 87 PHE A C 1663 O O . PHE A 87 ? 0.84917 0.61754 0.80254 -0.23045 -0.09841 0.08726 87 PHE A O 1664 C CB . PHE A 87 ? 1.00498 0.73672 0.88603 -0.19545 -0.10068 0.03887 87 PHE A CB 1665 C CG . PHE A 87 ? 0.93766 0.67035 0.79020 -0.17916 -0.10075 0.02176 87 PHE A CG 1666 C CD1 . PHE A 87 ? 1.06353 0.73825 0.85638 -0.18324 -0.11130 -0.00198 87 PHE A CD1 1667 C CD2 . PHE A 87 ? 0.89481 0.68159 0.77590 -0.15949 -0.08870 0.02996 87 PHE A CD2 1668 C CE1 . PHE A 87 ? 1.05858 0.73852 0.82280 -0.16902 -0.10867 -0.01354 87 PHE A CE1 1669 C CE2 . PHE A 87 ? 0.92424 0.71079 0.78059 -0.14722 -0.08897 0.01944 87 PHE A CE2 1670 C CZ . PHE A 87 ? 0.97902 0.71673 0.77793 -0.15269 -0.09853 -0.00043 87 PHE A CZ 1681 N N . PRO A 88 ? 0.91587 0.68489 0.88494 -0.29466 -0.14955 0.09996 88 PRO A N 1682 C CA . PRO A 88 ? 0.99037 0.79286 1.00900 -0.31215 -0.14177 0.13317 88 PRO A CA 1683 C C . PRO A 88 ? 1.04952 0.78707 1.03988 -0.30799 -0.12910 0.13113 88 PRO A C 1684 O O . PRO A 88 ? 1.01421 0.78641 1.03900 -0.30864 -0.11151 0.15902 88 PRO A O 1685 C CB . PRO A 88 ? 0.98656 0.80295 1.03311 -0.36498 -0.17916 0.15217 88 PRO A CB 1686 C CG . PRO A 88 ? 1.09978 0.84303 1.08014 -0.37765 -0.20848 0.11818 88 PRO A CG 1687 C CD . PRO A 88 ? 1.03785 0.79167 0.99169 -0.33163 -0.18850 0.09504 88 PRO A CD 1695 N N . ASP A 89 ? 1.05358 0.69976 0.98228 -0.30125 -0.13560 0.10160 89 ASP A N 1696 C CA . ASP A 89 ? 1.29682 0.87635 1.20202 -0.29525 -0.12606 0.10327 89 ASP A CA 1697 C C . ASP A 89 ? 1.15029 0.73520 1.04283 -0.24680 -0.09542 0.09571 89 ASP A C 1698 O O . ASP A 89 ? 1.11039 0.64498 0.98517 -0.23554 -0.08738 0.09963 89 ASP A O 1699 C CB . ASP A 89 ? 1.48404 0.95283 1.32887 -0.31006 -0.14753 0.07606 89 ASP A CB 1700 C CG . ASP A 89 ? 1.59532 1.04211 1.44546 -0.36732 -0.18456 0.08454 89 ASP A CG 1701 O OD1 . ASP A 89 ? 1.53357 1.03659 1.44193 -0.39857 -0.19049 0.12208 89 ASP A OD1 1702 O OD2 . ASP A 89 ? 1.54727 0.92834 1.34348 -0.37796 -0.20562 0.05368 89 ASP A OD2 1707 N N . TRP A 90 ? 0.94084 0.58372 0.84327 -0.21968 -0.08081 0.08739 90 TRP A N 1708 C CA . TRP A 90 ? 0.92567 0.56917 0.81124 -0.17891 -0.05878 0.07583 90 TRP A CA 1709 C C . TRP A 90 ? 0.90594 0.62541 0.82418 -0.16447 -0.03977 0.09173 90 TRP A C 1710 O O . TRP A 90 ? 0.78292 0.54869 0.71630 -0.15778 -0.03672 0.08629 90 TRP A O 1711 C CB . TRP A 90 ? 0.95561 0.58128 0.80927 -0.15953 -0.05936 0.04543 90 TRP A CB 1712 C CG . TRP A 90 ? 1.06078 0.60428 0.86669 -0.16295 -0.07042 0.02296 90 TRP A CG 1713 C CD1 . TRP A 90 ? 1.15588 0.62732 0.94152 -0.17516 -0.07840 0.02403 90 TRP A CD1 1714 C CD2 . TRP A 90 ? 1.15199 0.67064 0.91763 -0.15160 -0.07212 -0.00502 90 TRP A CD2 1715 N NE1 . TRP A 90 ? 1.24653 0.64352 0.97777 -0.17014 -0.08432 -0.00587 90 TRP A NE1 1716 C CE2 . TRP A 90 ? 1.32756 0.75625 1.04430 -0.15537 -0.07933 -0.02376 90 TRP A CE2 1717 C CE3 . TRP A 90 ? 1.09819 0.65872 0.86119 -0.13844 -0.06707 -0.01482 90 TRP A CE3 1718 C CZ2 . TRP A 90 ? 1.40074 0.78342 1.06118 -0.14446 -0.07892 -0.05428 90 TRP A CZ2 1719 C CZ3 . TRP A 90 ? 1.11965 0.64045 0.83190 -0.13044 -0.06802 -0.04006 90 TRP A CZ3 1720 C CH2 . TRP A 90 ? 1.32646 0.76081 0.98563 -0.13250 -0.07257 -0.06071 90 TRP A CH2 1731 N N . SER A 91 ? 0.79956 0.52642 0.72274 -0.15803 -0.02676 0.11087 91 SER A N 1732 C CA A SER A 91 ? 0.75076 0.53738 0.68726 -0.14097 -0.00715 0.11960 91 SER A CA 1733 C CA B SER A 91 ? 0.75356 0.54019 0.69008 -0.14098 -0.00714 0.11964 91 SER A CA 1734 C C . SER A 91 ? 0.81070 0.60308 0.72958 -0.11280 -0.00097 0.09575 91 SER A C 1735 O O . SER A 91 ? 0.74969 0.58400 0.67844 -0.10284 0.00871 0.09137 91 SER A O 1736 C CB A SER A 91 ? 0.78935 0.57538 0.72022 -0.13957 0.00324 0.14375 91 SER A CB 1737 C CB B SER A 91 ? 0.79142 0.57747 0.72226 -0.13953 0.00326 0.14375 91 SER A CB 1738 O OG A SER A 91 ? 0.85172 0.65269 0.80796 -0.16774 0.00263 0.17236 91 SER A OG 1739 O OG B SER A 91 ? 0.89496 0.62412 0.80034 -0.12919 -0.00324 0.14047 91 SER A OG 1750 N N . MET A 92 ? 0.80195 0.55169 0.69681 -0.09925 -0.00537 0.08186 92 MET A N 1751 C CA . MET A 92 ? 0.82449 0.57972 0.70824 -0.07805 -0.00203 0.06183 92 MET A CA 1752 C C . MET A 92 ? 0.93943 0.64493 0.80269 -0.06603 -0.00534 0.05126 92 MET A C 1753 O O . MET A 92 ? 0.92687 0.62033 0.78592 -0.05080 -0.00145 0.05964 92 MET A O 1754 C CB . MET A 92 ? 0.72457 0.51328 0.60720 -0.06256 0.00780 0.06507 92 MET A CB 1755 C CG . MET A 92 ? 0.78964 0.59221 0.66904 -0.04901 0.00912 0.04756 92 MET A CG 1756 S SD . MET A 92 ? 0.77505 0.57835 0.65940 -0.05435 0.00488 0.03211 92 MET A SD 1757 C CE . MET A 92 ? 0.73598 0.57327 0.64277 -0.06612 0.00817 0.04298 92 MET A CE 1767 N N . GLN A 93 ? 0.81425 0.49120 0.66280 -0.07078 -0.01185 0.03417 93 GLN A N 1768 C CA . GLN A 93 ? 0.90807 0.53405 0.73022 -0.05442 -0.00937 0.02011 93 GLN A CA 1769 C C . GLN A 93 ? 0.92985 0.58523 0.75352 -0.02977 0.00244 0.01153 93 GLN A C 1770 O O . GLN A 93 ? 0.88668 0.57611 0.71532 -0.03359 0.00250 0.00527 93 GLN A O 1771 C CB . GLN A 93 ? 0.94775 0.52655 0.74093 -0.07133 -0.02112 0.00279 93 GLN A CB 1772 C CG . GLN A 93 ? 1.05168 0.56595 0.80563 -0.05144 -0.01442 -0.01658 93 GLN A CG 1773 C CD . GLN A 93 ? 1.16078 0.60781 0.90316 -0.05198 -0.01749 -0.01072 93 GLN A CD 1774 O OE1 . GLN A 93 ? 1.29740 0.75771 1.06666 -0.05948 -0.02004 0.01355 93 GLN A OE1 1775 N NE2 . GLN A 93 ? 1.38993 0.75919 1.08728 -0.04338 -0.01627 -0.03264 93 GLN A NE2 1784 N N . THR A 94 ? 0.87938 0.52403 0.70356 -0.00496 0.01183 0.01518 94 THR A N 1785 C CA . THR A 94 ? 0.87922 0.56191 0.71566 0.01623 0.02248 0.01414 94 THR A CA 1786 C C . THR A 94 ? 0.88528 0.53338 0.69979 0.03799 0.03544 -0.00063 94 THR A C 1787 O O . THR A 94 ? 0.90325 0.50024 0.70352 0.05284 0.04007 -0.00207 94 THR A O 1788 C CB . THR A 94 ? 0.91810 0.63155 0.77951 0.02856 0.02253 0.03497 94 THR A CB 1789 O OG1 . THR A 94 ? 0.88681 0.62854 0.75545 0.00891 0.01365 0.04438 94 THR A OG1 1790 C CG2 . THR A 94 ? 0.90328 0.66215 0.78516 0.04549 0.02968 0.03799 94 THR A CG2 1798 N N . ILE A 95 ? 0.85100 0.52215 0.65883 0.04076 0.04297 -0.01122 95 ILE A N 1799 C CA . ILE A 95 ? 0.88713 0.53118 0.66654 0.06247 0.06030 -0.02626 95 ILE A CA 1800 C C . ILE A 95 ? 0.86227 0.56787 0.67201 0.08055 0.07578 -0.01520 95 ILE A C 1801 O O . ILE A 95 ? 0.85417 0.60036 0.67297 0.06574 0.07262 -0.01278 95 ILE A O 1802 C CB . ILE A 95 ? 0.99348 0.60609 0.72711 0.04446 0.05440 -0.04703 95 ILE A CB 1803 C CG1 . ILE A 95 ? 1.10590 0.65958 0.81414 0.02146 0.03524 -0.05541 95 ILE A CG1 1804 C CG2 . ILE A 95 ? 1.05056 0.63648 0.74394 0.06917 0.07640 -0.06399 95 ILE A CG2 1805 C CD1 . ILE A 95 ? 1.12691 0.67872 0.81199 -0.00977 0.01635 -0.06438 95 ILE A CD1 1817 N N . ASN A 96 ? 0.84370 0.55774 0.67374 0.11199 0.09170 -0.00509 96 ASN A N 1818 C CA . ASN A 96 ? 0.92255 0.70209 0.78941 0.12942 0.10749 0.00998 96 ASN A CA 1819 C C . ASN A 96 ? 0.79431 0.55773 0.62827 0.15135 0.13499 -0.00493 96 ASN A C 1820 O O . ASN A 96 ? 0.89019 0.61651 0.70760 0.18507 0.15580 -0.01209 96 ASN A O 1821 C CB . ASN A 96 ? 0.94978 0.75990 0.86342 0.15351 0.10991 0.03420 96 ASN A CB 1822 C CG . ASN A 96 ? 1.00798 0.90195 0.97343 0.16173 0.11842 0.05654 96 ASN A CG 1823 O OD1 . ASN A 96 ? 0.92826 0.84608 0.89067 0.16609 0.13687 0.05310 96 ASN A OD1 1824 N ND2 . ASN A 96 ? 0.88932 0.83106 0.90180 0.16058 0.10316 0.08215 96 ASN A ND2 1831 N N . LEU A 97 ? 0.87374 0.66180 0.69405 0.13425 0.13687 -0.00904 97 LEU A N 1832 C CA . LEU A 97 ? 1.05616 0.82885 0.83331 0.15208 0.16335 -0.02298 97 LEU A CA 1833 C C . LEU A 97 ? 0.94640 0.77678 0.76189 0.18631 0.19572 -0.00438 97 LEU A C 1834 O O . LEU A 97 ? 0.96461 0.77573 0.74292 0.21522 0.22718 -0.01634 97 LEU A O 1835 C CB . LEU A 97 ? 1.05649 0.83949 0.80631 0.12209 0.15347 -0.02751 97 LEU A CB 1836 C CG . LEU A 97 ? 1.18080 0.89379 0.86452 0.10328 0.13649 -0.05343 97 LEU A CG 1837 C CD1 . LEU A 97 ? 1.16061 0.89824 0.84683 0.06838 0.11352 -0.04636 97 LEU A CD1 1838 C CD2 . LEU A 97 ? 1.41503 1.07720 1.02657 0.12329 0.15857 -0.07723 97 LEU A CD2 1850 N N . ASP A 98 ? 0.85876 0.76136 0.74661 0.18352 0.18896 0.02524 98 ASP A N 1851 C CA . ASP A 98 ? 0.90798 0.87615 0.84638 0.21632 0.21760 0.04918 98 ASP A CA 1852 C C . ASP A 98 ? 0.92731 0.85457 0.85529 0.26532 0.24264 0.04176 98 ASP A C 1853 O O . ASP A 98 ? 1.00178 0.95548 0.93870 0.30428 0.28099 0.04807 98 ASP A O 1854 C CB . ASP A 98 ? 0.81382 0.86110 0.83172 0.20027 0.19666 0.08286 98 ASP A CB 1855 C CG . ASP A 98 ? 0.84188 0.92592 0.87189 0.15530 0.17574 0.09107 98 ASP A CG 1856 O OD1 . ASP A 98 ? 0.82127 0.91715 0.83229 0.14850 0.19169 0.08997 98 ASP A OD1 1857 O OD2 . ASP A 98 ? 0.91721 1.01526 0.97266 0.12783 0.14410 0.09952 98 ASP A OD2 1862 N N . GLU A 99 ? 1.09308 0.95359 1.00173 0.26553 0.22380 0.02975 99 GLU A N 1863 C CA . GLU A 99 ? 1.23545 1.04584 1.13795 0.31094 0.24260 0.02584 99 GLU A CA 1864 C C . GLU A 99 ? 1.15809 0.86280 0.97108 0.32580 0.25997 -0.01441 99 GLU A C 1865 O O . GLU A 99 ? 1.21119 0.85905 1.00810 0.36829 0.28122 -0.02269 99 GLU A O 1866 C CB . GLU A 99 ? 1.28759 1.07776 1.21584 0.30093 0.21145 0.03909 99 GLU A CB 1867 C CG . GLU A 99 ? 1.25569 1.14236 1.26550 0.29383 0.19435 0.07886 99 GLU A CG 1868 C CD . GLU A 99 ? 1.45512 1.32014 1.48047 0.28785 0.16631 0.09384 99 GLU A CD 1869 O OE1 . GLU A 99 ? 1.33685 1.27222 1.42351 0.29133 0.15312 0.12795 99 GLU A OE1 1870 O OE2 . GLU A 99 ? 1.49632 1.27660 1.47196 0.27677 0.15575 0.07399 99 GLU A OE2 1877 N N . ASN A 100 ? 1.49126 0.62702 1.06143 0.16433 -0.11837 0.13806 100 ASN A N 1878 C CA . ASN A 100 ? 1.46559 0.56116 1.04027 0.15416 -0.10629 0.11886 100 ASN A CA 1879 C C . ASN A 100 ? 1.41286 0.53514 1.03105 0.18297 -0.10208 0.08327 100 ASN A C 1880 O O . ASN A 100 ? 1.51643 0.71067 1.16082 0.19191 -0.09510 0.06747 100 ASN A O 1881 C CB . ASN A 100 ? 1.47179 0.58977 1.03361 0.11193 -0.08421 0.11397 100 ASN A CB 1882 C CG . ASN A 100 ? 1.49327 0.57297 1.05834 0.09687 -0.07426 0.09400 100 ASN A CG 1883 O OD1 . ASN A 100 ? 1.54277 0.64611 1.13358 0.10760 -0.06774 0.06350 100 ASN A OD1 1884 N ND2 . ASN A 100 ? 1.48939 0.50980 1.02565 0.06905 -0.07259 0.11072 100 ASN A ND2 1891 N N . THR A 101 ? 1.51324 0.57507 1.13742 0.19586 -0.10483 0.06985 101 THR A N 1892 C CA . THR A 101 ? 1.55523 0.63358 1.21629 0.22197 -0.09737 0.03241 101 THR A CA 1893 C C . THR A 101 ? 1.50715 0.53662 1.15809 0.20465 -0.08530 0.00905 101 THR A C 1894 O O . THR A 101 ? 1.60087 0.60266 1.27134 0.22810 -0.08350 -0.01801 101 THR A O 1895 C CB . THR A 101 ? 1.44216 0.49922 1.13336 0.26851 -0.11576 0.03237 101 THR A CB 1896 O OG1 . THR A 101 ? 1.60856 0.61371 1.28742 0.26389 -0.13261 0.06353 101 THR A OG1 1897 C CG2 . THR A 101 ? 1.57262 0.70636 1.29202 0.28958 -0.12291 0.03745 101 THR A CG2 1905 N N A ASP A 102 ? 1.51512 0.53458 1.13802 0.16332 -0.07669 0.01689 102 ASP A N 1906 N N B ASP A 102 ? 1.51635 0.53483 1.13882 0.16332 -0.07703 0.01769 102 ASP A N 1907 C CA A ASP A 102 ? 1.56848 0.55118 1.18316 0.14251 -0.06658 -0.00739 102 ASP A CA 1908 C CA B ASP A 102 ? 1.56611 0.54305 1.17824 0.14096 -0.06766 -0.00396 102 ASP A CA 1909 C C A ASP A 102 ? 1.54939 0.59381 1.18152 0.14290 -0.05151 -0.04349 102 ASP A C 1910 C C B ASP A 102 ? 1.55211 0.58341 1.18175 0.14227 -0.05277 -0.04229 102 ASP A C 1911 O O A ASP A 102 ? 1.41465 0.53239 1.05445 0.13582 -0.04508 -0.04155 102 ASP A O 1912 O O B ASP A 102 ? 1.43848 0.54450 1.07709 0.13668 -0.04561 -0.04345 102 ASP A O 1913 C CB A ASP A 102 ? 1.55949 0.52207 1.14625 0.09683 -0.06254 0.01168 102 ASP A CB 1914 C CB B ASP A 102 ? 1.55440 0.51853 1.13938 0.09487 -0.06287 0.01564 102 ASP A CB 1915 C CG A ASP A 102 ? 1.60702 0.53526 1.18714 0.07150 -0.05500 -0.01328 102 ASP A CG 1916 C CG B ASP A 102 ? 1.53228 0.44131 1.09832 0.08517 -0.07307 0.05011 102 ASP A CG 1917 O OD1 A ASP A 102 ? 1.62873 0.60891 1.21652 0.05653 -0.04500 -0.03551 102 ASP A OD1 1918 O OD1 B ASP A 102 ? 1.53694 0.41647 1.11603 0.11156 -0.08515 0.05622 102 ASP A OD1 1919 O OD2 A ASP A 102 ? 1.78311 0.65503 1.36098 0.06419 -0.05922 -0.00989 102 ASP A OD2 1920 O OD2 B ASP A 102 ? 1.55199 0.46170 1.09780 0.04929 -0.06714 0.07059 102 ASP A OD2 1929 N N A PHE A 103 ? 1.55630 0.56686 1.19139 0.15000 -0.04584 -0.07674 103 PHE A N 1930 N N C PHE A 103 ? 1.55862 0.62238 1.20501 0.15790 -0.04476 -0.06975 103 PHE A N 1931 C CA A PHE A 103 ? 1.57019 0.63336 1.21563 0.15317 -0.03128 -0.11256 103 PHE A CA 1932 C CA C PHE A 103 ? 1.56877 0.63405 1.21479 0.15361 -0.03196 -0.10987 103 PHE A CA 1933 C C A PHE A 103 ? 1.51420 0.63038 1.14645 0.11562 -0.02455 -0.11110 103 PHE A C 1934 C C C PHE A 103 ? 1.51520 0.62902 1.14689 0.11546 -0.02419 -0.11324 103 PHE A C 1935 O O A PHE A 103 ? 1.41751 0.60047 1.05843 0.11744 -0.01612 -0.12272 103 PHE A O 1936 O O C PHE A 103 ? 1.42050 0.59560 1.05901 0.11681 -0.01484 -0.12980 103 PHE A O 1937 C CB A PHE A 103 ? 1.66817 0.67628 1.30904 0.15956 -0.02524 -0.14984 103 PHE A CB 1938 C CB C PHE A 103 ? 1.67833 0.65305 1.31188 0.15237 -0.03530 -0.12431 103 PHE A CB 1939 C CG A PHE A 103 ? 1.73963 0.71509 1.35184 0.11839 -0.02354 -0.16009 103 PHE A CG 1940 C CG C PHE A 103 ? 1.76249 0.73066 1.38654 0.14185 -0.02273 -0.16735 103 PHE A CG 1941 C CD1 A PHE A 103 ? 1.79054 0.69528 1.38775 0.09864 -0.03334 -0.14188 103 PHE A CD1 1942 C CD1 C PHE A 103 ? 1.73270 0.72337 1.37322 0.17052 -0.01039 -0.20277 103 PHE A CD1 1943 C CD2 A PHE A 103 ? 1.69140 0.70862 1.29164 0.09722 -0.01355 -0.18642 103 PHE A CD2 1944 C CD2 C PHE A 103 ? 1.82275 0.76184 1.42083 0.10185 -0.02306 -0.17363 103 PHE A CD2 1945 C CE1 A PHE A 103 ? 1.78446 0.67057 1.36465 0.05848 -0.03236 -0.15150 103 PHE A CE1 1946 C CE1 C PHE A 103 ? 1.64520 0.62769 1.26853 0.15830 0.00242 -0.24389 103 PHE A CE1 1947 C CE2 A PHE A 103 ? 1.73081 0.72162 1.30756 0.05877 -0.01598 -0.19573 103 PHE A CE2 1948 C CE2 C PHE A 103 ? 1.78821 0.71918 1.37148 0.08992 -0.01423 -0.21376 103 PHE A CE2 1949 C CZ A PHE A 103 ? 1.78430 0.70739 1.35196 0.03964 -0.02532 -0.17978 103 PHE A CZ 1950 C CZ C PHE A 103 ? 1.65710 0.60800 1.24905 0.11779 -0.00104 -0.24906 103 PHE A CZ 1969 N N . LEU A 104 ? 1.51037 0.59800 1.12449 0.08103 -0.02861 -0.09626 104 LEU A N 1970 C CA . LEU A 104 ? 1.48739 0.62368 1.09666 0.04656 -0.02484 -0.09561 104 LEU A CA 1971 C C . LEU A 104 ? 1.37126 0.56487 0.99133 0.04260 -0.02513 -0.06686 104 LEU A C 1972 O O . LEU A 104 ? 1.37240 0.62499 0.99919 0.02817 -0.02149 -0.06915 104 LEU A O 1973 C CB . LEU A 104 ? 1.59888 0.68812 1.19297 0.00995 -0.02839 -0.09427 104 LEU A CB 1974 C CG . LEU A 104 ? 1.52969 0.66838 1.12723 -0.02635 -0.02803 -0.09036 104 LEU A CG 1975 C CD1 . LEU A 104 ? 1.65769 0.75967 1.24298 -0.05678 -0.03193 -0.11051 104 LEU A CD1 1976 C CD2 . LEU A 104 ? 1.68248 0.83755 1.28842 -0.04255 -0.02765 -0.05644 104 LEU A CD2 1988 N N . ILE A 105 ? 1.40977 0.58436 1.02958 0.05477 -0.03049 -0.04001 105 ILE A N 1989 C CA . ILE A 105 ? 1.29021 0.51711 0.91701 0.05301 -0.02993 -0.01629 105 ILE A CA 1990 C C . ILE A 105 ? 1.14507 0.43437 0.79119 0.07750 -0.02725 -0.02685 105 ILE A C 1991 O O . ILE A 105 ? 1.09526 0.44103 0.75023 0.06970 -0.02404 -0.01819 105 ILE A O 1992 C CB . ILE A 105 ? 1.34208 0.52997 0.95562 0.05993 -0.03793 0.01405 105 ILE A CB 1993 C CG1 . ILE A 105 ? 1.49704 0.62764 1.08897 0.02899 -0.03757 0.02948 105 ILE A CG1 1994 C CG2 . ILE A 105 ? 1.28132 0.52347 0.89808 0.05896 -0.03683 0.03433 105 ILE A CG2 1995 C CD1 . ILE A 105 ? 1.48694 0.64643 1.08409 -0.00809 -0.02787 0.02451 105 ILE A CD1 2007 N N . ARG A 106 ? 1.15399 0.43405 0.80972 0.10703 -0.02742 -0.04618 106 ARG A N 2008 C CA . ARG A 106 ? 1.15182 0.49107 0.82980 0.13088 -0.02373 -0.05469 106 ARG A CA 2009 C C . ARG A 106 ? 1.06085 0.46378 0.74216 0.11227 -0.01466 -0.06280 106 ARG A C 2010 O O . ARG A 106 ? 1.01229 0.46528 0.70574 0.11402 -0.01476 -0.04977 106 ARG A O 2011 C CB . ARG A 106 ? 1.22587 0.54343 0.91715 0.16168 -0.02085 -0.08113 106 ARG A CB 2012 C CG . ARG A 106 ? 1.49515 0.87252 1.20467 0.17406 -0.00761 -0.10656 106 ARG A CG 2013 C CD . ARG A 106 ? 1.50081 0.92943 1.23983 0.19781 -0.01084 -0.09534 106 ARG A CD 2014 N NE . ARG A 106 ? 1.58119 0.98647 1.34626 0.23544 -0.01689 -0.10196 106 ARG A NE 2015 C CZ . ARG A 106 ? 1.52826 0.93294 1.31290 0.25737 -0.00523 -0.13407 106 ARG A CZ 2016 N NH1 . ARG A 106 ? 1.49041 0.91503 1.26346 0.24329 0.01397 -0.16270 106 ARG A NH1 2017 N NH2 . ARG A 106 ? 1.59083 0.97407 1.40719 0.29432 -0.01331 -0.13795 106 ARG A NH2 2031 N N . PRO A 107 ? 1.05898 0.46133 0.72852 0.09326 -0.00880 -0.08255 107 PRO A N 2032 C CA . PRO A 107 ? 1.05291 0.51395 0.72414 0.07621 -0.00410 -0.08569 107 PRO A CA 2033 C C . PRO A 107 ? 1.02153 0.50640 0.69759 0.05423 -0.00885 -0.06104 107 PRO A C 2034 O O . PRO A 107 ? 0.95060 0.48753 0.63803 0.05107 -0.00704 -0.05505 107 PRO A O 2035 C CB . PRO A 107 ? 1.03107 0.47381 0.68175 0.05882 -0.00139 -0.11051 107 PRO A CB 2036 C CG . PRO A 107 ? 1.18096 0.55350 0.82039 0.05550 -0.00626 -0.11342 107 PRO A CG 2037 C CD . PRO A 107 ? 1.20929 0.55663 0.86182 0.08647 -0.00796 -0.10361 107 PRO A CD 2045 N N . ILE A 108 ? 0.97728 0.42507 0.64675 0.03839 -0.01334 -0.04731 108 ILE A N 2046 C CA . ILE A 108 ? 0.96961 0.44281 0.64809 0.01859 -0.01387 -0.02687 108 ILE A CA 2047 C C . ILE A 108 ? 0.93725 0.43683 0.62459 0.03486 -0.01307 -0.01015 108 ILE A C 2048 O O . ILE A 108 ? 0.91155 0.45549 0.61207 0.02710 -0.01082 -0.00217 108 ILE A O 2049 C CB . ILE A 108 ? 1.10437 0.53296 0.77442 -0.00391 -0.01520 -0.01714 108 ILE A CB 2050 C CG1 . ILE A 108 ? 1.11923 0.51747 0.77982 -0.01977 -0.01834 -0.03657 108 ILE A CG1 2051 C CG2 . ILE A 108 ? 1.06021 0.52246 0.74575 -0.02651 -0.01176 -0.00145 108 ILE A CG2 2052 C CD1 . ILE A 108 ? 1.20556 0.55073 0.85768 -0.04138 -0.01958 -0.02959 108 ILE A CD1 2064 N N . LYS A 109 ? 1.01819 0.49013 0.69955 0.05794 -0.01677 -0.00529 109 LYS A N 2065 C CA . LYS A 109 ? 0.96477 0.46208 0.65251 0.07364 -0.01979 0.00930 109 LYS A CA 2066 C C . LYS A 109 ? 0.91690 0.47545 0.62461 0.08180 -0.01626 0.00027 109 LYS A C 2067 O O . LYS A 109 ? 0.88929 0.48341 0.60476 0.07792 -0.01584 0.01102 109 LYS A O 2068 C CB . LYS A 109 ? 1.03269 0.49305 0.71572 0.10091 -0.02902 0.01365 109 LYS A CB 2069 C CG . LYS A 109 ? 1.23725 0.67127 0.90224 0.09909 -0.03698 0.03982 109 LYS A CG 2070 C CD . LYS A 109 ? 1.23480 0.61669 0.89303 0.12435 -0.05051 0.04599 109 LYS A CD 2071 C CE . LYS A 109 ? 1.16273 0.57783 0.84540 0.15762 -0.05987 0.04180 109 LYS A CE 2072 N NZ . LYS A 109 ? 1.24721 0.61093 0.92919 0.18486 -0.07692 0.05038 109 LYS A NZ 2086 N N . VAL A 110 ? 0.93849 0.50794 0.65285 0.09210 -0.01245 -0.02045 110 VAL A N 2087 C CA . VAL A 110 ? 0.87845 0.50377 0.60946 0.09795 -0.00734 -0.02853 110 VAL A CA 2088 C C . VAL A 110 ? 0.81705 0.47524 0.55035 0.07347 -0.00511 -0.02274 110 VAL A C 2089 O O . VAL A 110 ? 0.84617 0.54496 0.59326 0.07340 -0.00429 -0.01600 110 VAL A O 2090 C CB . VAL A 110 ? 0.91826 0.54575 0.65040 0.10971 0.00023 -0.05367 110 VAL A CB 2091 C CG1 . VAL A 110 ? 0.92872 0.61416 0.67717 0.11411 0.00776 -0.06036 110 VAL A CG1 2092 C CG2 . VAL A 110 ? 1.00496 0.59615 0.74226 0.13671 -0.00252 -0.06103 110 VAL A CG2 2102 N N A LEU A 111 ? 0.89607 0.53664 0.61898 0.05251 -0.00573 -0.02564 111 LEU A N 2103 N N B LEU A 111 ? 0.89466 0.53556 0.61775 0.05242 -0.00576 -0.02538 111 LEU A N 2104 C CA A LEU A 111 ? 0.85237 0.52273 0.58363 0.03109 -0.00702 -0.01943 111 LEU A CA 2105 C CA B LEU A 111 ? 0.85281 0.52522 0.58475 0.03170 -0.00689 -0.01921 111 LEU A CA 2106 C C A LEU A 111 ? 0.85480 0.53660 0.59902 0.02560 -0.00703 -0.00173 111 LEU A C 2107 C C B LEU A 111 ? 0.85384 0.53603 0.59832 0.02531 -0.00703 -0.00154 111 LEU A C 2108 O O A LEU A 111 ? 0.81389 0.53229 0.57370 0.02178 -0.00639 0.00360 111 LEU A O 2109 O O B LEU A 111 ? 0.81536 0.53369 0.57563 0.02064 -0.00646 0.00397 111 LEU A O 2110 C CB A LEU A 111 ? 0.89546 0.54422 0.61732 0.00997 -0.01129 -0.02560 111 LEU A CB 2111 C CB B LEU A 111 ? 0.89282 0.54716 0.61541 0.01074 -0.01109 -0.02610 111 LEU A CB 2112 C CG A LEU A 111 ? 0.94846 0.60697 0.65699 0.00223 -0.01332 -0.04125 111 LEU A CG 2113 C CG B LEU A 111 ? 0.92882 0.57842 0.63278 0.01135 -0.01028 -0.04618 111 LEU A CG 2114 C CD1 A LEU A 111 ? 0.94592 0.65174 0.66338 -0.00051 -0.01377 -0.03611 111 LEU A CD1 2115 C CD1 B LEU A 111 ? 0.99506 0.62296 0.68858 -0.01174 -0.01811 -0.05141 111 LEU A CD1 2116 C CD2 A LEU A 111 ? 0.97752 0.61204 0.66756 0.01862 -0.00675 -0.06134 111 LEU A CD2 2117 C CD2 B LEU A 111 ? 0.90459 0.59799 0.60970 0.01129 -0.00797 -0.04860 111 LEU A CD2 2140 N N . LEU A 112 ? 0.83688 0.48480 0.57242 0.02370 -0.00677 0.00698 112 LEU A N 2141 C CA . LEU A 112 ? 0.83086 0.48753 0.57235 0.01528 -0.00331 0.02144 112 LEU A CA 2142 C C . LEU A 112 ? 0.82870 0.51415 0.57527 0.03021 -0.00354 0.02593 112 LEU A C 2143 O O . LEU A 112 ? 0.81192 0.52544 0.57142 0.02254 0.00004 0.03059 112 LEU A O 2144 C CB . LEU A 112 ? 0.82371 0.43484 0.54626 0.00918 -0.00179 0.03114 112 LEU A CB 2145 C CG . LEU A 112 ? 0.92448 0.54075 0.64529 -0.00350 0.00576 0.04471 112 LEU A CG 2146 C CD1 . LEU A 112 ? 0.95332 0.59929 0.70128 -0.02395 0.01253 0.04135 112 LEU A CD1 2147 C CD2 . LEU A 112 ? 0.98151 0.54744 0.67553 -0.01138 0.00754 0.05638 112 LEU A CD2 2160 N N . GLN A 113 ? 0.80723 0.48760 0.54781 0.05175 -0.00816 0.02275 113 GLN A N 2161 C CA . GLN A 113 ? 0.80011 0.51122 0.54913 0.06484 -0.01085 0.02603 113 GLN A CA 2162 C C . GLN A 113 ? 0.81636 0.57310 0.58604 0.06071 -0.00745 0.01895 113 GLN A C 2163 O O . GLN A 113 ? 0.80571 0.58929 0.58531 0.05761 -0.00701 0.02353 113 GLN A O 2164 C CB . GLN A 113 ? 0.90696 0.60715 0.65441 0.09004 -0.01822 0.02316 113 GLN A CB 2165 C CG . GLN A 113 ? 1.02210 0.76311 0.78657 0.10350 -0.02260 0.02290 113 GLN A CG 2166 C CD . GLN A 113 ? 1.26445 0.98998 1.02540 0.12500 -0.03567 0.03016 113 GLN A CD 2167 O OE1 . GLN A 113 ? 1.47230 1.21359 1.23180 0.12710 -0.04395 0.03959 113 GLN A OE1 2168 N NE2 . GLN A 113 ? 1.25758 0.95016 1.01712 0.14123 -0.03940 0.02549 113 GLN A NE2 2177 N N . THR A 114 ? 0.77554 0.53816 0.54821 0.05874 -0.00519 0.00790 114 THR A N 2178 C CA . THR A 114 ? 0.78008 0.58091 0.56629 0.05233 -0.00275 0.00412 114 THR A CA 2179 C C . THR A 114 ? 0.74545 0.55730 0.54254 0.03384 -0.00340 0.01246 114 THR A C 2180 O O . THR A 114 ? 0.70776 0.54775 0.51981 0.03089 -0.00304 0.01586 114 THR A O 2181 C CB . THR A 114 ? 0.78652 0.58542 0.56339 0.05067 -0.00006 -0.00884 114 THR A CB 2182 O OG1 . THR A 114 ? 0.81103 0.60581 0.58599 0.07068 0.00361 -0.02041 114 THR A OG1 2183 C CG2 . THR A 114 ? 0.76348 0.59634 0.54631 0.03941 0.00156 -0.00896 114 THR A CG2 2192 N N A LEU A 115 ? 0.74402 0.53405 0.53815 0.02126 -0.00435 0.01493 115 LEU A N 2193 N N B LEU A 115 ? 0.74520 0.53511 0.53925 0.02132 -0.00435 0.01492 115 LEU A N 2194 C CA A LEU A 115 ? 0.74115 0.54414 0.55498 0.00591 -0.00468 0.02104 115 LEU A CA 2195 C CA B LEU A 115 ? 0.74156 0.54400 0.55513 0.00584 -0.00469 0.02100 115 LEU A CA 2196 C C A LEU A 115 ? 0.74392 0.55451 0.56622 0.00699 0.00101 0.02673 115 LEU A C 2197 C C B LEU A 115 ? 0.74371 0.55397 0.56598 0.00682 0.00101 0.02673 115 LEU A C 2198 O O A LEU A 115 ? 0.68360 0.51590 0.52747 0.00114 0.00226 0.02848 115 LEU A O 2199 O O B LEU A 115 ? 0.68428 0.51623 0.52822 0.00089 0.00221 0.02848 115 LEU A O 2200 C CB A LEU A 115 ? 0.75206 0.53393 0.56653 -0.00818 -0.00648 0.02088 115 LEU A CB 2201 C CB B LEU A 115 ? 0.75365 0.53423 0.56714 -0.00801 -0.00646 0.02070 115 LEU A CB 2202 C CG A LEU A 115 ? 0.83562 0.62203 0.65172 -0.01868 -0.01580 0.01674 115 LEU A CG 2203 C CG B LEU A 115 ? 0.74030 0.53801 0.58158 -0.02384 -0.01110 0.02376 115 LEU A CG 2204 C CD1 A LEU A 115 ? 0.88493 0.64449 0.69544 -0.03099 -0.01882 0.01328 115 LEU A CD1 2205 C CD1 B LEU A 115 ? 0.80364 0.61786 0.64599 -0.02705 -0.02203 0.02278 115 LEU A CD1 2206 C CD2 A LEU A 115 ? 0.80277 0.61808 0.64752 -0.02740 -0.02185 0.02331 115 LEU A CD2 2207 C CD2 B LEU A 115 ? 0.78689 0.56433 0.63169 -0.03787 -0.01138 0.02285 115 LEU A CD2 2230 N N . THR A 116 ? 0.70687 0.49671 0.51032 0.01365 0.00382 0.02955 116 THR A N 2231 C CA . THR A 116 ? 0.69715 0.49164 0.49890 0.01174 0.00937 0.03411 116 THR A CA 2232 C C . THR A 116 ? 0.69049 0.51367 0.50071 0.02000 0.00657 0.03195 116 THR A C 2233 O O . THR A 116 ? 0.69389 0.53278 0.51628 0.01341 0.01126 0.03091 116 THR A O 2234 C CB . THR A 116 ? 0.80727 0.56937 0.57893 0.01552 0.00965 0.04085 116 THR A CB 2235 O OG1 . THR A 116 ? 0.78826 0.52161 0.55336 0.00402 0.01343 0.04309 116 THR A OG1 2236 C CG2 . THR A 116 ? 0.80788 0.57369 0.56833 0.00985 0.01588 0.04521 116 THR A CG2 2245 N N . GLU A 117 ? 0.69285 0.52368 0.49954 0.03375 0.00011 0.02939 117 GLU A N 2246 C CA . GLU A 117 ? 0.75009 0.61122 0.56850 0.03935 -0.00264 0.02693 117 GLU A CA 2247 C C . GLU A 117 ? 0.70675 0.58978 0.54804 0.02791 -0.00005 0.02530 117 GLU A C 2248 O O . GLU A 117 ? 0.67094 0.56998 0.52347 0.02399 0.00083 0.02442 117 GLU A O 2249 C CB . GLU A 117 ? 0.78289 0.65427 0.60233 0.05474 -0.00720 0.02230 117 GLU A CB 2250 C CG . GLU A 117 ? 1.24573 1.09445 1.04906 0.07062 -0.01342 0.02455 117 GLU A CG 2251 C CD . GLU A 117 ? 1.68958 1.56258 1.50335 0.08590 -0.02159 0.02300 117 GLU A CD 2252 O OE1 . GLU A 117 ? 1.73370 1.64227 1.56906 0.08564 -0.01922 0.01643 117 GLU A OE1 2253 O OE2 . GLU A 117 ? 1.63409 1.49092 1.43505 0.09692 -0.03157 0.02949 117 GLU A OE2 2260 N N . SER A 118 ? 0.62133 0.50206 0.46809 0.02180 -0.00063 0.02521 118 SER A N 2261 C CA . SER A 118 ? 0.60912 0.50560 0.47626 0.01121 -0.00233 0.02748 118 SER A CA 2262 C C . SER A 118 ? 0.62944 0.52338 0.51545 0.00295 0.00084 0.02892 118 SER A C 2263 O O . SER A 118 ? 0.60565 0.51266 0.51105 -0.00069 0.00106 0.02884 118 SER A O 2264 C CB . SER A 118 ? 0.63450 0.52578 0.49634 0.00549 -0.00704 0.02841 118 SER A CB 2265 O OG . SER A 118 ? 0.65268 0.55611 0.53084 -0.00474 -0.01277 0.03438 118 SER A OG 2271 N N . HIS A 119 ? 0.65685 0.53354 0.53948 -0.00066 0.00492 0.02885 119 HIS A N 2272 C CA . HIS A 119 ? 0.60575 0.48351 0.50988 -0.00864 0.01241 0.02713 119 HIS A CA 2273 C C . HIS A 119 ? 0.62524 0.51003 0.52775 -0.00684 0.01979 0.02227 119 HIS A C 2274 O O . HIS A 119 ? 0.61302 0.50788 0.54186 -0.01108 0.02411 0.01769 119 HIS A O 2275 C CB . HIS A 119 ? 0.62946 0.48827 0.52462 -0.01463 0.01902 0.02744 119 HIS A CB 2276 C CG . HIS A 119 ? 0.60242 0.46797 0.52854 -0.02498 0.02874 0.02397 119 HIS A CG 2277 N ND1 . HIS A 119 ? 0.60506 0.47482 0.53446 -0.02777 0.04325 0.01775 119 HIS A ND1 2278 C CD2 . HIS A 119 ? 0.63649 0.50791 0.59446 -0.03338 0.02645 0.02409 119 HIS A CD2 2279 C CE1 . HIS A 119 ? 0.65074 0.52974 0.61562 -0.03645 0.05261 0.01281 119 HIS A CE1 2280 N NE2 . HIS A 119 ? 0.63498 0.51663 0.62097 -0.03949 0.04126 0.01741 119 HIS A NE2 2288 N N . ARG A 120 ? 0.59923 0.47761 0.47155 -0.00031 0.01976 0.02243 120 ARG A N 2289 C CA . ARG A 120 ? 0.63682 0.51969 0.49976 -0.00121 0.02478 0.01727 120 ARG A CA 2290 C C . ARG A 120 ? 0.62287 0.52626 0.50476 -0.00046 0.02002 0.01291 120 ARG A C 2291 O O . ARG A 120 ? 0.67595 0.58369 0.56184 -0.00530 0.02559 0.00484 120 ARG A O 2292 C CB . ARG A 120 ? 0.68015 0.55039 0.50541 0.00574 0.02025 0.02154 120 ARG A CB 2293 C CG . ARG A 120 ? 0.74978 0.59249 0.55259 0.00246 0.02518 0.02783 120 ARG A CG 2294 C CD . ARG A 120 ? 0.75092 0.57942 0.52208 -0.00540 0.03333 0.02882 120 ARG A CD 2295 N NE . ARG A 120 ? 0.73779 0.57381 0.52409 -0.01935 0.05098 0.01936 120 ARG A NE 2296 C CZ . ARG A 120 ? 0.77078 0.59810 0.53018 -0.03039 0.06395 0.01615 120 ARG A CZ 2297 N NH1 . ARG A 120 ? 0.79349 0.60057 0.50383 -0.03082 0.05841 0.02544 120 ARG A NH1 2298 N NH2 . ARG A 120 ? 0.78388 0.62231 0.56547 -0.04145 0.08293 0.00325 120 ARG A NH2 2312 N N . ILE A 121 ? 0.58333 0.49775 0.47514 0.00333 0.01126 0.01714 121 ILE A N 2313 C CA . ILE A 121 ? 0.57954 0.51100 0.49092 0.00014 0.00747 0.01545 121 ILE A CA 2314 C C . ILE A 121 ? 0.60057 0.52947 0.54281 -0.00735 0.00941 0.01536 121 ILE A C 2315 O O . ILE A 121 ? 0.61741 0.54934 0.57674 -0.01160 0.01157 0.00931 121 ILE A O 2316 C CB . ILE A 121 ? 0.61976 0.56431 0.52897 0.00374 0.00059 0.02056 121 ILE A CB 2317 C CG1 . ILE A 121 ? 0.61688 0.57149 0.50965 0.01346 -0.00241 0.01775 121 ILE A CG1 2318 C CG2 . ILE A 121 ? 0.62357 0.58091 0.55380 -0.00481 -0.00232 0.02302 121 ILE A CG2 2319 C CD1 . ILE A 121 ? 0.69658 0.66088 0.58572 0.02066 -0.00430 0.01935 121 ILE A CD1 2331 N N . LEU A 122 ? 0.54993 0.47225 0.50204 -0.00874 0.00700 0.02141 122 LEU A N 2332 C CA . LEU A 122 ? 0.57789 0.49930 0.56578 -0.01349 0.00450 0.02326 122 LEU A CA 2333 C C . LEU A 122 ? 0.55888 0.47764 0.56713 -0.01469 0.01710 0.01135 122 LEU A C 2334 O O . LEU A 122 ? 0.55771 0.47715 0.60107 -0.01587 0.01657 0.00825 122 LEU A O 2335 C CB . LEU A 122 ? 0.58618 0.50343 0.57999 -0.01549 -0.00314 0.03136 122 LEU A CB 2336 C CG . LEU A 122 ? 0.67355 0.59206 0.64759 -0.01714 -0.01486 0.04120 122 LEU A CG 2337 C CD1 . LEU A 122 ? 0.72659 0.63904 0.70479 -0.02146 -0.02340 0.04624 122 LEU A CD1 2338 C CD2 . LEU A 122 ? 0.65424 0.57866 0.63776 -0.02161 -0.02310 0.04901 122 LEU A CD2 2350 N N . GLU A 123 ? 0.54194 0.45584 0.52796 -0.01485 0.02919 0.00426 123 GLU A N 2351 C CA . GLU A 123 ? 0.56168 0.47447 0.56139 -0.01856 0.04552 -0.00955 123 GLU A CA 2352 C C . GLU A 123 ? 0.55566 0.47083 0.56426 -0.01925 0.04767 -0.02031 123 GLU A C 2353 O O . GLU A 123 ? 0.56570 0.48051 0.60392 -0.02098 0.05883 -0.03344 123 GLU A O 2354 C CB . GLU A 123 ? 0.60398 0.50823 0.56443 -0.02195 0.05782 -0.01310 123 GLU A CB 2355 C CG . GLU A 123 ? 0.62029 0.51670 0.57348 -0.02461 0.05983 -0.00526 123 GLU A CG 2356 C CD . GLU A 123 ? 0.67339 0.55422 0.57686 -0.02717 0.06566 -0.00251 123 GLU A CD 2357 O OE1 . GLU A 123 ? 0.68324 0.56194 0.56486 -0.03129 0.07560 -0.01061 123 GLU A OE1 2358 O OE2 . GLU A 123 ? 0.63195 0.49981 0.51572 -0.02555 0.05912 0.00780 123 GLU A OE2 2365 N N . LYS A 124 ? 0.55208 0.47032 0.53801 -0.01837 0.03816 -0.01711 124 LYS A N 2366 C CA A LYS A 124 ? 0.63071 0.55014 0.62178 -0.02201 0.03916 -0.02844 124 LYS A CA 2367 C CA B LYS A 124 ? 0.63059 0.55004 0.62163 -0.02200 0.03910 -0.02839 124 LYS A CA 2368 C C . LYS A 124 ? 0.53330 0.45045 0.56638 -0.02277 0.03216 -0.02593 124 LYS A C 2369 O O . LYS A 124 ? 0.55661 0.46856 0.60392 -0.02655 0.03524 -0.03806 124 LYS A O 2370 C CB A LYS A 124 ? 0.65946 0.58756 0.61923 -0.02222 0.02946 -0.02546 124 LYS A CB 2371 C CB B LYS A 124 ? 0.65976 0.58794 0.61977 -0.02220 0.02930 -0.02530 124 LYS A CB 2372 C CG A LYS A 124 ? 0.74020 0.66688 0.65717 -0.02067 0.03172 -0.02687 124 LYS A CG 2373 C CG B LYS A 124 ? 0.74254 0.66981 0.66006 -0.01961 0.03038 -0.02452 124 LYS A CG 2374 C CD A LYS A 124 ? 0.80360 0.72148 0.70501 -0.02790 0.04590 -0.04313 124 LYS A CD 2375 C CD B LYS A 124 ? 0.79024 0.70650 0.69017 -0.02543 0.04589 -0.03727 124 LYS A CD 2376 C CE A LYS A 124 ? 0.98381 0.90001 0.83554 -0.02925 0.04131 -0.04260 124 LYS A CE 2377 C CE B LYS A 124 ? 0.96209 0.87403 0.81162 -0.02585 0.04251 -0.03479 124 LYS A CE 2378 N NZ A LYS A 124 ? 0.97124 0.87439 0.79508 -0.03829 0.05858 -0.05399 124 LYS A NZ 2379 N NZ B LYS A 124 ? 0.91292 0.83299 0.75063 -0.01626 0.02446 -0.02084 124 LYS A NZ 2406 N N . TYR A 125 ? 0.52605 0.44379 0.57610 -0.02036 0.02131 -0.01005 125 TYR A N 2407 C CA . TYR A 125 ? 0.54537 0.45663 0.63158 -0.02159 0.01073 -0.00232 125 TYR A CA 2408 C C . TYR A 125 ? 0.54990 0.45631 0.67990 -0.01684 0.01191 -0.00384 125 TYR A C 2409 O O . TYR A 125 ? 0.57994 0.47815 0.74410 -0.01587 -0.00050 0.00508 125 TYR A O 2410 C CB . TYR A 125 ? 0.54194 0.45708 0.61449 -0.02450 -0.00475 0.01806 125 TYR A CB 2411 C CG . TYR A 125 ? 0.50916 0.43375 0.55457 -0.02961 -0.00601 0.01901 125 TYR A CG 2412 C CD1 . TYR A 125 ? 0.49630 0.41738 0.55354 -0.03742 -0.00902 0.01791 125 TYR A CD1 2413 C CD2 . TYR A 125 ? 0.59521 0.53276 0.60747 -0.02648 -0.00410 0.01976 125 TYR A CD2 2414 C CE1 . TYR A 125 ? 0.51366 0.44902 0.55260 -0.04384 -0.00979 0.01771 125 TYR A CE1 2415 C CE2 . TYR A 125 ? 0.63424 0.58649 0.63125 -0.02962 -0.00543 0.01916 125 TYR A CE2 2416 C CZ . TYR A 125 ? 0.61043 0.56427 0.62167 -0.03918 -0.00795 0.01801 125 TYR A CZ 2417 O OH . TYR A 125 ? 0.58053 0.55442 0.58267 -0.04409 -0.00900 0.01659 125 TYR A OH 2427 N N . THR A 126 ? 0.54964 0.46125 0.68176 -0.01451 0.02604 -0.01434 126 THR A N 2428 C CA A THR A 126 ? 0.56053 0.47569 0.73995 -0.01035 0.02946 -0.01786 126 THR A CA 2429 C CA B THR A 126 ? 0.56308 0.47776 0.74422 -0.01020 0.02890 -0.01778 126 THR A CA 2430 C C . THR A 126 ? 0.58622 0.50182 0.78728 -0.00933 0.05297 -0.04312 126 THR A C 2431 O O . THR A 126 ? 0.62160 0.53650 0.78394 -0.01440 0.06900 -0.05593 126 THR A O 2432 C CB A THR A 126 ? 0.59770 0.52147 0.76380 -0.01215 0.03008 -0.01078 126 THR A CB 2433 C CB B THR A 126 ? 0.60408 0.52758 0.77722 -0.01148 0.02653 -0.00865 126 THR A CB 2434 O OG1 A THR A 126 ? 0.63937 0.56120 0.77546 -0.01395 0.01190 0.00795 126 THR A OG1 2435 O OG1 B THR A 126 ? 0.63219 0.55563 0.75744 -0.01557 0.04036 -0.01418 126 THR A OG1 2436 C CG2 A THR A 126 ? 0.60952 0.54293 0.83252 -0.00926 0.02972 -0.01264 126 THR A CG2 2437 C CG2 B THR A 126 ? 0.63400 0.55567 0.79454 -0.01272 0.00263 0.01341 126 THR A CG2 2452 N N . GLN A 127 ? 0.68262 0.59988 0.94497 -0.00281 0.05503 -0.05084 127 GLN A N 2453 C CA . GLN A 127 ? 0.67953 0.59980 0.96622 -0.00170 0.08204 -0.07909 127 GLN A CA 2454 C C . GLN A 127 ? 0.67977 0.61566 0.95303 -0.00771 0.10336 -0.08695 127 GLN A C 2455 O O . GLN A 127 ? 0.61513 0.56249 0.90312 -0.00794 0.09541 -0.07359 127 GLN A O 2456 C CB . GLN A 127 ? 0.76452 0.68429 1.13009 0.00963 0.07981 -0.08745 127 GLN A CB 2457 C CG . GLN A 127 ? 0.89328 0.79470 1.27989 0.01516 0.05149 -0.06959 127 GLN A CG 2458 C CD . GLN A 127 ? 1.18303 1.08909 1.63943 0.02642 0.03273 -0.05768 127 GLN A CD 2459 O OE1 . GLN A 127 ? 1.19867 1.12407 1.70585 0.03288 0.04446 -0.07026 127 GLN A OE1 2460 N NE2 . GLN A 127 ? 1.17975 1.06885 1.64108 0.02798 0.00258 -0.03274 127 GLN A NE2 2469 N N . PRO A 128 ? 0.70429 0.63950 0.94768 -0.01502 0.13047 -0.10849 128 PRO A N 2470 C CA . PRO A 128 ? 0.75354 0.69975 0.97551 -0.02466 0.15182 -0.11290 128 PRO A CA 2471 C C . PRO A 128 ? 0.71466 0.68232 1.00545 -0.02215 0.16375 -0.12040 128 PRO A C 2472 O O . PRO A 128 ? 0.70622 0.68464 0.98904 -0.03099 0.17249 -0.11495 128 PRO A O 2473 C CB . PRO A 128 ? 0.93924 0.87802 1.11689 -0.03408 0.17809 -0.13628 128 PRO A CB 2474 C CG . PRO A 128 ? 0.76669 0.68998 0.92882 -0.03028 0.16351 -0.13897 128 PRO A CG 2475 C CD . PRO A 128 ? 0.88623 0.80927 1.11320 -0.01736 0.14370 -0.13083 128 PRO A CD 2483 N N . SER A 129 ? 0.61089 0.66849 0.58240 0.03842 -0.06019 -0.03870 129 SER A N 2484 C CA . SER A 129 ? 0.80484 0.87402 0.77429 0.04119 -0.04142 -0.02838 129 SER A CA 2485 C C . SER A 129 ? 0.73877 0.80781 0.73372 0.01512 -0.02656 -0.00684 129 SER A C 2486 O O . SER A 129 ? 0.68795 0.76874 0.68749 0.01434 -0.01186 0.01261 129 SER A O 2487 C CB . SER A 129 ? 0.83177 0.88910 0.80632 0.04784 -0.05725 -0.04756 129 SER A CB 2488 O OG . SER A 129 ? 0.78523 0.82900 0.79990 0.02048 -0.06798 -0.04774 129 SER A OG 2494 N N . ILE A 130 ? 0.65931 0.71625 0.67251 -0.00179 -0.03353 -0.00709 130 ILE A N 2495 C CA . ILE A 130 ? 0.67922 0.72803 0.70192 -0.01447 -0.02675 0.00743 130 ILE A CA 2496 C C . ILE A 130 ? 0.64772 0.69583 0.65795 -0.01204 -0.02236 0.02267 130 ILE A C 2497 O O . ILE A 130 ? 0.62573 0.66512 0.64664 -0.01884 -0.02267 0.03792 130 ILE A O 2498 C CB . ILE A 130 ? 0.67482 0.72011 0.70894 -0.01868 -0.03279 0.00774 130 ILE A CB 2499 C CG1 . ILE A 130 ? 0.79987 0.85008 0.86242 -0.02489 -0.03875 0.00364 130 ILE A CG1 2500 C CG2 . ILE A 130 ? 0.72329 0.75363 0.74875 -0.01726 -0.03162 0.01697 130 ILE A CG2 2501 C CD1 . ILE A 130 ? 0.81657 0.85986 0.88583 -0.03052 -0.03413 0.00086 130 ILE A CD1 2513 N N . PHE A 131 ? 0.66871 0.72368 0.66217 -0.00326 -0.02323 0.02092 131 PHE A N 2514 C CA . PHE A 131 ? 0.68801 0.74169 0.67423 -0.00204 -0.02198 0.03775 131 PHE A CA 2515 C C . PHE A 131 ? 0.68638 0.75991 0.68417 0.00112 -0.01214 0.06166 131 PHE A C 2516 O O . PHE A 131 ? 0.69635 0.76430 0.71308 -0.00720 -0.01747 0.08648 131 PHE A O 2517 C CB . PHE A 131 ? 0.69156 0.75178 0.65731 0.00801 -0.02354 0.03121 131 PHE A CB 2518 C CG . PHE A 131 ? 0.65100 0.70159 0.61473 0.00622 -0.03166 0.02198 131 PHE A CG 2519 C CD1 . PHE A 131 ? 0.78817 0.84790 0.75787 0.00902 -0.03811 0.01041 131 PHE A CD1 2520 C CD2 . PHE A 131 ? 0.84970 0.88320 0.80759 0.00644 -0.03689 0.02834 131 PHE A CD2 2521 C CE1 . PHE A 131 ? 0.79418 0.85868 0.77476 0.00858 -0.04298 0.01475 131 PHE A CE1 2522 C CE2 . PHE A 131 ? 0.87062 0.90739 0.82331 0.01460 -0.03944 0.02671 131 PHE A CE2 2523 C CZ . PHE A 131 ? 0.86767 0.92629 0.83694 0.01400 -0.03912 0.02467 131 PHE A CZ 2533 N N . LYS A 132 ? 0.63634 0.73500 0.62585 0.01707 -0.00113 0.05885 132 LYS A N 2534 C CA . LYS A 132 ? 0.74054 0.87351 0.74372 0.02773 0.01385 0.09251 132 LYS A CA 2535 C C . LYS A 132 ? 0.72281 0.84977 0.76691 0.00758 0.01126 0.11395 132 LYS A C 2536 O O . LYS A 132 ? 0.63780 0.78388 0.71772 0.00218 0.01335 0.15557 132 LYS A O 2537 C CB . LYS A 132 ? 0.87393 1.03794 0.84732 0.06281 0.02614 0.08463 132 LYS A CB 2538 C CG . LYS A 132 ? 1.06102 1.20312 1.01443 0.06968 0.01330 0.04393 132 LYS A CG 2539 C CD . LYS A 132 ? 1.15175 1.30094 1.12269 0.06757 0.01968 0.04981 132 LYS A CD 2540 C CE . LYS A 132 ? 1.23561 1.37461 1.17720 0.09222 0.00689 0.01504 132 LYS A CE 2541 N NZ . LYS A 132 ? 1.23177 1.37203 1.19088 0.08685 0.01084 0.01660 132 LYS A NZ 2555 N N . ILE A 133 ? 0.59054 0.69131 0.63692 -0.00449 0.00320 0.09038 133 ILE A N 2556 C CA . ILE A 133 ? 0.59658 0.68473 0.67868 -0.02238 -0.00398 0.10670 133 ILE A CA 2557 C C . ILE A 133 ? 0.58134 0.63652 0.68262 -0.03808 -0.02727 0.12062 133 ILE A C 2558 O O . ILE A 133 ? 0.57338 0.62830 0.71766 -0.04950 -0.03912 0.15504 133 ILE A O 2559 C CB . ILE A 133 ? 0.67253 0.73983 0.74832 -0.02823 -0.00777 0.07728 133 ILE A CB 2560 C CG1 . ILE A 133 ? 0.63923 0.73069 0.69926 -0.01099 0.00521 0.06313 133 ILE A CG1 2561 C CG2 . ILE A 133 ? 0.59795 0.64653 0.70583 -0.04441 -0.01867 0.09066 133 ILE A CG2 2562 C CD1 . ILE A 133 ? 0.76571 0.83743 0.82501 -0.01768 -0.00234 0.03556 133 ILE A CD1 2574 N N . ILE A 134 ? 0.59352 0.61960 0.66601 -0.03604 -0.03887 0.09639 134 ILE A N 2575 C CA . ILE A 134 ? 0.65483 0.64107 0.73174 -0.04096 -0.06758 0.10218 134 ILE A CA 2576 C C . ILE A 134 ? 0.65243 0.65222 0.76043 -0.04620 -0.07431 0.13983 134 ILE A C 2577 O O . ILE A 134 ? 0.63004 0.60516 0.77795 -0.05841 -0.10380 0.16522 134 ILE A O 2578 C CB . ILE A 134 ? 0.64478 0.61132 0.67842 -0.02779 -0.07229 0.07397 134 ILE A CB 2579 C CG1 . ILE A 134 ? 0.71246 0.67417 0.72972 -0.02160 -0.06682 0.05040 134 ILE A CG1 2580 C CG2 . ILE A 134 ? 0.71869 0.64107 0.74475 -0.02271 -0.10588 0.07703 134 ILE A CG2 2581 C CD1 . ILE A 134 ? 0.66488 0.62948 0.65104 -0.00553 -0.06334 0.03529 134 ILE A CD1 2593 N N . SER A 135 ? 0.61018 0.64915 0.70491 -0.03565 -0.05123 0.14694 135 SER A N 2594 C CA . SER A 135 ? 0.67411 0.73354 0.79771 -0.03698 -0.05447 0.18708 135 SER A CA 2595 C C . SER A 135 ? 0.64325 0.73465 0.83255 -0.04688 -0.05429 0.24076 135 SER A C 2596 O O . SER A 135 ? 0.69643 0.79390 0.93561 -0.05682 -0.07175 0.28578 135 SER A O 2597 C CB . SER A 135 ? 0.68239 0.78279 0.77185 -0.01621 -0.02665 0.18289 135 SER A CB 2598 O OG . SER A 135 ? 0.74072 0.89080 0.82762 0.00149 0.00160 0.19348 135 SER A OG 2604 N N . GLN A 136 ? 0.64307 0.75676 0.84068 -0.04479 -0.03748 0.24176 136 GLN A N 2605 C CA . GLN A 136 ? 0.69483 0.84902 0.95916 -0.05144 -0.03343 0.29832 136 GLN A CA 2606 C C . GLN A 136 ? 0.72121 0.82594 1.03915 -0.07947 -0.07585 0.31093 136 GLN A C 2607 O O . GLN A 136 ? 0.74461 0.87951 1.13382 -0.09056 -0.08037 0.36462 136 GLN A O 2608 C CB . GLN A 136 ? 0.81254 1.01221 1.05594 -0.03073 0.00206 0.29202 136 GLN A CB 2609 C CG . GLN A 136 ? 0.88992 1.14476 1.08840 0.00730 0.03701 0.29236 136 GLN A CG 2610 C CD . GLN A 136 ? 1.15880 1.44472 1.32469 0.03578 0.06174 0.27655 136 GLN A CD 2611 O OE1 . GLN A 136 ? 1.03779 1.29618 1.20518 0.02264 0.05428 0.25225 136 GLN A OE1 2612 N NE2 . GLN A 136 ? 1.52826 1.86942 1.65913 0.08033 0.08861 0.28847 136 GLN A NE2 2621 N N . GLY A 137 ? 0.74098 0.77298 1.02614 -0.08604 -0.10868 0.26530 137 GLY A N 2622 C CA . GLY A 137 ? 0.70648 0.67801 1.02789 -0.10308 -0.15886 0.26805 137 GLY A CA 2623 C C . GLY A 137 ? 0.70002 0.64770 1.00178 -0.10287 -0.15901 0.23548 137 GLY A C 2624 O O . GLY A 137 ? 0.81167 0.71083 1.14555 -0.11394 -0.20223 0.23982 137 GLY A O 2628 N N . THR A 138 ? 0.64096 0.61732 0.89391 -0.08986 -0.11772 0.20359 138 THR A N 2629 C CA . THR A 138 ? 0.71864 0.67870 0.95442 -0.08926 -0.11421 0.17479 138 THR A CA 2630 C C . THR A 138 ? 0.69528 0.62043 0.86592 -0.07382 -0.11639 0.12432 138 THR A C 2631 O O . THR A 138 ? 0.70103 0.64168 0.83619 -0.06281 -0.09873 0.10943 138 THR A O 2632 C CB . THR A 138 ? 0.70798 0.72674 0.94445 -0.08386 -0.07151 0.18082 138 THR A CB 2633 O OG1 . THR A 138 ? 0.77638 0.83724 1.07638 -0.09157 -0.06682 0.23614 138 THR A OG1 2634 C CG2 . THR A 138 ? 0.72087 0.72213 0.93659 -0.08336 -0.06740 0.14764 138 THR A CG2 2642 N N . ASN A 139 ? 0.67993 0.56197 0.83716 -0.06959 -0.13875 0.10258 139 ASN A N 2643 C CA . ASN A 139 ? 0.66760 0.53295 0.76799 -0.04815 -0.13441 0.06551 139 ASN A CA 2644 C C . ASN A 139 ? 0.58270 0.48505 0.67923 -0.05014 -0.09963 0.05431 139 ASN A C 2645 O O . ASN A 139 ? 0.58082 0.47890 0.69647 -0.05745 -0.10144 0.05565 139 ASN A O 2646 C CB . ASN A 139 ? 0.79171 0.59585 0.86958 -0.03044 -0.17588 0.04840 139 ASN A CB 2647 C CG . ASN A 139 ? 0.76113 0.56390 0.78027 0.00145 -0.16508 0.02042 139 ASN A CG 2648 O OD1 . ASN A 139 ? 0.74854 0.59734 0.75977 0.00151 -0.12790 0.01764 139 ASN A OD1 2649 N ND2 . ASN A 139 ? 0.98656 0.73779 0.96638 0.03315 -0.20129 0.00316 139 ASN A ND2 2656 N N . PRO A 140 ? 0.56501 0.50074 0.64295 -0.04492 -0.07313 0.04451 140 PRO A N 2657 C CA . PRO A 140 ? 0.52714 0.49133 0.61062 -0.04826 -0.05077 0.03547 140 PRO A CA 2658 C C . PRO A 140 ? 0.56615 0.51665 0.64371 -0.04225 -0.05454 0.02333 140 PRO A C 2659 O O . PRO A 140 ? 0.56103 0.52644 0.65395 -0.04923 -0.04345 0.01986 140 PRO A O 2660 C CB . PRO A 140 ? 0.59865 0.58752 0.66661 -0.04170 -0.03735 0.02730 140 PRO A CB 2661 C CG . PRO A 140 ? 0.64925 0.62334 0.69592 -0.03196 -0.04788 0.02880 140 PRO A CG 2662 C CD . PRO A 140 ? 0.61465 0.55963 0.67067 -0.03628 -0.06866 0.04208 140 PRO A CD 2670 N N . LEU A 141 ? 0.61207 0.53470 0.66403 -0.02396 -0.07135 0.01731 141 LEU A N 2671 C CA . LEU A 141 ? 0.66519 0.58081 0.70549 -0.00864 -0.07296 0.00959 141 LEU A CA 2672 C C . LEU A 141 ? 0.66411 0.55701 0.72341 -0.01935 -0.08516 0.00927 141 LEU A C 2673 O O . LEU A 141 ? 0.66701 0.56385 0.72506 -0.01233 -0.07963 0.00420 141 LEU A O 2674 C CB . LEU A 141 ? 0.68476 0.57619 0.67993 0.02758 -0.09014 0.00305 141 LEU A CB 2675 C CG . LEU A 141 ? 0.70388 0.62587 0.68183 0.04279 -0.07513 0.00814 141 LEU A CG 2676 C CD1 . LEU A 141 ? 0.84057 0.73392 0.76545 0.08523 -0.09611 0.00139 141 LEU A CD1 2677 C CD2 . LEU A 141 ? 0.69632 0.66876 0.69451 0.04445 -0.04883 0.01986 141 LEU A CD2 2689 N N . ASN A 142 ? 0.62914 0.50344 0.71311 -0.03632 -0.10169 0.02026 142 ASN A N 2690 C CA . ASN A 142 ? 0.70172 0.55527 0.81424 -0.04831 -0.11795 0.02675 142 ASN A CA 2691 C C . ASN A 142 ? 0.62831 0.52203 0.77923 -0.07066 -0.09226 0.04105 142 ASN A C 2692 O O . ASN A 142 ? 0.66374 0.54951 0.84660 -0.08255 -0.10227 0.05325 142 ASN A O 2693 C CB . ASN A 142 ? 0.78676 0.59641 0.91881 -0.05288 -0.16021 0.04045 142 ASN A CB 2694 C CG . ASN A 142 ? 0.90170 0.65532 0.98685 -0.02139 -0.19867 0.01972 142 ASN A CG 2695 O OD1 . ASN A 142 ? 0.93255 0.67651 0.97337 0.00764 -0.19684 -0.00177 142 ASN A OD1 2696 N ND2 . ASN A 142 ? 0.98450 0.70299 1.07778 -0.02165 -0.23510 0.02841 142 ASN A ND2 2703 N N . ILE A 143 ? 0.58483 0.51912 0.73173 -0.07224 -0.06383 0.04008 143 ILE A N 2704 C CA . ILE A 143 ? 0.51946 0.48892 0.68749 -0.08036 -0.04271 0.04795 143 ILE A CA 2705 C C . ILE A 143 ? 0.57070 0.53801 0.73962 -0.08134 -0.03759 0.03269 143 ILE A C 2706 O O . ILE A 143 ? 0.58568 0.55025 0.73775 -0.07406 -0.03552 0.01680 143 ILE A O 2707 C CB . ILE A 143 ? 0.55549 0.55693 0.70782 -0.07234 -0.02439 0.04376 143 ILE A CB 2708 C CG1 . ILE A 143 ? 0.58195 0.59320 0.73772 -0.07055 -0.02580 0.06499 143 ILE A CG1 2709 C CG2 . ILE A 143 ? 0.59794 0.62843 0.75457 -0.06715 -0.00828 0.04170 143 ILE A CG2 2710 C CD1 . ILE A 143 ? 0.62453 0.65565 0.75328 -0.05783 -0.01441 0.05426 143 ILE A CD1 2722 N N . ARG A 144 ? 0.52736 0.50125 0.72201 -0.08970 -0.03515 0.04341 144 ARG A N 2723 C CA . ARG A 144 ? 0.56090 0.53230 0.75921 -0.09170 -0.03105 0.03036 144 ARG A CA 2724 C C . ARG A 144 ? 0.53641 0.53515 0.72800 -0.08659 -0.01454 0.01775 144 ARG A C 2725 O O . ARG A 144 ? 0.51853 0.54081 0.70477 -0.07846 -0.00529 0.02291 144 ARG A O 2726 C CB . ARG A 144 ? 0.62703 0.59455 0.85761 -0.10196 -0.03730 0.04796 144 ARG A CB 2727 C CG . ARG A 144 ? 0.84747 0.77731 1.09430 -0.10755 -0.06846 0.06186 144 ARG A CG 2728 C CD . ARG A 144 ? 1.18216 1.07005 1.42761 -0.10598 -0.09247 0.04967 144 ARG A CD 2729 N NE . ARG A 144 ? 1.40457 1.29850 1.69483 -0.12092 -0.09688 0.07032 144 ARG A NE 2730 C CZ . ARG A 144 ? 1.61500 1.51152 1.90814 -0.12264 -0.08849 0.06054 144 ARG A CZ 2731 N NH1 . ARG A 144 ? 1.53710 1.42004 1.79541 -0.11033 -0.08448 0.03257 144 ARG A NH1 2732 N NH2 . ARG A 144 ? 1.68572 1.60322 2.02224 -0.13534 -0.08415 0.08499 144 ARG A NH2 2746 N N . PRO A 145 ? 0.49942 0.49429 0.69136 -0.08707 -0.01509 0.00244 145 PRO A N 2747 C CA . PRO A 145 ? 0.46451 0.47381 0.65661 -0.08239 -0.01300 -0.01087 145 PRO A CA 2748 C C . PRO A 145 ? 0.48267 0.50457 0.67699 -0.07648 -0.00621 -0.00983 145 PRO A C 2749 O O . PRO A 145 ? 0.53643 0.55845 0.74562 -0.08295 -0.00156 0.00284 145 PRO A O 2750 C CB . PRO A 145 ? 0.56329 0.56687 0.77135 -0.08789 -0.01907 -0.01661 145 PRO A CB 2751 C CG . PRO A 145 ? 0.56433 0.55411 0.77306 -0.09031 -0.01792 -0.00909 145 PRO A CG 2752 C CD . PRO A 145 ? 0.54058 0.51853 0.73360 -0.08713 -0.02144 -0.00104 145 PRO A CD 2760 N N . LYS A 146 ? 0.42948 0.64518 0.57410 -0.04122 -0.07365 -0.06888 146 LYS A N 2761 C CA A LYS A 146 ? 0.47471 0.70568 0.64041 -0.04327 -0.06890 -0.06176 146 LYS A CA 2762 C CA B LYS A 146 ? 0.47458 0.70584 0.64021 -0.04312 -0.06905 -0.06180 146 LYS A CA 2763 C C . LYS A 146 ? 0.44123 0.66877 0.59616 -0.03305 -0.05941 -0.04926 146 LYS A C 2764 O O . LYS A 146 ? 0.47363 0.68151 0.60948 -0.02970 -0.05299 -0.04469 146 LYS A O 2765 C CB A LYS A 146 ? 0.49280 0.71680 0.67755 -0.05721 -0.06164 -0.06068 146 LYS A CB 2766 C CB B LYS A 146 ? 0.49302 0.71758 0.67797 -0.05729 -0.06243 -0.06133 146 LYS A CB 2767 C CG A LYS A 146 ? 0.51308 0.72426 0.70319 -0.06916 -0.06805 -0.07068 146 LYS A CG 2768 C CG B LYS A 146 ? 0.49151 0.68797 0.66222 -0.05978 -0.05183 -0.05541 146 LYS A CG 2769 C CD A LYS A 146 ? 0.53259 0.76507 0.74748 -0.07746 -0.07922 -0.08017 146 LYS A CD 2770 C CD B LYS A 146 ? 0.61519 0.80195 0.80133 -0.07494 -0.04743 -0.05461 146 LYS A CD 2771 C CE A LYS A 146 ? 0.50282 0.71963 0.71866 -0.08640 -0.08929 -0.09307 146 LYS A CE 2772 C CE B LYS A 146 ? 0.65252 0.81120 0.82227 -0.07591 -0.03824 -0.04785 146 LYS A CE 2773 N NZ A LYS A 146 ? 0.41632 0.60071 0.62176 -0.09148 -0.08166 -0.08913 146 LYS A NZ 2774 N NZ B LYS A 146 ? 0.78971 0.94652 0.97098 -0.08600 -0.02737 -0.03868 146 LYS A NZ 2801 N N . ALA A 147 ? 0.42359 0.67042 0.59277 -0.02803 -0.05917 -0.04457 147 ALA A N 2802 C CA . ALA A 147 ? 0.40214 0.64436 0.56574 -0.01895 -0.05034 -0.03393 147 ALA A CA 2803 C C . ALA A 147 ? 0.43055 0.66912 0.60749 -0.02595 -0.03798 -0.03087 147 ALA A C 2804 O O . ALA A 147 ? 0.45393 0.70863 0.65374 -0.03414 -0.03747 -0.03430 147 ALA A O 2805 C CB . ALA A 147 ? 0.46923 0.73248 0.64091 -0.00777 -0.05708 -0.03075 147 ALA A CB 2811 N N . VAL A 148 ? 0.38540 0.60434 0.54806 -0.02329 -0.02806 -0.02441 148 VAL A N 2812 C CA . VAL A 148 ? 0.41689 0.63082 0.58661 -0.02968 -0.01603 -0.02136 148 VAL A CA 2813 C C . VAL A 148 ? 0.44402 0.64557 0.60091 -0.02040 -0.00803 -0.01472 148 VAL A C 2814 O O . VAL A 148 ? 0.43758 0.62529 0.57657 -0.01325 -0.01058 -0.01188 148 VAL A O 2815 C CB . VAL A 148 ? 0.50318 0.69884 0.66720 -0.04222 -0.01381 -0.02330 148 VAL A CB 2816 C CG1 . VAL A 148 ? 0.51554 0.68897 0.65576 -0.03847 -0.01712 -0.02393 148 VAL A CG1 2817 C CG2 . VAL A 148 ? 0.64893 0.83772 0.81502 -0.04835 -0.00126 -0.01785 148 VAL A CG2 2827 N N . GLU A 149 ? 0.43418 0.64144 0.60052 -0.02104 0.00193 -0.01264 149 GLU A N 2828 C CA . GLU A 149 ? 0.45041 0.64483 0.60497 -0.01278 0.00926 -0.00843 149 GLU A CA 2829 C C . GLU A 149 ? 0.43173 0.60174 0.56812 -0.01910 0.01521 -0.00607 149 GLU A C 2830 O O . GLU A 149 ? 0.44592 0.61426 0.58526 -0.02999 0.01980 -0.00606 149 GLU A O 2831 C CB . GLU A 149 ? 0.54704 0.75957 0.71796 -0.00899 0.01744 -0.00912 149 GLU A CB 2832 C CG . GLU A 149 ? 0.72191 0.92661 0.88580 0.00481 0.01963 -0.00754 149 GLU A CG 2833 C CD . GLU A 149 ? 0.93253 1.16043 1.11689 0.01562 0.01821 -0.01032 149 GLU A CD 2834 O OE1 . GLU A 149 ? 0.91792 1.13842 1.09867 0.02845 0.01383 -0.00887 149 GLU A OE1 2835 O OE2 . GLU A 149 ? 0.89071 1.14427 1.09612 0.01118 0.02113 -0.01379 149 GLU A OE2 2842 N N . LYS A 150 ? 0.43788 0.58919 0.55644 -0.01249 0.01464 -0.00340 150 LYS A N 2843 C CA . LYS A 150 ? 0.43841 0.56757 0.54011 -0.01625 0.01914 -0.00143 150 LYS A CA 2844 C C . LYS A 150 ? 0.45641 0.57472 0.54843 -0.00771 0.02334 0.00092 150 LYS A C 2845 O O . LYS A 150 ? 0.46058 0.58264 0.55562 0.00157 0.02048 0.00172 150 LYS A O 2846 C CB . LYS A 150 ? 0.45551 0.57124 0.54478 -0.01837 0.01240 -0.00228 150 LYS A CB 2847 C CG . LYS A 150 ? 0.50685 0.62990 0.60382 -0.02572 0.00614 -0.00687 150 LYS A CG 2848 C CD . LYS A 150 ? 0.51033 0.62522 0.60967 -0.03676 0.00969 -0.00725 150 LYS A CD 2849 C CE . LYS A 150 ? 0.58419 0.69593 0.68571 -0.04303 0.00140 -0.01305 150 LYS A CE 2850 N NZ . LYS A 150 ? 0.59762 0.70762 0.71016 -0.05533 0.00316 -0.01290 150 LYS A NZ 2864 N N . ILE A 151 ? 0.42590 0.52918 0.50600 -0.01095 0.02890 0.00203 151 ILE A N 2865 C CA . ILE A 151 ? 0.44473 0.53258 0.51230 -0.00462 0.03049 0.00311 151 ILE A CA 2866 C C . ILE A 151 ? 0.43766 0.51015 0.49305 -0.00609 0.02514 0.00458 151 ILE A C 2867 O O . ILE A 151 ? 0.44065 0.50593 0.49049 -0.01280 0.02467 0.00422 151 ILE A O 2868 C CB . ILE A 151 ? 0.46088 0.54298 0.52107 -0.00675 0.03867 0.00277 151 ILE A CB 2869 C CG1 . ILE A 151 ? 0.60240 0.70409 0.67492 -0.00646 0.04596 0.00090 151 ILE A CG1 2870 C CG2 . ILE A 151 ? 0.43940 0.50600 0.48794 0.00009 0.03843 0.00209 151 ILE A CG2 2871 C CD1 . ILE A 151 ? 0.61433 0.72663 0.69732 0.00467 0.04557 -0.00240 151 ILE A CD1 2883 N N . VAL A 152 ? 0.41889 0.48657 0.47090 0.00012 0.02114 0.00650 152 VAL A N 2884 C CA . VAL A 152 ? 0.42245 0.47984 0.46439 -0.00106 0.01730 0.00805 152 VAL A CA 2885 C C . VAL A 152 ? 0.45955 0.50124 0.49244 0.00038 0.01958 0.00877 152 VAL A C 2886 O O . VAL A 152 ? 0.46697 0.50499 0.50133 0.00543 0.02106 0.00912 152 VAL A O 2887 C CB . VAL A 152 ? 0.42876 0.49274 0.47203 0.00304 0.01170 0.01136 152 VAL A CB 2888 C CG1 . VAL A 152 ? 0.46441 0.52197 0.49750 0.00117 0.00946 0.01270 152 VAL A CG1 2889 C CG2 . VAL A 152 ? 0.44874 0.52943 0.50085 0.00221 0.00816 0.00944 152 VAL A CG2 2899 N N . PHE A 153 ? 0.42781 0.46042 0.45246 -0.00361 0.01903 0.00786 153 PHE A N 2900 C CA . PHE A 153 ? 0.44637 0.46541 0.46279 -0.00326 0.01975 0.00763 153 PHE A CA 2901 C C . PHE A 153 ? 0.44625 0.46308 0.46011 -0.00327 0.01614 0.00922 153 PHE A C 2902 O O . PHE A 153 ? 0.44209 0.46411 0.45545 -0.00531 0.01403 0.00805 153 PHE A O 2903 C CB . PHE A 153 ? 0.44770 0.46010 0.45777 -0.00759 0.02155 0.00576 153 PHE A CB 2904 C CG . PHE A 153 ? 0.47570 0.47526 0.47662 -0.00726 0.02030 0.00500 153 PHE A CG 2905 C CD1 . PHE A 153 ? 0.47157 0.46775 0.47094 -0.00753 0.01629 0.00446 153 PHE A CD1 2906 C CD2 . PHE A 153 ? 0.51811 0.51118 0.51192 -0.00650 0.02308 0.00411 153 PHE A CD2 2907 C CE1 . PHE A 153 ? 0.49319 0.47990 0.48656 -0.00701 0.01427 0.00324 153 PHE A CE1 2908 C CE2 . PHE A 153 ? 0.48622 0.46856 0.47142 -0.00594 0.02052 0.00287 153 PHE A CE2 2909 C CZ . PHE A 153 ? 0.53008 0.50917 0.51612 -0.00628 0.01570 0.00250 153 PHE A CZ 2919 N N . PHE A 154 ? 0.42214 0.43223 0.43524 -0.00120 0.01552 0.01135 154 PHE A N 2920 C CA . PHE A 154 ? 0.43055 0.43974 0.44243 -0.00258 0.01343 0.01359 154 PHE A CA 2921 C C . PHE A 154 ? 0.52484 0.52254 0.53407 -0.00324 0.01292 0.01159 154 PHE A C 2922 O O . PHE A 154 ? 0.50231 0.49196 0.51180 -0.00113 0.01320 0.01066 154 PHE A O 2923 C CB . PHE A 154 ? 0.46086 0.47338 0.47659 -0.00116 0.01214 0.02020 154 PHE A CB 2924 C CG . PHE A 154 ? 0.47713 0.50312 0.49210 -0.00164 0.01109 0.02311 154 PHE A CG 2925 C CD1 . PHE A 154 ? 0.55006 0.58514 0.56639 -0.00019 0.01024 0.02126 154 PHE A CD1 2926 C CD2 . PHE A 154 ? 0.58241 0.61389 0.59542 -0.00377 0.01099 0.02720 154 PHE A CD2 2927 C CE1 . PHE A 154 ? 0.59130 0.63946 0.60544 -0.00012 0.00816 0.02252 154 PHE A CE1 2928 C CE2 . PHE A 154 ? 0.57918 0.62507 0.58880 -0.00356 0.01031 0.02913 154 PHE A CE2 2929 C CZ . PHE A 154 ? 0.54892 0.60239 0.55829 -0.00137 0.00833 0.02624 154 PHE A CZ 2939 N N . SER A 155 ? 0.44244 0.44032 0.44993 -0.00538 0.01148 0.00986 155 SER A N 2940 C CA A SER A 155 ? 0.44338 0.43303 0.45032 -0.00618 0.00947 0.00793 155 SER A CA 2941 C CA B SER A 155 ? 0.44637 0.43605 0.45334 -0.00618 0.00948 0.00795 155 SER A CA 2942 C C . SER A 155 ? 0.52726 0.52471 0.53914 -0.00860 0.00842 0.00951 155 SER A C 2943 O O . SER A 155 ? 0.51697 0.52451 0.52881 -0.00856 0.00903 0.00856 155 SER A O 2944 C CB A SER A 155 ? 0.46087 0.44327 0.46051 -0.00558 0.00827 0.00308 155 SER A CB 2945 C CB B SER A 155 ? 0.46037 0.44295 0.46013 -0.00560 0.00828 0.00313 155 SER A CB 2946 O OG A SER A 155 ? 0.46852 0.45436 0.46661 -0.00601 0.00703 0.00123 155 SER A OG 2947 O OG B SER A 155 ? 0.52053 0.49546 0.51910 -0.00559 0.00519 0.00061 155 SER A OG 2958 N N . ASP A 156 ? 0.44800 0.44174 0.46500 -0.01083 0.00687 0.01114 156 ASP A N 2959 C CA . ASP A 156 ? 0.44450 0.44874 0.46876 -0.01454 0.00720 0.01426 156 ASP A CA 2960 C C . ASP A 156 ? 0.46367 0.46269 0.49373 -0.01713 0.00366 0.01138 156 ASP A C 2961 O O . ASP A 156 ? 0.47681 0.46272 0.50708 -0.01735 0.00102 0.01029 156 ASP A O 2962 C CB . ASP A 156 ? 0.46313 0.47110 0.49061 -0.01679 0.00935 0.02352 156 ASP A CB 2963 C CG . ASP A 156 ? 0.47867 0.50015 0.51264 -0.02193 0.01145 0.02934 156 ASP A CG 2964 O OD1 . ASP A 156 ? 0.46109 0.48315 0.50311 -0.02610 0.01028 0.02873 156 ASP A OD1 2965 O OD2 . ASP A 156 ? 0.52434 0.55739 0.55540 -0.02213 0.01440 0.03521 156 ASP A OD2 2970 N N . ILE A 157 ? 0.44561 0.45600 0.48115 -0.01844 0.00302 0.00878 157 ILE A N 2971 C CA . ILE A 157 ? 0.45677 0.46586 0.50037 -0.02112 -0.00133 0.00538 157 ILE A CA 2972 C C . ILE A 157 ? 0.47042 0.47831 0.52471 -0.02813 -0.00124 0.01167 157 ILE A C 2973 O O . ILE A 157 ? 0.44523 0.46307 0.50430 -0.03224 0.00324 0.01993 157 ILE A O 2974 C CB . ILE A 157 ? 0.41722 0.44247 0.46720 -0.01999 -0.00193 0.00093 157 ILE A CB 2975 C CG1 . ILE A 157 ? 0.46466 0.48563 0.50452 -0.01300 -0.00396 -0.00510 157 ILE A CG1 2976 C CG2 . ILE A 157 ? 0.47769 0.50594 0.53992 -0.02352 -0.00695 -0.00230 157 ILE A CG2 2977 C CD1 . ILE A 157 ? 0.45829 0.49344 0.50443 -0.00953 -0.00525 -0.01057 157 ILE A CD1 2989 N N . VAL A 158 ? 0.45949 0.45466 0.51718 -0.02984 -0.00680 0.00789 158 VAL A N 2990 C CA . VAL A 158 ? 0.46176 0.45205 0.53187 -0.03742 -0.00874 0.01257 158 VAL A CA 2991 C C . VAL A 158 ? 0.45631 0.46456 0.54222 -0.04451 -0.00851 0.01411 158 VAL A C 2992 O O . VAL A 158 ? 0.48976 0.50535 0.57945 -0.04288 -0.01238 0.00621 158 VAL A O 2993 C CB . VAL A 158 ? 0.48983 0.46020 0.55822 -0.03615 -0.01591 0.00516 158 VAL A CB 2994 C CG1 . VAL A 158 ? 0.53207 0.49449 0.61515 -0.04457 -0.01920 0.00940 158 VAL A CG1 2995 C CG2 . VAL A 158 ? 0.52446 0.48157 0.57799 -0.02841 -0.01466 0.00278 158 VAL A CG2 3005 N N . SER A 159 ? 0.45455 0.47144 0.54987 -0.05226 -0.00385 0.02499 159 SER A N 3006 C CA A SER A 159 ? 0.48946 0.52530 0.60265 -0.06129 -0.00230 0.02834 159 SER A CA 3007 C CA B SER A 159 ? 0.49103 0.52700 0.60422 -0.06131 -0.00223 0.02844 159 SER A CA 3008 C C . SER A 159 ? 0.51915 0.57935 0.63430 -0.05689 0.00049 0.02186 159 SER A C 3009 O O . SER A 159 ? 0.54162 0.61584 0.67176 -0.06023 -0.00192 0.01725 159 SER A O 3010 C CB A SER A 159 ? 0.53074 0.55593 0.65805 -0.06784 -0.01054 0.02391 159 SER A CB 3011 C CB B SER A 159 ? 0.53387 0.55938 0.66141 -0.06807 -0.01034 0.02429 159 SER A CB 3012 O OG A SER A 159 ? 0.70612 0.74471 0.85302 -0.08036 -0.00811 0.03249 159 SER A OG 3013 O OG B SER A 159 ? 0.61359 0.64066 0.74060 -0.06248 -0.01688 0.01118 159 SER A OG 3024 N N . PHE A 160 ? 0.48593 0.55162 0.58744 -0.04904 0.00490 0.02077 160 PHE A N 3025 C CA . PHE A 160 ? 0.44690 0.53416 0.55047 -0.04362 0.00717 0.01378 160 PHE A CA 3026 C C . PHE A 160 ? 0.51354 0.62970 0.63310 -0.05052 0.01356 0.01821 160 PHE A C 3027 O O . PHE A 160 ? 0.51499 0.65063 0.64480 -0.04744 0.01326 0.01027 160 PHE A O 3028 C CB . PHE A 160 ? 0.47335 0.56076 0.56073 -0.03558 0.01078 0.01247 160 PHE A CB 3029 C CG . PHE A 160 ? 0.54731 0.65395 0.63652 -0.02876 0.01225 0.00383 160 PHE A CG 3030 C CD1 . PHE A 160 ? 0.62433 0.72407 0.71247 -0.02124 0.00542 -0.00656 160 PHE A CD1 3031 C CD2 . PHE A 160 ? 0.62213 0.75339 0.71352 -0.02925 0.01999 0.00594 160 PHE A CD2 3032 C CE1 . PHE A 160 ? 0.59749 0.71245 0.68865 -0.01369 0.00549 -0.01521 160 PHE A CE1 3033 C CE2 . PHE A 160 ? 0.61158 0.76051 0.70552 -0.02148 0.02089 -0.00429 160 PHE A CE2 3034 C CZ . PHE A 160 ? 0.56042 0.69989 0.65522 -0.01346 0.01317 -0.01507 160 PHE A CZ 3044 N N . SER A 161 ? 0.47378 0.59424 0.59578 -0.05950 0.01952 0.03125 161 SER A N 3045 C CA . SER A 161 ? 0.55163 0.70255 0.68710 -0.06715 0.02764 0.03754 161 SER A CA 3046 C C . SER A 161 ? 0.57746 0.74106 0.73601 -0.07288 0.02424 0.03237 161 SER A C 3047 O O . SER A 161 ? 0.56899 0.76429 0.74150 -0.07547 0.03029 0.03137 161 SER A O 3048 C CB . SER A 161 ? 0.66390 0.81168 0.79797 -0.07771 0.03288 0.05517 161 SER A CB 3049 O OG . SER A 161 ? 0.73076 0.87679 0.84508 -0.07201 0.03700 0.06004 161 SER A OG 3055 N N . THR A 162 ? 0.52038 0.66143 0.68351 -0.07445 0.01436 0.02803 162 THR A N 3056 C CA . THR A 162 ? 0.62036 0.77174 0.80575 -0.07989 0.00873 0.02200 162 THR A CA 3057 C C . THR A 162 ? 0.62786 0.79673 0.81695 -0.06886 0.00581 0.00793 162 THR A C 3058 O O . THR A 162 ? 0.57814 0.77518 0.78838 -0.07193 0.00713 0.00441 162 THR A O 3059 C CB . THR A 162 ? 0.72117 0.84173 0.90648 -0.08270 -0.00231 0.01922 162 THR A CB 3060 O OG1 . THR A 162 ? 0.65225 0.75822 0.83953 -0.09360 -0.00023 0.03230 162 THR A OG1 3061 C CG2 . THR A 162 ? 0.89219 1.02211 1.09892 -0.08676 -0.01083 0.01029 162 THR A CG2 3069 N N . PHE A 163 ? 0.53536 0.68775 0.70544 -0.05604 0.00135 0.00003 163 PHE A N 3070 C CA . PHE A 163 ? 0.50782 0.67283 0.67957 -0.04438 -0.00216 -0.01213 163 PHE A CA 3071 C C . PHE A 163 ? 0.45569 0.65590 0.63792 -0.04312 0.00765 -0.01275 163 PHE A C 3072 O O . PHE A 163 ? 0.53857 0.76332 0.73936 -0.04043 0.00623 -0.02056 163 PHE A O 3073 C CB . PHE A 163 ? 0.51186 0.65435 0.65985 -0.03252 -0.00560 -0.01684 163 PHE A CB 3074 C CG . PHE A 163 ? 0.53522 0.64715 0.67112 -0.03095 -0.01501 -0.01875 163 PHE A CG 3075 C CD1 . PHE A 163 ? 0.71411 0.80439 0.83810 -0.03556 -0.01356 -0.01170 163 PHE A CD1 3076 C CD2 . PHE A 163 ? 0.55172 0.65744 0.68687 -0.02367 -0.02533 -0.02781 163 PHE A CD2 3077 C CE1 . PHE A 163 ? 0.65523 0.72044 0.76735 -0.03309 -0.02112 -0.01491 163 PHE A CE1 3078 C CE2 . PHE A 163 ? 0.58769 0.66775 0.70892 -0.02195 -0.03316 -0.02954 163 PHE A CE2 3079 C CZ . PHE A 163 ? 0.59495 0.65572 0.70460 -0.02659 -0.03044 -0.02372 163 PHE A CZ 3089 N N . ALA A 164 ? 0.54209 0.74646 0.71214 -0.04425 0.01744 -0.00523 164 ALA A N 3090 C CA . ALA A 164 ? 0.52579 0.76360 0.70049 -0.04143 0.02748 -0.00697 164 ALA A CA 3091 C C . ALA A 164 ? 0.67017 0.94126 0.87014 -0.05188 0.03377 -0.00298 164 ALA A C 3092 O O . ALA A 164 ? 0.61254 0.91741 0.82356 -0.04736 0.03999 -0.00963 164 ALA A O 3093 C CB . ALA A 164 ? 0.53372 0.76841 0.68871 -0.04238 0.03577 0.00199 164 ALA A CB 3099 N N . GLU A 165 ? 0.63227 0.89517 0.84296 -0.06592 0.03223 0.00723 165 GLU A N 3100 C CA . GLU A 165 ? 0.73455 1.02895 0.97093 -0.07884 0.03884 0.01337 165 GLU A CA 3101 C C . GLU A 165 ? 0.68028 0.98975 0.94222 -0.07747 0.03080 0.00146 165 GLU A C 3102 O O . GLU A 165 ? 0.65470 1.00187 0.94068 -0.08307 0.03726 0.00099 165 GLU A O 3103 C CB . GLU A 165 ? 0.87022 1.14792 1.10912 -0.09583 0.03996 0.03037 165 GLU A CB 3104 C CG . GLU A 165 ? 1.16059 1.45739 1.39582 -0.10556 0.05408 0.04683 165 GLU A CG 3105 C CD . GLU A 165 ? 1.60927 1.95420 1.86752 -0.11200 0.06480 0.04748 165 GLU A CD 3106 O OE1 . GLU A 165 ? 1.61278 1.98554 1.86265 -0.10496 0.07525 0.04521 165 GLU A OE1 3107 O OE2 . GLU A 165 ? 1.56031 1.91674 1.84579 -0.12403 0.06274 0.04936 165 GLU A OE2 3114 N N . LYS A 166 ? 0.59750 0.88053 0.85457 -0.06976 0.01688 -0.00819 166 LYS A N 3115 C CA . LYS A 166 ? 0.62581 0.91775 0.90573 -0.06987 0.00632 -0.01790 166 LYS A CA 3116 C C . LYS A 166 ? 0.66854 0.96888 0.94919 -0.05218 -0.00091 -0.03377 166 LYS A C 3117 O O . LYS A 166 ? 0.63960 0.95881 0.94356 -0.05097 -0.00808 -0.04225 166 LYS A O 3118 C CB . LYS A 166 ? 0.73937 0.99523 1.01410 -0.07515 -0.00622 -0.01703 166 LYS A CB 3119 C CG . LYS A 166 ? 0.95339 1.19573 1.23031 -0.09213 -0.00225 -0.00257 166 LYS A CG 3120 C CD . LYS A 166 ? 1.16644 1.43980 1.47573 -0.10838 0.00274 0.00356 166 LYS A CD 3121 C CE . LYS A 166 ? 1.23138 1.48956 1.54156 -0.12550 0.00759 0.02063 166 LYS A CE 3122 N NZ . LYS A 166 ? 1.31328 1.55859 1.64406 -0.13855 -0.00336 0.01997 166 LYS A NZ 3136 N N . LEU A 167 ? 0.48256 0.76887 0.73981 -0.03867 -0.00025 -0.03789 167 LEU A N 3137 C CA . LEU A 167 ? 0.42389 0.70848 0.67850 -0.02150 -0.00924 -0.05160 167 LEU A CA 3138 C C . LEU A 167 ? 0.42001 0.73285 0.67801 -0.01118 -0.00043 -0.05861 167 LEU A C 3139 O O . LEU A 167 ? 0.44818 0.77121 0.69793 -0.01512 0.01227 -0.05232 167 LEU A O 3140 C CB . LEU A 167 ? 0.48331 0.72603 0.70844 -0.01367 -0.01704 -0.05180 167 LEU A CB 3141 C CG . LEU A 167 ? 0.60990 0.82157 0.82587 -0.01987 -0.02655 -0.04780 167 LEU A CG 3142 C CD1 . LEU A 167 ? 0.61404 0.79054 0.80043 -0.01189 -0.03080 -0.04739 167 LEU A CD1 3143 C CD2 . LEU A 167 ? 0.63131 0.85064 0.86547 -0.01835 -0.03928 -0.05585 167 LEU A CD2 3155 N N . PRO A 168 ? 0.41679 0.74207 0.68589 0.00312 -0.00771 -0.07225 168 PRO A N 3156 C CA . PRO A 168 ? 0.45570 0.80163 0.72477 0.01605 -0.00122 -0.08181 168 PRO A CA 3157 C C . PRO A 168 ? 0.44945 0.76545 0.68787 0.02209 0.00004 -0.08036 168 PRO A C 3158 O O . PRO A 168 ? 0.41444 0.69263 0.63347 0.02130 -0.00759 -0.07545 168 PRO A O 3159 C CB . PRO A 168 ? 0.46296 0.81690 0.74851 0.03140 -0.01388 -0.09646 168 PRO A CB 3160 C CG . PRO A 168 ? 0.53893 0.89392 0.84162 0.02287 -0.02309 -0.09376 168 PRO A CG 3161 C CD . PRO A 168 ? 0.46299 0.78379 0.74490 0.00945 -0.02333 -0.08039 168 PRO A CD 3169 N N A VAL A 169 ? 0.41882 0.75430 0.65362 0.02823 0.00985 -0.08556 169 VAL A N 3170 N N B VAL A 169 ? 0.41917 0.75469 0.65407 0.02843 0.00974 -0.08575 169 VAL A N 3171 C CA A VAL A 169 ? 0.42676 0.73902 0.63451 0.03171 0.01234 -0.08399 169 VAL A CA 3172 C CA B VAL A 169 ? 0.42689 0.73935 0.63475 0.03180 0.01235 -0.08409 169 VAL A CA 3173 C C A VAL A 169 ? 0.42125 0.69550 0.61513 0.04254 -0.00150 -0.08960 169 VAL A C 3174 C C B VAL A 169 ? 0.42168 0.69603 0.61557 0.04255 -0.00146 -0.08962 169 VAL A C 3175 O O A VAL A 169 ? 0.42216 0.66506 0.59423 0.03935 -0.00323 -0.08267 169 VAL A O 3176 O O B VAL A 169 ? 0.42455 0.66757 0.59665 0.03928 -0.00317 -0.08262 169 VAL A O 3177 C CB A VAL A 169 ? 0.45380 0.79692 0.66193 0.03899 0.02315 -0.09271 169 VAL A CB 3178 C CB B VAL A 169 ? 0.45303 0.79607 0.66104 0.03913 0.02313 -0.09282 169 VAL A CB 3179 C CG1 A VAL A 169 ? 0.40435 0.72303 0.58837 0.04701 0.02110 -0.09708 169 VAL A CG1 3180 C CG1 B VAL A 169 ? 0.45533 0.83990 0.67780 0.02790 0.03760 -0.08601 169 VAL A CG1 3181 C CG2 A VAL A 169 ? 0.50923 0.88224 0.72053 0.02512 0.03860 -0.08134 169 VAL A CG2 3182 C CG2 B VAL A 169 ? 0.39610 0.74960 0.61642 0.05762 0.01610 -0.11182 169 VAL A CG2 3201 N N . GLU A 170 ? 0.45456 0.73162 0.66129 0.05551 -0.01159 -0.10159 170 GLU A N 3202 C CA . GLU A 170 ? 0.45238 0.69255 0.64527 0.06546 -0.02490 -0.10512 170 GLU A CA 3203 C C . GLU A 170 ? 0.48757 0.69526 0.66699 0.05672 -0.03200 -0.09341 170 GLU A C 3204 O O . GLU A 170 ? 0.51174 0.68613 0.67097 0.05864 -0.03732 -0.09015 170 GLU A O 3205 C CB . GLU A 170 ? 0.50737 0.75633 0.71804 0.08104 -0.03586 -0.11854 170 GLU A CB 3206 C CG . GLU A 170 ? 0.75166 1.02776 0.97316 0.09309 -0.03041 -0.13305 170 GLU A CG 3207 C CD . GLU A 170 ? 1.07528 1.33260 1.29738 0.11112 -0.04390 -0.14522 170 GLU A CD 3208 O OE1 . GLU A 170 ? 1.37175 1.62838 1.60801 0.11907 -0.05599 -0.14908 170 GLU A OE1 3209 O OE2 . GLU A 170 ? 0.97327 1.21617 1.18261 0.11782 -0.04355 -0.15136 170 GLU A OE2 3217 N N . GLU A 171 ? 0.46407 0.68177 0.65491 0.04693 -0.03217 -0.08763 171 GLU A N 3218 C CA A GLU A 171 ? 0.45325 0.64174 0.63098 0.03961 -0.03910 -0.07874 171 GLU A CA 3219 C CA B GLU A 171 ? 0.45204 0.64106 0.63017 0.03939 -0.03901 -0.07868 171 GLU A CA 3220 C C . GLU A 171 ? 0.52396 0.69605 0.68291 0.02862 -0.03039 -0.06765 171 GLU A C 3221 O O . GLU A 171 ? 0.48596 0.62764 0.62616 0.02711 -0.03509 -0.06240 171 GLU A O 3222 C CB A GLU A 171 ? 0.56639 0.77013 0.76354 0.03292 -0.04364 -0.07817 171 GLU A CB 3223 C CB B GLU A 171 ? 0.56511 0.77064 0.76317 0.03216 -0.04280 -0.07789 171 GLU A CB 3224 C CG A GLU A 171 ? 0.67069 0.87799 0.88032 0.04443 -0.05796 -0.08741 171 GLU A CG 3225 C CG B GLU A 171 ? 0.76932 0.95677 0.96526 0.03726 -0.05876 -0.08037 171 GLU A CG 3226 C CD A GLU A 171 ? 0.83150 1.02300 1.03832 0.03952 -0.06943 -0.08413 171 GLU A CD 3227 C CD B GLU A 171 ? 0.80172 1.01633 1.02554 0.03544 -0.06467 -0.08562 171 GLU A CD 3228 O OE1 A GLU A 171 ? 0.83764 0.99590 1.02023 0.04140 -0.07598 -0.07986 171 GLU A OE1 3229 O OE1 B GLU A 171 ? 0.69719 0.91877 0.92967 0.02182 -0.06176 -0.08044 171 GLU A OE1 3230 O OE2 A GLU A 171 ? 0.84713 1.06076 1.07613 0.03345 -0.07180 -0.08620 171 GLU A OE2 3231 O OE2 B GLU A 171 ? 0.78306 1.01194 1.02161 0.04767 -0.07285 -0.09521 171 GLU A OE2 3244 N N . VAL A 172 ? 0.42314 0.61596 0.58649 0.02144 -0.01779 -0.06373 172 VAL A N 3245 C CA . VAL A 172 ? 0.41791 0.59629 0.56400 0.01275 -0.01032 -0.05329 172 VAL A CA 3246 C C . VAL A 172 ? 0.42444 0.57966 0.54993 0.02001 -0.01214 -0.05517 172 VAL A C 3247 O O . VAL A 172 ? 0.42845 0.55832 0.53762 0.01607 -0.01330 -0.04835 172 VAL A O 3248 C CB . VAL A 172 ? 0.42683 0.63382 0.58029 0.00527 0.00293 -0.04834 172 VAL A CB 3249 C CG1 . VAL A 172 ? 0.42888 0.61972 0.56368 -0.00197 0.00896 -0.03727 172 VAL A CG1 3250 C CG2 . VAL A 172 ? 0.47334 0.70349 0.64944 -0.00445 0.00526 -0.04479 172 VAL A CG2 3260 N N . VAL A 173 ? 0.39882 0.56377 0.52620 0.03049 -0.01216 -0.06510 173 VAL A N 3261 C CA . VAL A 173 ? 0.40545 0.54854 0.51594 0.03647 -0.01471 -0.06774 173 VAL A CA 3262 C C . VAL A 173 ? 0.44897 0.56014 0.54998 0.03955 -0.02601 -0.06628 173 VAL A C 3263 O O . VAL A 173 ? 0.45711 0.54441 0.54168 0.03773 -0.02696 -0.06171 173 VAL A O 3264 C CB . VAL A 173 ? 0.45601 0.61587 0.57264 0.04785 -0.01384 -0.08097 173 VAL A CB 3265 C CG1 . VAL A 173 ? 0.51551 0.64985 0.61739 0.05386 -0.01894 -0.08507 173 VAL A CG1 3266 C CG2 . VAL A 173 ? 0.45476 0.64695 0.57539 0.04399 -0.00106 -0.08101 173 VAL A CG2 3276 N N . SER A 174 ? 0.47850 0.59020 0.58948 0.04367 -0.03463 -0.06933 174 SER A N 3277 C CA A SER A 174 ? 0.52278 0.60544 0.62225 0.04658 -0.04557 -0.06662 174 SER A CA 3278 C CA B SER A 174 ? 0.52373 0.60641 0.62324 0.04658 -0.04560 -0.06661 174 SER A CA 3279 C C . SER A 174 ? 0.53526 0.60017 0.61995 0.03624 -0.04346 -0.05593 174 SER A C 3280 O O . SER A 174 ? 0.50800 0.54765 0.57566 0.03631 -0.04676 -0.05147 174 SER A O 3281 C CB A SER A 174 ? 0.59848 0.68880 0.71197 0.05334 -0.05604 -0.07203 174 SER A CB 3282 C CB B SER A 174 ? 0.59729 0.68746 0.71068 0.05324 -0.05607 -0.07192 174 SER A CB 3283 O OG A SER A 174 ? 0.68617 0.74890 0.78590 0.05665 -0.06717 -0.06841 174 SER A OG 3284 O OG B SER A 174 ? 0.67969 0.74207 0.77957 0.05755 -0.06753 -0.06894 174 SER A OG 3295 N N . VAL A 175 ? 0.46257 0.54067 0.55427 0.02719 -0.03773 -0.05179 175 VAL A N 3296 C CA . VAL A 175 ? 0.47603 0.53784 0.55559 0.01861 -0.03602 -0.04351 175 VAL A CA 3297 C C . VAL A 175 ? 0.50073 0.55079 0.56558 0.01589 -0.02893 -0.03834 175 VAL A C 3298 O O . VAL A 175 ? 0.46040 0.48936 0.50994 0.01467 -0.03050 -0.03412 175 VAL A O 3299 C CB . VAL A 175 ? 0.49394 0.57130 0.58704 0.00945 -0.03222 -0.04063 175 VAL A CB 3300 C CG1 . VAL A 175 ? 0.54214 0.60217 0.62348 0.00157 -0.02959 -0.03314 175 VAL A CG1 3301 C CG2 . VAL A 175 ? 0.53878 0.62555 0.64647 0.01122 -0.04126 -0.04605 175 VAL A CG2 3311 N N . VAL A 176 ? 0.43919 0.50484 0.50845 0.01493 -0.02097 -0.03876 176 VAL A N 3312 C CA . VAL A 176 ? 0.40410 0.46065 0.46071 0.01206 -0.01530 -0.03398 176 VAL A CA 3313 C C . VAL A 176 ? 0.43001 0.46843 0.47571 0.01773 -0.01990 -0.03688 176 VAL A C 3314 O O . VAL A 176 ? 0.44709 0.46970 0.48080 0.01469 -0.01870 -0.03191 176 VAL A O 3315 C CB . VAL A 176 ? 0.45424 0.53273 0.51598 0.00988 -0.00658 -0.03345 176 VAL A CB 3316 C CG1 . VAL A 176 ? 0.56102 0.65362 0.62803 0.01802 -0.00689 -0.04334 176 VAL A CG1 3317 C CG2 . VAL A 176 ? 0.56671 0.63675 0.61634 0.00580 -0.00178 -0.02692 176 VAL A CG2 3327 N N . ASN A 177 ? 0.44225 0.48239 0.49328 0.02589 -0.02557 -0.04479 177 ASN A N 3328 C CA . ASN A 177 ? 0.46886 0.48867 0.51084 0.03044 -0.03109 -0.04664 177 ASN A CA 3329 C C . ASN A 177 ? 0.49710 0.49375 0.52746 0.02874 -0.03685 -0.04006 177 ASN A C 3330 O O . ASN A 177 ? 0.51046 0.48907 0.52945 0.02684 -0.03744 -0.03598 177 ASN A O 3331 C CB . ASN A 177 ? 0.52257 0.54774 0.57426 0.04078 -0.03712 -0.05724 177 ASN A CB 3332 C CG . ASN A 177 ? 0.47847 0.52351 0.53646 0.04350 -0.03111 -0.06526 177 ASN A CG 3333 O OD1 . ASN A 177 ? 0.50420 0.55768 0.55764 0.03731 -0.02305 -0.06162 177 ASN A OD1 3334 N ND2 . ASN A 177 ? 0.56873 0.62188 0.63673 0.05374 -0.03559 -0.07674 177 ASN A ND2 3341 N N . SER A 178 ? 0.50923 0.50759 0.54212 0.02888 -0.04104 -0.03900 178 SER A N 3342 C CA . SER A 178 ? 0.50187 0.48079 0.52081 0.02735 -0.04603 -0.03305 178 SER A CA 3343 C C . SER A 178 ? 0.52331 0.49558 0.53104 0.01946 -0.03852 -0.02623 178 SER A C 3344 O O . SER A 178 ? 0.52525 0.48092 0.51876 0.01789 -0.03900 -0.02105 178 SER A O 3345 C CB . SER A 178 ? 0.54659 0.53171 0.57114 0.02893 -0.05253 -0.03502 178 SER A CB 3346 O OG . SER A 178 ? 0.62561 0.61588 0.66044 0.03765 -0.06110 -0.04120 178 SER A OG 3352 N N . TYR A 179 ? 0.47741 0.46321 0.49207 0.01457 -0.03148 -0.02574 179 TYR A N 3353 C CA . TYR A 179 ? 0.46082 0.44171 0.46765 0.00867 -0.02477 -0.02027 179 TYR A CA 3354 C C . TYR A 179 ? 0.50337 0.47821 0.50387 0.00783 -0.02090 -0.01805 179 TYR A C 3355 O O . TYR A 179 ? 0.49018 0.45416 0.48020 0.00515 -0.01874 -0.01361 179 TYR A O 3356 C CB . TYR A 179 ? 0.47494 0.47080 0.49243 0.00437 -0.01936 -0.01950 179 TYR A CB 3357 C CG . TYR A 179 ? 0.47759 0.47011 0.49019 -0.00013 -0.01306 -0.01432 179 TYR A CG 3358 C CD1 . TYR A 179 ? 0.48262 0.46381 0.48759 -0.00183 -0.01343 -0.01239 179 TYR A CD1 3359 C CD2 . TYR A 179 ? 0.50110 0.50280 0.51660 -0.00163 -0.00732 -0.01219 179 TYR A CD2 3360 C CE1 . TYR A 179 ? 0.49972 0.47876 0.50241 -0.00433 -0.00818 -0.00871 179 TYR A CE1 3361 C CE2 . TYR A 179 ? 0.50344 0.50277 0.51585 -0.00456 -0.00285 -0.00738 179 TYR A CE2 3362 C CZ . TYR A 179 ? 0.50073 0.48856 0.50771 -0.00559 -0.00326 -0.00575 179 TYR A CZ 3363 O OH . TYR A 179 ? 0.55201 0.53837 0.55796 -0.00699 0.00077 -0.00183 179 TYR A OH 3373 N N . PHE A 180 ? 0.47721 0.46050 0.48461 0.01008 -0.02004 -0.02198 180 PHE A N 3374 C CA . PHE A 180 ? 0.46387 0.44226 0.46719 0.00871 -0.01765 -0.02130 180 PHE A CA 3375 C C . PHE A 180 ? 0.49089 0.44969 0.48563 0.00930 -0.02265 -0.01922 180 PHE A C 3376 O O . PHE A 180 ? 0.51503 0.46642 0.50431 0.00504 -0.01994 -0.01532 180 PHE A O 3377 C CB . PHE A 180 ? 0.44773 0.43952 0.45935 0.01197 -0.01703 -0.02819 180 PHE A CB 3378 C CG . PHE A 180 ? 0.43202 0.44352 0.44878 0.00964 -0.01040 -0.02744 180 PHE A CG 3379 C CD1 . PHE A 180 ? 0.46110 0.47338 0.47498 0.00432 -0.00554 -0.02016 180 PHE A CD1 3380 C CD2 . PHE A 180 ? 0.51105 0.54044 0.53505 0.01325 -0.00910 -0.03386 180 PHE A CD2 3381 C CE1 . PHE A 180 ? 0.48149 0.50951 0.49930 0.00201 -0.00038 -0.01741 180 PHE A CE1 3382 C CE2 . PHE A 180 ? 0.49247 0.54049 0.51903 0.01038 -0.00261 -0.03110 180 PHE A CE2 3383 C CZ . PHE A 180 ? 0.47174 0.51788 0.49498 0.00448 0.00133 -0.02200 180 PHE A CZ 3393 N N A SER A 181 ? 0.49527 0.44609 0.48939 0.01420 -0.03022 -0.02093 181 SER A N 3394 N N B SER A 181 ? 0.49784 0.44878 0.49217 0.01428 -0.03026 -0.02108 181 SER A N 3395 C CA A SER A 181 ? 0.55837 0.48852 0.54300 0.01455 -0.03586 -0.01667 181 SER A CA 3396 C CA B SER A 181 ? 0.55904 0.48925 0.54368 0.01453 -0.03583 -0.01667 181 SER A CA 3397 C C A SER A 181 ? 0.53257 0.45395 0.50319 0.00932 -0.03280 -0.00806 181 SER A C 3398 C C B SER A 181 ? 0.53350 0.45561 0.50443 0.00907 -0.03229 -0.00813 181 SER A C 3399 O O A SER A 181 ? 0.56768 0.47700 0.53013 0.00505 -0.03155 -0.00196 181 SER A O 3400 O O B SER A 181 ? 0.56976 0.48144 0.53326 0.00435 -0.03008 -0.00227 181 SER A O 3401 C CB A SER A 181 ? 0.57942 0.50380 0.56674 0.02245 -0.04596 -0.02009 181 SER A CB 3402 C CB B SER A 181 ? 0.57960 0.50376 0.56638 0.02229 -0.04592 -0.01974 181 SER A CB 3403 O OG A SER A 181 ? 0.65530 0.58576 0.65501 0.02841 -0.04899 -0.02908 181 SER A OG 3404 O OG B SER A 181 ? 0.63059 0.53248 0.60702 0.02258 -0.05228 -0.01365 181 SER A OG 3415 N N . VAL A 182 ? 0.51710 0.44508 0.48534 0.00946 -0.03165 -0.00803 182 VAL A N 3416 C CA . VAL A 182 ? 0.54082 0.46361 0.49562 0.00575 -0.02801 -0.00250 182 VAL A CA 3417 C C . VAL A 182 ? 0.57594 0.50276 0.53061 0.00016 -0.01872 0.00035 182 VAL A C 3418 O O . VAL A 182 ? 0.56234 0.48217 0.50679 -0.00350 -0.01543 0.00614 182 VAL A O 3419 C CB . VAL A 182 ? 0.58061 0.51070 0.53628 0.00722 -0.02921 -0.00596 182 VAL A CB 3420 C CG1 . VAL A 182 ? 0.64818 0.57574 0.59168 0.00427 -0.02409 -0.00327 182 VAL A CG1 3421 C CG2 . VAL A 182 ? 0.64047 0.56651 0.59458 0.01253 -0.03953 -0.00811 182 VAL A CG2 3432 N N . CYS A 183 ? 0.51096 0.45070 0.47701 -0.00061 -0.01432 -0.00309 183 CYS A N 3433 C CA . CYS A 183 ? 0.49526 0.44029 0.46237 -0.00473 -0.00679 -0.00069 183 CYS A CA 3434 C C . CYS A 183 ? 0.51884 0.45926 0.48646 -0.00808 -0.00615 0.00160 183 CYS A C 3435 O O . CYS A 183 ? 0.51555 0.45578 0.47975 -0.01244 -0.00106 0.00582 183 CYS A O 3436 C CB . CYS A 183 ? 0.51803 0.47698 0.49612 -0.00447 -0.00357 -0.00343 183 CYS A CB 3437 S SG . CYS A 183 ? 0.53647 0.50028 0.51796 -0.00305 -0.00401 -0.00502 183 CYS A SG 3443 N N . THR A 184 ? 0.49939 0.43723 0.47294 -0.00617 -0.01129 -0.00203 184 THR A N 3444 C CA . THR A 184 ? 0.52681 0.45862 0.50299 -0.00986 -0.01216 -0.00132 184 THR A CA 3445 C C . THR A 184 ? 0.53753 0.45380 0.50372 -0.01431 -0.01281 0.00672 184 THR A C 3446 O O . THR A 184 ? 0.52968 0.44492 0.49690 -0.02100 -0.00909 0.01087 184 THR A O 3447 C CB . THR A 184 ? 0.55553 0.48497 0.53917 -0.00531 -0.01903 -0.00867 184 THR A CB 3448 O OG1 . THR A 184 ? 0.57811 0.52527 0.56994 -0.00275 -0.01657 -0.01519 184 THR A OG1 3449 C CG2 . THR A 184 ? 0.67444 0.59212 0.66057 -0.00943 -0.02220 -0.00840 184 THR A CG2 3457 N N . ALA A 185 ? 0.53863 0.44374 0.49523 -0.01105 -0.01777 0.00963 185 ALA A N 3458 C CA . ALA A 185 ? 0.59981 0.48943 0.54419 -0.01532 -0.01886 0.01919 185 ALA A CA 3459 C C . ALA A 185 ? 0.57304 0.47008 0.50976 -0.02132 -0.00907 0.02526 185 ALA A C 3460 O O . ALA A 185 ? 0.57793 0.46987 0.51139 -0.02876 -0.00562 0.03296 185 ALA A O 3461 C CB . ALA A 185 ? 0.59532 0.47370 0.52917 -0.00936 -0.02695 0.02113 185 ALA A CB 3467 N N . ILE A 186 ? 0.54039 0.45011 0.47569 -0.01833 -0.00442 0.02153 186 ILE A N 3468 C CA . ILE A 186 ? 0.52766 0.44533 0.45560 -0.02162 0.00452 0.02510 186 ILE A CA 3469 C C . ILE A 186 ? 0.53261 0.46296 0.47322 -0.02640 0.01168 0.02440 186 ILE A C 3470 O O . ILE A 186 ? 0.52408 0.45886 0.46219 -0.03220 0.01855 0.02988 186 ILE A O 3471 C CB . ILE A 186 ? 0.51734 0.44117 0.44022 -0.01573 0.00504 0.01976 186 ILE A CB 3472 C CG1 . ILE A 186 ? 0.62252 0.53484 0.53015 -0.01220 -0.00211 0.02165 186 ILE A CG1 3473 C CG2 . ILE A 186 ? 0.60100 0.53588 0.52046 -0.01703 0.01454 0.01979 186 ILE A CG2 3474 C CD1 . ILE A 186 ? 0.63874 0.55500 0.54363 -0.00657 -0.00492 0.01469 186 ILE A CD1 3486 N N . ILE A 187 ? 0.50674 0.44500 0.46109 -0.02411 0.01020 0.01798 187 ILE A N 3487 C CA . ILE A 187 ? 0.51660 0.46755 0.48328 -0.02785 0.01499 0.01694 187 ILE A CA 3488 C C . ILE A 187 ? 0.51955 0.46500 0.49006 -0.03589 0.01458 0.02150 187 ILE A C 3489 O O . ILE A 187 ? 0.53241 0.48735 0.50824 -0.04188 0.02078 0.02468 187 ILE A O 3490 C CB . ILE A 187 ? 0.48635 0.44563 0.46408 -0.02374 0.01196 0.01016 187 ILE A CB 3491 C CG1 . ILE A 187 ? 0.50623 0.47218 0.48291 -0.01821 0.01391 0.00774 187 ILE A CG1 3492 C CG2 . ILE A 187 ? 0.51894 0.48958 0.50887 -0.02769 0.01385 0.00892 187 ILE A CG2 3493 C CD1 . ILE A 187 ? 0.57459 0.54651 0.55867 -0.01450 0.01048 0.00339 187 ILE A CD1 3505 N N . THR A 188 ? 0.52970 0.45982 0.49935 -0.03621 0.00680 0.02155 188 THR A N 3506 C CA . THR A 188 ? 0.54899 0.46973 0.52368 -0.04442 0.00462 0.02568 188 THR A CA 3507 C C . THR A 188 ? 0.57448 0.48994 0.53920 -0.05204 0.01012 0.03733 188 THR A C 3508 O O . THR A 188 ? 0.54716 0.46604 0.51927 -0.06168 0.01405 0.04224 188 THR A O 3509 C CB . THR A 188 ? 0.58498 0.48789 0.56065 -0.04105 -0.00609 0.02215 188 THR A CB 3510 O OG1 . THR A 188 ? 0.62835 0.54084 0.61306 -0.03430 -0.00943 0.01090 188 THR A OG1 3511 C CG2 . THR A 188 ? 0.73607 0.62497 0.71813 -0.04984 -0.01004 0.02600 188 THR A CG2 3519 N N . ARG A 189 ? 0.57002 0.47915 0.51799 -0.04824 0.01063 0.04185 189 ARG A N 3520 C CA . ARG A 189 ? 0.60092 0.50724 0.53518 -0.05465 0.01665 0.05340 189 ARG A CA 3521 C C . ARG A 189 ? 0.59050 0.51899 0.52915 -0.05918 0.02896 0.05434 189 ARG A C 3522 O O . ARG A 189 ? 0.64734 0.57851 0.58254 -0.06839 0.03572 0.06408 189 ARG A O 3523 C CB . ARG A 189 ? 0.66536 0.56405 0.57975 -0.04744 0.01380 0.05517 189 ARG A CB 3524 C CG . ARG A 189 ? 0.82558 0.71927 0.72038 -0.05255 0.01821 0.06763 189 ARG A CG 3525 C CD . ARG A 189 ? 0.82491 0.70948 0.70069 -0.04386 0.01161 0.06726 189 ARG A CD 3526 N NE . ARG A 189 ? 0.69549 0.56067 0.57383 -0.03944 -0.00165 0.06656 189 ARG A NE 3527 C CZ . ARG A 189 ? 0.73345 0.59647 0.61170 -0.02951 -0.00991 0.05822 189 ARG A CZ 3528 N NH1 . ARG A 189 ? 0.72184 0.59793 0.59662 -0.02377 -0.00729 0.05047 189 ARG A NH1 3529 N NH2 . ARG A 189 ? 0.77766 0.62518 0.66081 -0.02524 -0.02145 0.05722 189 ARG A NH2 3543 N N . GLN A 190 ? 0.56028 0.50530 0.50730 -0.05286 0.03203 0.04487 190 GLN A N 3544 C CA . GLN A 190 ? 0.55776 0.52488 0.51179 -0.05456 0.04248 0.04369 190 GLN A CA 3545 C C . GLN A 190 ? 0.56433 0.54357 0.54021 -0.05999 0.04321 0.04106 190 GLN A C 3546 O O . GLN A 190 ? 0.55684 0.55661 0.54252 -0.05982 0.05044 0.03853 190 GLN A O 3547 C CB . GLN A 190 ? 0.58414 0.56064 0.53552 -0.04397 0.04429 0.03523 190 GLN A CB 3548 C CG . GLN A 190 ? 0.60475 0.57421 0.53540 -0.03891 0.04464 0.03602 190 GLN A CG 3549 C CD . GLN A 190 ? 0.64689 0.62674 0.56632 -0.04262 0.05511 0.04157 190 GLN A CD 3550 O OE1 . GLN A 190 ? 0.66876 0.66680 0.59916 -0.04625 0.06386 0.04176 190 GLN A OE1 3551 N NE2 . GLN A 190 ? 0.67663 0.64702 0.57414 -0.04153 0.05427 0.04605 190 GLN A NE2 3560 N N . GLY A 191 ? 0.55059 0.51812 0.53468 -0.06426 0.03524 0.04077 191 GLY A N 3561 C CA . GLY A 191 ? 0.57284 0.55110 0.57668 -0.07081 0.03475 0.03820 191 GLY A CA 3562 C C . GLY A 191 ? 0.57074 0.55946 0.58551 -0.06340 0.03038 0.02764 191 GLY A C 3563 O O . GLY A 191 ? 0.56234 0.56401 0.59335 -0.06748 0.02969 0.02435 191 GLY A O 3567 N N . GLY A 192 ? 0.52192 0.50625 0.52827 -0.05312 0.02713 0.02282 192 GLY A N 3568 C CA . GLY A 192 ? 0.52391 0.51658 0.53792 -0.04660 0.02282 0.01485 192 GLY A CA 3569 C C . GLY A 192 ? 0.50302 0.48507 0.51940 -0.04619 0.01359 0.00969 192 GLY A C 3570 O O . GLY A 192 ? 0.51900 0.48387 0.53087 -0.04904 0.00925 0.01151 192 GLY A O 3574 N N . GLU A 193 ? 0.47128 0.46421 0.49430 -0.04171 0.01032 0.00296 193 GLU A N 3575 C CA . GLU A 193 ? 0.50647 0.49480 0.53175 -0.03966 0.00231 -0.00446 193 GLU A CA 3576 C C . GLU A 193 ? 0.50593 0.49854 0.52517 -0.03059 0.00143 -0.00785 193 GLU A C 3577 O O . GLU A 193 ? 0.50213 0.50841 0.52287 -0.02720 0.00426 -0.00729 193 GLU A O 3578 C CB . GLU A 193 ? 0.55058 0.55156 0.58859 -0.04355 -0.00085 -0.00958 193 GLU A CB 3579 C CG . GLU A 193 ? 0.77422 0.77423 0.81384 -0.04040 -0.00917 -0.01968 193 GLU A CG 3580 C CD . GLU A 193 ? 0.84427 0.82445 0.88550 -0.04456 -0.01560 -0.02299 193 GLU A CD 3581 O OE1 . GLU A 193 ? 0.92596 0.90475 0.96939 -0.04153 -0.02293 -0.03341 193 GLU A OE1 3582 O OE2 . GLU A 193 ? 0.76305 0.72896 0.80298 -0.05059 -0.01366 -0.01526 193 GLU A OE2 3589 N N . VAL A 194 ? 0.46474 0.44615 0.47831 -0.02677 -0.00264 -0.01082 194 VAL A N 3590 C CA . VAL A 194 ? 0.45217 0.44074 0.46266 -0.01952 -0.00324 -0.01439 194 VAL A CA 3591 C C . VAL A 194 ? 0.48834 0.48737 0.50345 -0.01765 -0.00740 -0.02266 194 VAL A C 3592 O O . VAL A 194 ? 0.52471 0.51630 0.54229 -0.01798 -0.01307 -0.02945 194 VAL A O 3593 C CB . VAL A 194 ? 0.59697 0.57348 0.60174 -0.01557 -0.00586 -0.01514 194 VAL A CB 3594 C CG1 . VAL A 194 ? 0.60894 0.59650 0.61355 -0.00949 -0.00575 -0.01890 194 VAL A CG1 3595 C CG2 . VAL A 194 ? 0.56149 0.52900 0.55936 -0.01710 -0.00256 -0.00758 194 VAL A CG2 3605 N N . THR A 195 ? 0.45050 0.46601 0.46620 -0.01541 -0.00531 -0.02228 195 THR A N 3606 C CA . THR A 195 ? 0.45364 0.48143 0.47138 -0.01376 -0.00939 -0.02990 195 THR A CA 3607 C C . THR A 195 ? 0.50290 0.54076 0.51517 -0.00742 -0.00940 -0.03395 195 THR A C 3608 O O . THR A 195 ? 0.50714 0.55203 0.51880 -0.00475 -0.01351 -0.04342 195 THR A O 3609 C CB . THR A 195 ? 0.52178 0.56358 0.54376 -0.01570 -0.00857 -0.02680 195 THR A CB 3610 O OG1 . THR A 195 ? 0.49174 0.54418 0.51536 -0.01498 -0.01434 -0.03540 195 THR A OG1 3611 C CG2 . THR A 195 ? 0.48716 0.53826 0.50543 -0.01204 -0.00416 -0.01912 195 THR A CG2 3619 N N . LYS A 196 ? 0.43747 0.47722 0.44626 -0.00522 -0.00490 -0.02780 196 LYS A N 3620 C CA . LYS A 196 ? 0.44706 0.49955 0.45226 -0.00069 -0.00367 -0.03044 196 LYS A CA 3621 C C . LYS A 196 ? 0.46099 0.50984 0.46600 -0.00001 0.00003 -0.02481 196 LYS A C 3622 O O . LYS A 196 ? 0.46055 0.50185 0.46597 -0.00252 0.00240 -0.01700 196 LYS A O 3623 C CB . LYS A 196 ? 0.50949 0.57966 0.51112 -0.00009 -0.00227 -0.02682 196 LYS A CB 3624 C CG . LYS A 196 ? 0.62607 0.71361 0.62221 0.00389 -0.00111 -0.03085 196 LYS A CG 3625 C CD . LYS A 196 ? 0.65048 0.75454 0.64042 0.00421 -0.00072 -0.02547 196 LYS A CD 3626 C CE . LYS A 196 ? 0.76711 0.87291 0.75812 0.00345 -0.00648 -0.02969 196 LYS A CE 3627 N NZ . LYS A 196 ? 0.53366 0.64970 0.52052 0.00667 -0.01112 -0.04339 196 LYS A NZ 3641 N N . PHE A 197 ? 0.44432 0.50034 0.44968 0.00371 0.00023 -0.03002 197 PHE A N 3642 C CA . PHE A 197 ? 0.42311 0.48248 0.43050 0.00388 0.00363 -0.02536 197 PHE A CA 3643 C C . PHE A 197 ? 0.47756 0.55763 0.48292 0.00376 0.00821 -0.02149 197 PHE A C 3644 O O . PHE A 197 ? 0.44429 0.53933 0.44644 0.00683 0.00831 -0.02788 197 PHE A O 3645 C CB . PHE A 197 ? 0.46659 0.52327 0.47825 0.00809 0.00093 -0.03322 197 PHE A CB 3646 C CG . PHE A 197 ? 0.47630 0.51143 0.48818 0.00829 -0.00434 -0.03528 197 PHE A CG 3647 C CD1 . PHE A 197 ? 0.47856 0.49975 0.48827 0.00451 -0.00392 -0.02745 197 PHE A CD1 3648 C CD2 . PHE A 197 ? 0.58560 0.61407 0.59910 0.01236 -0.00989 -0.04490 197 PHE A CD2 3649 C CE1 . PHE A 197 ? 0.48111 0.48358 0.48861 0.00408 -0.00814 -0.02750 197 PHE A CE1 3650 C CE2 . PHE A 197 ? 0.54352 0.55022 0.55647 0.01162 -0.01509 -0.04437 197 PHE A CE2 3651 C CZ . PHE A 197 ? 0.51743 0.51209 0.52656 0.00714 -0.01377 -0.03486 197 PHE A CZ 3662 N N . ILE A 198 ? 0.45055 0.53117 0.45713 0.00012 0.01170 -0.01104 198 ILE A N 3663 C CA . ILE A 198 ? 0.44568 0.54337 0.44984 -0.00171 0.01615 -0.00353 198 ILE A CA 3664 C C . ILE A 198 ? 0.45125 0.55205 0.46265 -0.00473 0.01934 0.00096 198 ILE A C 3665 O O . ILE A 198 ? 0.48067 0.57106 0.49538 -0.00887 0.01961 0.00943 198 ILE A O 3666 C CB . ILE A 198 ? 0.47272 0.56657 0.47292 -0.00403 0.01600 0.00664 198 ILE A CB 3667 C CG1 . ILE A 198 ? 0.49197 0.58366 0.48841 -0.00161 0.01194 0.00111 198 ILE A CG1 3668 C CG2 . ILE A 198 ? 0.48907 0.59947 0.48472 -0.00593 0.01975 0.01611 198 ILE A CG2 3669 C CD1 . ILE A 198 ? 0.57176 0.65673 0.56823 -0.00264 0.01046 0.00904 198 ILE A CD1 3681 N N . GLY A 199 ? 0.46244 0.57829 0.47792 -0.00244 0.02128 -0.00585 199 GLY A N 3682 C CA . GLY A 199 ? 0.45799 0.57917 0.48362 -0.00566 0.02364 -0.00301 199 GLY A CA 3683 C C . GLY A 199 ? 0.44905 0.54985 0.48015 -0.00542 0.01838 -0.00579 199 GLY A C 3684 O O . GLY A 199 ? 0.46143 0.55566 0.49297 -0.00011 0.01405 -0.01537 199 GLY A O 3688 N N . ASP A 200 ? 0.39004 0.47987 0.42451 -0.01083 0.01802 0.00244 200 ASP A N 3689 C CA . ASP A 200 ? 0.40158 0.47273 0.43859 -0.01069 0.01288 0.00006 200 ASP A CA 3690 C C . ASP A 200 ? 0.46080 0.51224 0.48935 -0.01040 0.01081 0.00263 200 ASP A C 3691 O O . ASP A 200 ? 0.45760 0.49453 0.48637 -0.01164 0.00807 0.00351 200 ASP A O 3692 C CB . ASP A 200 ? 0.41767 0.49027 0.46503 -0.01661 0.01301 0.00494 200 ASP A CB 3693 C CG . ASP A 200 ? 0.41381 0.48000 0.46040 -0.02252 0.01519 0.01607 200 ASP A CG 3694 O OD1 . ASP A 200 ? 0.44297 0.51239 0.48233 -0.02198 0.01808 0.02115 200 ASP A OD1 3695 O OD2 . ASP A 200 ? 0.42500 0.48265 0.47865 -0.02739 0.01313 0.01955 200 ASP A OD2 3700 N N . CYS A 201 ? 0.44691 0.49960 0.46855 -0.00857 0.01200 0.00298 201 CYS A N 3701 C CA . CYS A 201 ? 0.42803 0.46787 0.44440 -0.00866 0.01130 0.00626 201 CYS A CA 3702 C C . CYS A 201 ? 0.50717 0.54294 0.51866 -0.00571 0.00936 0.00015 201 CYS A C 3703 O O . CYS A 201 ? 0.44127 0.48660 0.45195 -0.00359 0.00895 -0.00499 201 CYS A O 3704 C CB . CYS A 201 ? 0.50105 0.54753 0.51639 -0.01044 0.01385 0.01479 201 CYS A CB 3705 S SG . CYS A 201 ? 0.55159 0.59033 0.56279 -0.00839 0.01277 0.01672 201 CYS A SG 3711 N N . VAL A 202 ? 0.42623 0.44808 0.43483 -0.00586 0.00820 0.00031 202 VAL A N 3712 C CA A VAL A 202 ? 0.43092 0.44741 0.43630 -0.00535 0.00688 -0.00307 202 VAL A CA 3713 C CA B VAL A 202 ? 0.43333 0.45065 0.43884 -0.00529 0.00687 -0.00321 202 VAL A CA 3714 C C . VAL A 202 ? 0.44469 0.46450 0.45031 -0.00623 0.00876 0.00071 202 VAL A C 3715 O O . VAL A 202 ? 0.46418 0.47973 0.47039 -0.00636 0.01044 0.00505 202 VAL A O 3716 C CB A VAL A 202 ? 0.46929 0.47066 0.47083 -0.00566 0.00527 -0.00397 202 VAL A CB 3717 C CB B VAL A 202 ? 0.48318 0.48571 0.48511 -0.00534 0.00469 -0.00510 202 VAL A CB 3718 C CG1 A VAL A 202 ? 0.44587 0.44213 0.44517 -0.00737 0.00522 -0.00453 202 VAL A CG1 3719 C CG1 B VAL A 202 ? 0.53565 0.53021 0.53477 -0.00630 0.00653 -0.00124 202 VAL A CG1 3720 C CG2 A VAL A 202 ? 0.50139 0.49908 0.50307 -0.00363 0.00149 -0.00799 202 VAL A CG2 3721 C CG2 B VAL A 202 ? 0.42203 0.41955 0.42233 -0.00635 0.00301 -0.00775 202 VAL A CG2 3740 N N . MET A 203 ? 0.42724 0.45455 0.43336 -0.00621 0.00762 -0.00208 203 MET A N 3741 C CA A MET A 203 ? 0.44133 0.47326 0.44966 -0.00686 0.00806 0.00015 203 MET A CA 3742 C CA B MET A 203 ? 0.44079 0.47282 0.44912 -0.00685 0.00805 0.00013 203 MET A CA 3743 C C . MET A 203 ? 0.46200 0.48852 0.47198 -0.00956 0.00687 -0.00370 203 MET A C 3744 O O . MET A 203 ? 0.45468 0.47970 0.46455 -0.01030 0.00369 -0.00943 203 MET A O 3745 C CB A MET A 203 ? 0.46240 0.50950 0.47051 -0.00541 0.00662 0.00045 203 MET A CB 3746 C CB B MET A 203 ? 0.46232 0.50952 0.47034 -0.00540 0.00659 0.00031 203 MET A CB 3747 C CG A MET A 203 ? 0.45209 0.50593 0.46392 -0.00519 0.00555 0.00266 203 MET A CG 3748 C CG B MET A 203 ? 0.46432 0.51893 0.47594 -0.00555 0.00485 0.00062 203 MET A CG 3749 S SD A MET A 203 ? 0.52007 0.59209 0.52837 -0.00263 0.00253 0.00442 203 MET A SD 3750 S SD B MET A 203 ? 0.46909 0.54219 0.47671 -0.00325 0.00136 -0.00064 203 MET A SD 3751 C CE A MET A 203 ? 0.47739 0.55656 0.49336 -0.00286 -0.00103 0.00250 203 MET A CE 3752 C CE B MET A 203 ? 0.49755 0.57774 0.51264 -0.00412 -0.00251 -0.00282 203 MET A CE 3771 N N . ALA A 204 ? 0.45222 0.47595 0.46450 -0.01114 0.00949 -0.00070 204 ALA A N 3772 C CA . ALA A 204 ? 0.41643 0.43594 0.43104 -0.01556 0.00973 -0.00209 204 ALA A CA 3773 C C . ALA A 204 ? 0.41316 0.44285 0.43518 -0.01658 0.01241 0.00007 204 ALA A C 3774 O O . ALA A 204 ? 0.43978 0.47612 0.46391 -0.01251 0.01372 0.00263 204 ALA A O 3775 C CB . ALA A 204 ? 0.46683 0.47195 0.47495 -0.01703 0.01154 -0.00026 204 ALA A CB 3781 N N . TYR A 205 ? 0.44972 0.48073 0.47724 -0.02212 0.01293 -0.00074 205 TYR A N 3782 C CA . TYR A 205 ? 0.46491 0.50867 0.50196 -0.02322 0.01632 0.00089 205 TYR A CA 3783 C C . TYR A 205 ? 0.46697 0.50861 0.50707 -0.03058 0.02055 0.00287 205 TYR A C 3784 O O . TYR A 205 ? 0.48070 0.51027 0.51709 -0.03606 0.01880 0.00318 205 TYR A O 3785 C CB . TYR A 205 ? 0.46356 0.52293 0.51027 -0.02266 0.01154 -0.00205 205 TYR A CB 3786 C CG . TYR A 205 ? 0.46815 0.52758 0.51818 -0.02782 0.00559 -0.00748 205 TYR A CG 3787 C CD1 . TYR A 205 ? 0.52923 0.59174 0.58992 -0.03594 0.00532 -0.00876 205 TYR A CD1 3788 C CD2 . TYR A 205 ? 0.54009 0.59819 0.58379 -0.02459 0.00013 -0.01198 205 TYR A CD2 3789 C CE1 . TYR A 205 ? 0.56201 0.62249 0.62711 -0.04077 -0.00160 -0.01507 205 TYR A CE1 3790 C CE2 . TYR A 205 ? 0.52855 0.58650 0.57515 -0.02791 -0.00611 -0.01936 205 TYR A CE2 3791 C CZ . TYR A 205 ? 0.61503 0.67274 0.67259 -0.03594 -0.00771 -0.02129 205 TYR A CZ 3792 O OH . TYR A 205 ? 0.63025 0.68552 0.69181 -0.03941 -0.01531 -0.02993 205 TYR A OH 3802 N N . PHE A 206 ? 0.45276 0.50676 0.50000 -0.03026 0.02630 0.00466 206 PHE A N 3803 C CA . PHE A 206 ? 0.47033 0.52893 0.52201 -0.03747 0.03271 0.00767 206 PHE A CA 3804 C C . PHE A 206 ? 0.48755 0.56858 0.55799 -0.03968 0.03359 0.00599 206 PHE A C 3805 O O . PHE A 206 ? 0.48334 0.57556 0.56072 -0.03292 0.03007 0.00310 206 PHE A O 3806 C CB . PHE A 206 ? 0.46326 0.52003 0.50568 -0.03379 0.04057 0.01012 206 PHE A CB 3807 C CG . PHE A 206 ? 0.47686 0.51334 0.50139 -0.03182 0.03919 0.01158 206 PHE A CG 3808 C CD1 . PHE A 206 ? 0.48141 0.50969 0.50016 -0.02471 0.03429 0.00899 206 PHE A CD1 3809 C CD2 . PHE A 206 ? 0.54443 0.57137 0.55834 -0.03735 0.04266 0.01629 206 PHE A CD2 3810 C CE1 . PHE A 206 ? 0.50777 0.52012 0.51285 -0.02305 0.03236 0.00958 206 PHE A CE1 3811 C CE2 . PHE A 206 ? 0.50640 0.51598 0.50433 -0.03468 0.03995 0.01733 206 PHE A CE2 3812 C CZ . PHE A 206 ? 0.50607 0.50918 0.50074 -0.02742 0.03464 0.01324 206 PHE A CZ 3822 N N . ASP A 207 ? 0.49387 0.58220 0.57313 -0.04944 0.03809 0.00860 207 ASP A N 3823 C CA . ASP A 207 ? 0.49448 0.60807 0.59427 -0.05194 0.04030 0.00698 207 ASP A CA 3824 C C . ASP A 207 ? 0.45601 0.58433 0.55903 -0.04125 0.04575 0.00542 207 ASP A C 3825 O O . ASP A 207 ? 0.48784 0.60741 0.57751 -0.03542 0.05079 0.00647 207 ASP A O 3826 C CB . ASP A 207 ? 0.50078 0.62107 0.60950 -0.06531 0.04680 0.01173 207 ASP A CB 3827 C CG . ASP A 207 ? 0.72562 0.83423 0.83887 -0.07664 0.03945 0.01202 207 ASP A CG 3828 O OD1 . ASP A 207 ? 0.63239 0.73477 0.74579 -0.07342 0.02924 0.00605 207 ASP A OD1 3829 O OD2 . ASP A 207 ? 0.67173 0.77743 0.78831 -0.08891 0.04389 0.01824 207 ASP A OD2 3834 N N . GLY A 208 ? 0.47298 0.62395 0.59489 -0.03824 0.04380 0.00202 208 GLY A N 3835 C CA . GLY A 208 ? 0.44266 0.60638 0.56999 -0.02594 0.04638 -0.00058 208 GLY A CA 3836 C C . GLY A 208 ? 0.49594 0.66989 0.62416 -0.02481 0.05857 -0.00040 208 GLY A C 3837 O O . GLY A 208 ? 0.54833 0.72417 0.67453 -0.01302 0.06097 -0.00362 208 GLY A O 3841 N N . ASP A 209 ? 0.48028 0.66070 0.61108 -0.03678 0.06624 0.00326 209 ASP A N 3842 C CA . ASP A 209 ? 0.53146 0.72421 0.66041 -0.03662 0.07929 0.00402 209 ASP A CA 3843 C C . ASP A 209 ? 0.50699 0.67665 0.60977 -0.03951 0.08356 0.00871 209 ASP A C 3844 O O . ASP A 209 ? 0.52490 0.70327 0.62199 -0.04320 0.09466 0.01151 209 ASP A O 3845 C CB . ASP A 209 ? 0.53950 0.75940 0.68924 -0.04855 0.08671 0.00652 209 ASP A CB 3846 C CG . ASP A 209 ? 0.63097 0.83856 0.77923 -0.06564 0.08429 0.01383 209 ASP A CG 3847 O OD1 . ASP A 209 ? 0.67871 0.85860 0.81220 -0.06655 0.07541 0.01522 209 ASP A OD1 3848 O OD2 . ASP A 209 ? 0.79232 1.01824 0.95559 -0.07828 0.09113 0.01803 209 ASP A OD2 3853 N N . CYS A 210 ? 0.45111 0.59357 0.53769 -0.03739 0.07502 0.00955 210 CYS A N 3854 C CA . CYS A 210 ? 0.51001 0.63010 0.57265 -0.03932 0.07661 0.01363 210 CYS A CA 3855 C C . CYS A 210 ? 0.51269 0.61917 0.56131 -0.02660 0.07371 0.00867 210 CYS A C 3856 O O . CYS A 210 ? 0.50049 0.58482 0.53323 -0.02620 0.06843 0.01017 210 CYS A O 3857 C CB . CYS A 210 ? 0.48576 0.58575 0.54297 -0.04861 0.06888 0.01856 210 CYS A CB 3858 S SG . CYS A 210 ? 0.57636 0.68657 0.64708 -0.06604 0.07307 0.02581 210 CYS A SG 3864 N N . ALA A 211 ? 0.50534 0.62510 0.56107 -0.01602 0.07684 0.00226 211 ALA A N 3865 C CA . ALA A 211 ? 0.46666 0.57212 0.51109 -0.00474 0.07354 -0.00289 211 ALA A CA 3866 C C . ALA A 211 ? 0.46549 0.55882 0.48768 -0.00554 0.07787 -0.00236 211 ALA A C 3867 O O . ALA A 211 ? 0.49088 0.56433 0.49998 -0.00163 0.07189 -0.00393 211 ALA A O 3868 C CB . ALA A 211 ? 0.53754 0.65841 0.59504 0.00731 0.07576 -0.01056 211 ALA A CB 3874 N N . ASP A 212 ? 0.51979 0.62655 0.53747 -0.01065 0.08821 -0.00001 212 ASP A N 3875 C CA . ASP A 212 ? 0.51623 0.61307 0.50996 -0.01104 0.09206 0.00109 212 ASP A CA 3876 C C . ASP A 212 ? 0.58206 0.65394 0.56145 -0.01750 0.08395 0.00797 212 ASP A C 3877 O O . ASP A 212 ? 0.53945 0.59516 0.50149 -0.01309 0.07980 0.00575 212 ASP A O 3878 C CB . ASP A 212 ? 0.53998 0.65720 0.53027 -0.01761 0.10523 0.00534 212 ASP A CB 3879 C CG . ASP A 212 ? 0.57177 0.71611 0.57401 -0.00883 0.11452 -0.00375 212 ASP A CG 3880 O OD1 . ASP A 212 ? 0.55163 0.69260 0.54873 0.00412 0.11302 -0.01434 212 ASP A OD1 3881 O OD2 . ASP A 212 ? 0.64522 0.81480 0.66343 -0.01479 0.12309 -0.00094 212 ASP A OD2 3886 N N . GLN A 213 ? 0.50648 0.57534 0.49416 -0.02744 0.08078 0.01524 213 GLN A N 3887 C CA . GLN A 213 ? 0.50916 0.55471 0.48552 -0.03218 0.07244 0.02059 213 GLN A CA 3888 C C . GLN A 213 ? 0.48712 0.51883 0.46412 -0.02464 0.06238 0.01499 213 GLN A C 3889 O O . GLN A 213 ? 0.51474 0.52901 0.47839 -0.02350 0.05650 0.01578 213 GLN A O 3890 C CB . GLN A 213 ? 0.51100 0.55557 0.49775 -0.04386 0.07063 0.02779 213 GLN A CB 3891 C CG . GLN A 213 ? 0.58123 0.63610 0.56775 -0.05521 0.07988 0.03669 213 GLN A CG 3892 C CD . GLN A 213 ? 0.76445 0.84911 0.76432 -0.05510 0.09127 0.03418 213 GLN A CD 3893 O OE1 . GLN A 213 ? 0.64402 0.74271 0.66046 -0.04828 0.09050 0.02627 213 GLN A OE1 3894 N NE2 . GLN A 213 ? 1.18087 1.27638 1.17402 -0.06286 0.10191 0.04168 213 GLN A NE2 3903 N N . ALA A 214 ? 0.49772 0.53790 0.49054 -0.01969 0.06005 0.01008 214 ALA A N 3904 C CA . ALA A 214 ? 0.51238 0.54124 0.50574 -0.01354 0.05171 0.00648 214 ALA A CA 3905 C C . ALA A 214 ? 0.48446 0.50448 0.46604 -0.00608 0.05112 0.00169 214 ALA A C 3906 O O . ALA A 214 ? 0.47735 0.48303 0.45242 -0.00457 0.04447 0.00095 214 ALA A O 3907 C CB . ALA A 214 ? 0.47585 0.51634 0.48672 -0.00966 0.04963 0.00395 214 ALA A CB 3913 N N . ILE A 215 ? 0.45612 0.48588 0.43630 -0.00111 0.05770 -0.00276 215 ILE A N 3914 C CA . ILE A 215 ? 0.43583 0.45698 0.40453 0.00624 0.05654 -0.00945 215 ILE A CA 3915 C C . ILE A 215 ? 0.49834 0.50762 0.44679 0.00259 0.05504 -0.00682 215 ILE A C 3916 O O . ILE A 215 ? 0.49276 0.48817 0.43330 0.00556 0.04820 -0.01009 215 ILE A O 3917 C CB . ILE A 215 ? 0.46988 0.50592 0.44140 0.01345 0.06430 -0.01666 215 ILE A CB 3918 C CG1 . ILE A 215 ? 0.49740 0.54145 0.48964 0.01987 0.06255 -0.02009 215 ILE A CG1 3919 C CG2 . ILE A 215 ? 0.52689 0.55397 0.48320 0.02069 0.06327 -0.02533 215 ILE A CG2 3920 C CD1 . ILE A 215 ? 0.51203 0.57453 0.51204 0.02804 0.07025 -0.02778 215 ILE A CD1 3932 N N . GLN A 216 ? 0.52236 0.53703 0.46284 -0.00434 0.06080 -0.00013 216 GLN A N 3933 C CA . GLN A 216 ? 0.51043 0.51360 0.42991 -0.00734 0.05887 0.00410 216 GLN A CA 3934 C C . GLN A 216 ? 0.53915 0.52493 0.45829 -0.00956 0.04824 0.00722 216 GLN A C 3935 O O . GLN A 216 ? 0.54108 0.51508 0.44711 -0.00695 0.04211 0.00560 216 GLN A O 3936 C CB . GLN A 216 ? 0.52425 0.53569 0.43670 -0.01578 0.06709 0.01343 216 GLN A CB 3937 C CG . GLN A 216 ? 0.60563 0.60555 0.49334 -0.01832 0.06535 0.01959 216 GLN A CG 3938 C CD . GLN A 216 ? 0.61256 0.61571 0.48215 -0.01038 0.06763 0.01175 216 GLN A CD 3939 O OE1 . GLN A 216 ? 0.64958 0.67008 0.51550 -0.00850 0.07808 0.00876 216 GLN A OE1 3940 N NE2 . GLN A 216 ? 0.67238 0.66042 0.53154 -0.00531 0.05763 0.00712 216 GLN A NE2 3949 N N . ALA A 217 ? 0.51333 0.49904 0.44711 -0.01395 0.04568 0.01080 217 ALA A N 3950 C CA . ALA A 217 ? 0.49924 0.47178 0.43483 -0.01460 0.03630 0.01177 217 ALA A CA 3951 C C . ALA A 217 ? 0.49966 0.46725 0.43676 -0.00802 0.03055 0.00490 217 ALA A C 3952 O O . ALA A 217 ? 0.51404 0.47122 0.44528 -0.00698 0.02347 0.00435 217 ALA A O 3953 C CB . ALA A 217 ? 0.51616 0.49277 0.46801 -0.01868 0.03495 0.01366 217 ALA A CB 3959 N N . SER A 218 ? 0.48818 0.46313 0.43517 -0.00383 0.03279 0.00004 218 SER A N 3960 C CA . SER A 218 ? 0.49929 0.46825 0.44988 0.00085 0.02725 -0.00523 218 SER A CA 3961 C C . SER A 218 ? 0.52557 0.48646 0.46180 0.00399 0.02444 -0.01003 218 SER A C 3962 O O . SER A 218 ? 0.50459 0.45724 0.44036 0.00464 0.01716 -0.01227 218 SER A O 3963 C CB . SER A 218 ? 0.52221 0.49809 0.48519 0.00515 0.02977 -0.00851 218 SER A CB 3964 O OG . SER A 218 ? 0.50231 0.48701 0.47760 0.00272 0.03117 -0.00433 218 SER A OG 3970 N N . LEU A 219 ? 0.49587 0.46113 0.42063 0.00602 0.03016 -0.01229 219 LEU A N 3971 C CA . LEU A 219 ? 0.52487 0.48399 0.43323 0.00975 0.02726 -0.01815 219 LEU A CA 3972 C C . LEU A 219 ? 0.56090 0.51120 0.45655 0.00656 0.02105 -0.01321 219 LEU A C 3973 O O . LEU A 219 ? 0.55277 0.49525 0.44207 0.00908 0.01314 -0.01799 219 LEU A O 3974 C CB . LEU A 219 ? 0.53319 0.50253 0.43021 0.01262 0.03629 -0.02116 219 LEU A CB 3975 C CG . LEU A 219 ? 0.54004 0.51644 0.44787 0.01955 0.04017 -0.03031 219 LEU A CG 3976 C CD1 . LEU A 219 ? 0.57497 0.56627 0.47226 0.02255 0.05077 -0.03348 219 LEU A CD1 3977 C CD2 . LEU A 219 ? 0.66528 0.62989 0.57604 0.02550 0.03183 -0.04069 219 LEU A CD2 3989 N N . ASP A 220 ? 0.53403 0.48490 0.42755 0.00110 0.02340 -0.00382 220 ASP A N 3990 C CA . ASP A 220 ? 0.52102 0.46172 0.40262 -0.00093 0.01674 0.00177 220 ASP A CA 3991 C C . ASP A 220 ? 0.56097 0.49507 0.45448 -0.00014 0.00723 -0.00006 220 ASP A C 3992 O O . ASP A 220 ? 0.55092 0.47736 0.43642 0.00164 -0.00109 -0.00025 220 ASP A O 3993 C CB . ASP A 220 ? 0.56860 0.50909 0.44640 -0.00746 0.02129 0.01267 220 ASP A CB 3994 C CG . ASP A 220 ? 0.62072 0.56883 0.48248 -0.00941 0.03071 0.01661 220 ASP A CG 3995 O OD1 . ASP A 220 ? 0.63218 0.58285 0.47905 -0.00455 0.03160 0.01109 220 ASP A OD1 3996 O OD2 . ASP A 220 ? 0.67654 0.62908 0.54047 -0.01619 0.03731 0.02501 220 ASP A OD2 4001 N N . ILE A 221 ? 0.50776 0.44659 0.42013 -0.00109 0.00829 -0.00136 221 ILE A N 4002 C CA . ILE A 221 ? 0.49022 0.42707 0.41456 -0.00036 0.00109 -0.00363 221 ILE A CA 4003 C C . ILE A 221 ? 0.51630 0.45102 0.44058 0.00285 -0.00434 -0.01074 221 ILE A C 4004 O O . ILE A 221 ? 0.50728 0.43884 0.43247 0.00383 -0.01232 -0.01262 221 ILE A O 4005 C CB . ILE A 221 ? 0.49760 0.44209 0.43927 -0.00218 0.00441 -0.00288 221 ILE A CB 4006 C CG1 . ILE A 221 ? 0.51389 0.45900 0.45814 -0.00557 0.00589 0.00220 221 ILE A CG1 4007 C CG2 . ILE A 221 ? 0.54453 0.49099 0.49829 -0.00129 -0.00067 -0.00609 221 ILE A CG2 4008 C CD1 . ILE A 221 ? 0.52257 0.47753 0.48089 -0.00711 0.00980 0.00236 221 ILE A CD1 4020 N N . LEU A 222 ? 0.50930 0.44583 0.43404 0.00476 -0.00083 -0.01561 222 LEU A N 4021 C CA . LEU A 222 ? 0.52928 0.46164 0.45519 0.00714 -0.00689 -0.02344 222 LEU A CA 4022 C C . LEU A 222 ? 0.57526 0.50238 0.48389 0.00938 -0.01343 -0.02662 222 LEU A C 4023 O O . LEU A 222 ? 0.55768 0.48197 0.47002 0.00986 -0.02218 -0.03155 222 LEU A O 4024 C CB . LEU A 222 ? 0.55059 0.48322 0.47920 0.01007 -0.00267 -0.02916 222 LEU A CB 4025 C CG . LEU A 222 ? 0.57312 0.50961 0.51927 0.00906 0.00140 -0.02627 222 LEU A CG 4026 C CD1 . LEU A 222 ? 0.66355 0.59883 0.61155 0.01397 0.00453 -0.03249 222 LEU A CD1 4027 C CD2 . LEU A 222 ? 0.55362 0.48849 0.51472 0.00563 -0.00422 -0.02466 222 LEU A CD2 4039 N N A MET A 223 ? 0.56654 0.49351 0.45623 0.01039 -0.00950 -0.02346 223 MET A N 4040 N N B MET A 223 ? 0.56599 0.49293 0.45581 0.01031 -0.00958 -0.02326 223 MET A N 4041 C CA A MET A 223 ? 0.58308 0.50529 0.45289 0.01275 -0.01616 -0.02453 223 MET A CA 4042 C CA B MET A 223 ? 0.58232 0.50454 0.45216 0.01279 -0.01618 -0.02467 223 MET A CA 4043 C C A MET A 223 ? 0.57885 0.49696 0.45219 0.01185 -0.02506 -0.01983 223 MET A C 4044 C C B MET A 223 ? 0.57892 0.49683 0.45070 0.01191 -0.02491 -0.01949 223 MET A C 4045 O O A MET A 223 ? 0.59887 0.51432 0.46902 0.01435 -0.03531 -0.02447 223 MET A O 4046 O O B MET A 223 ? 0.59545 0.51028 0.46155 0.01460 -0.03506 -0.02362 223 MET A O 4047 C CB A MET A 223 ? 0.63219 0.55624 0.48041 0.01266 -0.00880 -0.01874 223 MET A CB 4048 C CB B MET A 223 ? 0.63046 0.55504 0.47866 0.01310 -0.00842 -0.02005 223 MET A CB 4049 C CG A MET A 223 ? 0.77517 0.70300 0.60669 0.01705 -0.00536 -0.02695 223 MET A CG 4050 C CG B MET A 223 ? 0.64667 0.56640 0.47008 0.01506 -0.01467 -0.01746 223 MET A CG 4051 S SD A MET A 223 ? 0.86884 0.79169 0.67660 0.02228 -0.01687 -0.03484 223 MET A SD 4052 S SD B MET A 223 ? 0.88029 0.80604 0.67781 0.01384 -0.00291 -0.01013 223 MET A SD 4053 C CE A MET A 223 ? 0.59753 0.51325 0.42224 0.02183 -0.03225 -0.03786 223 MET A CE 4054 C CE B MET A 223 ? 0.78926 0.71310 0.59715 0.00592 0.00304 0.00547 223 MET A CE 4073 N N . GLU A 224 ? 0.54116 0.45919 0.42169 0.00889 -0.02196 -0.01156 224 GLU A N 4074 C CA . GLU A 224 ? 0.56297 0.47678 0.44750 0.00961 -0.03039 -0.00805 224 GLU A CA 4075 C C . GLU A 224 ? 0.56442 0.48309 0.46733 0.01087 -0.03758 -0.01516 224 GLU A C 4076 O O . GLU A 224 ? 0.57175 0.48901 0.47474 0.01384 -0.04767 -0.01675 224 GLU A O 4077 C CB . GLU A 224 ? 0.57768 0.49025 0.46938 0.00643 -0.02571 -0.00047 224 GLU A CB 4078 C CG . GLU A 224 ? 0.59765 0.50200 0.48794 0.00840 -0.03428 0.00403 224 GLU A CG 4079 C CD . GLU A 224 ? 0.68434 0.57795 0.55074 0.00944 -0.03823 0.01131 224 GLU A CD 4080 O OE1 . GLU A 224 ? 0.70864 0.60256 0.55882 0.00689 -0.03110 0.01503 224 GLU A OE1 4081 O OE2 . GLU A 224 ? 0.78046 0.66637 0.64420 0.01334 -0.04871 0.01343 224 GLU A OE2 4089 N N . LEU A 225 ? 0.53510 0.46031 0.45421 0.00849 -0.03285 -0.01888 225 LEU A N 4090 C CA . LEU A 225 ? 0.51258 0.44393 0.45009 0.00777 -0.03841 -0.02408 225 LEU A CA 4091 C C . LEU A 225 ? 0.55403 0.48318 0.48709 0.00938 -0.04699 -0.03179 225 LEU A C 4092 O O . LEU A 225 ? 0.55953 0.49352 0.50409 0.00945 -0.05533 -0.03555 225 LEU A O 4093 C CB . LEU A 225 ? 0.49118 0.42847 0.44484 0.00406 -0.03126 -0.02387 225 LEU A CB 4094 C CG . LEU A 225 ? 0.55881 0.50109 0.51919 0.00260 -0.02474 -0.01791 225 LEU A CG 4095 C CD1 . LEU A 225 ? 0.62198 0.56981 0.59477 -0.00044 -0.01861 -0.01689 225 LEU A CD1 4096 C CD2 . LEU A 225 ? 0.61376 0.56167 0.58326 0.00378 -0.02937 -0.01768 225 LEU A CD2 4108 N N . GLU A 226 ? 0.54507 0.46866 0.46262 0.01088 -0.04542 -0.03545 226 GLU A N 4109 C CA A GLU A 226 ? 0.59610 0.51712 0.50742 0.01297 -0.05492 -0.04461 226 GLU A CA 4110 C CA B GLU A 226 ? 0.59649 0.51749 0.50771 0.01298 -0.05489 -0.04459 226 GLU A CA 4111 C C . GLU A 226 ? 0.56731 0.48716 0.46594 0.01668 -0.06498 -0.04345 226 GLU A C 4112 O O . GLU A 226 ? 0.60787 0.53041 0.51304 0.01755 -0.07611 -0.04988 226 GLU A O 4113 C CB A GLU A 226 ? 0.62025 0.53647 0.51534 0.01540 -0.05090 -0.05049 226 GLU A CB 4114 C CB B GLU A 226 ? 0.62064 0.53686 0.51535 0.01545 -0.05081 -0.05033 226 GLU A CB 4115 C CG A GLU A 226 ? 0.69091 0.60392 0.57295 0.01888 -0.06148 -0.06120 226 GLU A CG 4116 C CG B GLU A 226 ? 0.68208 0.59521 0.57058 0.01787 -0.06140 -0.06239 226 GLU A CG 4117 C CD A GLU A 226 ? 0.75990 0.67108 0.66017 0.01652 -0.06787 -0.07205 226 GLU A CD 4118 C CD B GLU A 226 ? 0.76885 0.67842 0.63808 0.02218 -0.05765 -0.07016 226 GLU A CD 4119 O OE1 A GLU A 226 ? 0.66881 0.58186 0.59277 0.01150 -0.06488 -0.06911 226 GLU A OE1 4120 O OE1 B GLU A 226 ? 0.84415 0.75538 0.70595 0.02315 -0.04603 -0.06544 226 GLU A OE1 4121 O OE2 A GLU A 226 ? 0.86827 0.77598 0.75885 0.01929 -0.07649 -0.08332 226 GLU A OE2 4122 O OE2 B GLU A 226 ? 0.91443 0.82097 0.77663 0.02487 -0.06657 -0.08204 226 GLU A OE2 4135 N N . ILE A 227 ? 0.58916 0.50475 0.47031 0.01866 -0.06199 -0.03477 227 ILE A N 4136 C CA . ILE A 227 ? 0.60914 0.52115 0.47758 0.02278 -0.07238 -0.03134 227 ILE A CA 4137 C C . ILE A 227 ? 0.61375 0.53121 0.50446 0.02356 -0.07992 -0.03162 227 ILE A C 4138 O O . ILE A 227 ? 0.62303 0.54235 0.51414 0.02746 -0.09251 -0.03514 227 ILE A O 4139 C CB . ILE A 227 ? 0.67274 0.57708 0.52042 0.02311 -0.06685 -0.01952 227 ILE A CB 4140 C CG1 . ILE A 227 ? 0.74354 0.64676 0.56701 0.02320 -0.06010 -0.02026 227 ILE A CG1 4141 C CG2 . ILE A 227 ? 0.75970 0.65756 0.59755 0.02752 -0.07858 -0.01351 227 ILE A CG2 4142 C CD1 . ILE A 227 ? 0.79099 0.69018 0.59820 0.02061 -0.05050 -0.00778 227 ILE A CD1 4154 N N . LEU A 228 ? 0.54681 0.46888 0.45645 0.02052 -0.07253 -0.02867 228 LEU A N 4155 C CA . LEU A 228 ? 0.54091 0.47130 0.47201 0.02194 -0.07768 -0.02977 228 LEU A CA 4156 C C . LEU A 228 ? 0.58447 0.52632 0.53399 0.02054 -0.08455 -0.03882 228 LEU A C 4157 O O . LEU A 228 ? 0.56902 0.51804 0.52877 0.02416 -0.09479 -0.04206 228 LEU A O 4158 C CB . LEU A 228 ? 0.55174 0.48657 0.49689 0.01870 -0.06714 -0.02613 228 LEU A CB 4159 C CG . LEU A 228 ? 0.66372 0.60847 0.62888 0.02112 -0.06987 -0.02744 228 LEU A CG 4160 C CD1 . LEU A 228 ? 0.80386 0.73913 0.76012 0.02764 -0.07731 -0.02363 228 LEU A CD1 4161 C CD2 . LEU A 228 ? 0.65446 0.60563 0.63104 0.01714 -0.05863 -0.02548 228 LEU A CD2 4173 N N . ARG A 229 ? 0.53431 0.47797 0.49000 0.01516 -0.07943 -0.04291 229 ARG A N 4174 C CA . ARG A 229 ? 0.53989 0.49248 0.51446 0.01154 -0.08565 -0.05084 229 ARG A CA 4175 C C . ARG A 229 ? 0.56233 0.51340 0.52779 0.01533 -0.09980 -0.05799 229 ARG A C 4176 O O . ARG A 229 ? 0.56687 0.52918 0.55023 0.01486 -0.10925 -0.06335 229 ARG A O 4177 C CB . ARG A 229 ? 0.57205 0.52076 0.55094 0.00564 -0.07862 -0.05306 229 ARG A CB 4178 C CG . ARG A 229 ? 0.50561 0.45960 0.49942 0.00089 -0.06713 -0.04679 229 ARG A CG 4179 C CD . ARG A 229 ? 0.53430 0.48416 0.53688 -0.00483 -0.06392 -0.04911 229 ARG A CD 4180 N NE . ARG A 229 ? 0.54158 0.47793 0.52533 -0.00192 -0.06180 -0.05219 229 ARG A NE 4181 C CZ . ARG A 229 ? 0.56015 0.49204 0.53596 -0.00075 -0.05184 -0.04734 229 ARG A CZ 4182 N NH1 . ARG A 229 ? 0.51063 0.44872 0.49394 -0.00248 -0.04391 -0.03911 229 ARG A NH1 4183 N NH2 . ARG A 229 ? 0.56355 0.48624 0.52460 0.00255 -0.05005 -0.05193 229 ARG A NH2 4197 N N . ASN A 230 ? 0.56437 0.50371 0.50209 0.01908 -0.10141 -0.05835 230 ASN A N 4198 C CA . ASN A 230 ? 0.59265 0.53058 0.51756 0.02307 -0.11525 -0.06579 230 ASN A CA 4199 C C . ASN A 230 ? 0.64780 0.58874 0.56913 0.02966 -0.12637 -0.06227 230 ASN A C 4200 O O . ASN A 230 ? 0.61335 0.56030 0.53847 0.03229 -0.14057 -0.06947 230 ASN A O 4201 C CB . ASN A 230 ? 0.61950 0.54615 0.51295 0.02574 -0.11237 -0.06706 230 ASN A CB 4202 C CG . ASN A 230 ? 0.71163 0.63497 0.60946 0.02150 -0.10511 -0.07431 230 ASN A CG 4203 O OD1 . ASN A 230 ? 0.77417 0.70145 0.69775 0.01580 -0.10422 -0.07798 230 ASN A OD1 4204 N ND2 . ASN A 230 ? 0.79228 0.70864 0.66533 0.02446 -0.09966 -0.07583 230 ASN A ND2 4211 N N A SER A 231 ? 0.63364 0.57003 0.54909 0.03268 -0.12145 -0.05181 231 SER A N 4212 N N B SER A 231 ? 0.63394 0.57019 0.54913 0.03264 -0.12131 -0.05175 231 SER A N 4213 C CA A SER A 231 ? 0.63666 0.57127 0.54588 0.04030 -0.13271 -0.04736 231 SER A CA 4214 C CA B SER A 231 ? 0.63683 0.57128 0.54591 0.04023 -0.13240 -0.04720 231 SER A CA 4215 C C A SER A 231 ? 0.62643 0.57369 0.56553 0.04230 -0.13597 -0.04857 231 SER A C 4216 C C B SER A 231 ? 0.62660 0.57515 0.56654 0.04225 -0.13751 -0.04997 231 SER A C 4217 O O A SER A 231 ? 0.65645 0.60213 0.59429 0.05002 -0.14578 -0.04551 231 SER A O 4218 O O B SER A 231 ? 0.64460 0.59457 0.58492 0.04992 -0.15020 -0.04952 231 SER A O 4219 C CB A SER A 231 ? 0.67687 0.59591 0.56048 0.04269 -0.12715 -0.03485 231 SER A CB 4220 C CB B SER A 231 ? 0.67314 0.59306 0.56129 0.04224 -0.12562 -0.03440 231 SER A CB 4221 O OG A SER A 231 ? 0.64227 0.56068 0.53920 0.03980 -0.11583 -0.02930 231 SER A OG 4222 O OG B SER A 231 ? 0.72011 0.63057 0.57959 0.04052 -0.11996 -0.03126 231 SER A OG 4233 N N . ALA A 232 ? 0.58539 0.54556 0.55080 0.03611 -0.12819 -0.05279 232 ALA A N 4234 C CA . ALA A 232 ? 0.58366 0.55995 0.57730 0.03814 -0.12960 -0.05481 232 ALA A CA 4235 C C . ALA A 232 ? 0.59377 0.58516 0.60393 0.04168 -0.14487 -0.06322 232 ALA A C 4236 O O . ALA A 232 ? 0.63675 0.62887 0.64303 0.03915 -0.15266 -0.06933 232 ALA A O 4237 C CB . ALA A 232 ? 0.63669 0.62459 0.65175 0.02966 -0.11617 -0.05565 232 ALA A CB 4244 N N . PRO A 233 ? 0.65383 0.65848 0.68369 0.04813 -0.15009 -0.06491 233 PRO A N 4245 C CA . PRO A 233 ? 0.69101 0.71374 0.74036 0.05208 -0.16502 -0.07339 233 PRO A CA 4246 C C . PRO A 233 ? 0.62510 0.66759 0.70077 0.04131 -0.16240 -0.08101 233 PRO A C 4247 O O . PRO A 233 ? 0.57866 0.62499 0.66417 0.03208 -0.14820 -0.07902 233 PRO A O 4248 C CB . PRO A 233 ? 0.64823 0.68281 0.71646 0.06153 -0.16740 -0.07389 233 PRO A CB 4249 C CG . PRO A 233 ? 0.70032 0.72110 0.75771 0.06192 -0.15430 -0.06627 233 PRO A CG 4250 C CD . PRO A 233 ? 0.68144 0.68062 0.71049 0.05483 -0.14594 -0.05926 233 PRO A CD 4258 N N . GLU A 234 ? 0.59474 0.65019 0.68310 0.04230 -0.17719 -0.08934 234 GLU A N 4259 C CA . GLU A 234 ? 0.54368 0.61918 0.66151 0.03113 -0.17673 -0.09665 234 GLU A CA 4260 C C . GLU A 234 ? 0.57986 0.67787 0.72819 0.02665 -0.16389 -0.09507 234 GLU A C 4261 O O . GLU A 234 ? 0.59102 0.70200 0.75073 0.03564 -0.16457 -0.09525 234 GLU A O 4262 C CB . GLU A 234 ? 0.65504 0.74645 0.78806 0.03417 -0.19611 -0.10661 234 GLU A CB 4263 C CG . GLU A 234 ? 0.86947 0.94347 0.97134 0.04369 -0.21199 -0.10784 234 GLU A CG 4264 C CD . GLU A 234 ? 1.12628 1.21423 1.24149 0.04241 -0.23053 -0.11955 234 GLU A CD 4265 O OE1 . GLU A 234 ? 0.81798 0.93223 0.97159 0.03553 -0.23200 -0.12622 234 GLU A OE1 4266 O OE2 . GLU A 234 ? 1.44201 1.51608 1.52946 0.04792 -0.24363 -0.12208 234 GLU A OE2 4273 N N . GLY A 235 ? 0.55496 0.65758 0.71598 0.01321 -0.15259 -0.09366 235 GLY A N 4274 C CA . GLY A 235 ? 0.61453 0.74040 0.80268 0.00719 -0.13962 -0.09114 235 GLY A CA 4275 C C . GLY A 235 ? 0.53375 0.65144 0.70862 0.01008 -0.12446 -0.08304 235 GLY A C 4276 O O . GLY A 235 ? 0.55136 0.68873 0.74518 0.00543 -0.11272 -0.08072 235 GLY A O 4280 N N . SER A 236 ? 0.50029 0.59107 0.64339 0.01697 -0.12422 -0.07862 236 SER A N 4281 C CA . SER A 236 ? 0.50186 0.58478 0.63340 0.01952 -0.11131 -0.07186 236 SER A CA 4282 C C . SER A 236 ? 0.52234 0.60143 0.65287 0.00786 -0.09714 -0.06590 236 SER A C 4283 O O . SER A 236 ? 0.46852 0.53374 0.59025 0.00098 -0.09793 -0.06507 236 SER A O 4284 C CB . SER A 236 ? 0.52926 0.58466 0.62875 0.02826 -0.11521 -0.06782 236 SER A CB 4285 O OG . SER A 236 ? 0.55062 0.59656 0.63912 0.02791 -0.10250 -0.06141 236 SER A OG 4291 N N . PRO A 237 ? 0.48936 0.57949 0.62730 0.00641 -0.08462 -0.06200 237 PRO A N 4292 C CA . PRO A 237 ? 0.47471 0.55934 0.60881 -0.00341 -0.07215 -0.05482 237 PRO A CA 4293 C C . PRO A 237 ? 0.50575 0.56198 0.61109 -0.00174 -0.06945 -0.05006 237 PRO A C 4294 O O . PRO A 237 ? 0.50818 0.55607 0.60940 -0.00922 -0.06254 -0.04523 237 PRO A O 4295 C CB . PRO A 237 ? 0.52764 0.63350 0.67403 -0.00283 -0.06103 -0.05279 237 PRO A CB 4296 C CG . PRO A 237 ? 0.60992 0.72063 0.75623 0.01011 -0.06700 -0.05886 237 PRO A CG 4297 C CD . PRO A 237 ? 0.56135 0.67172 0.71301 0.01399 -0.08185 -0.06496 237 PRO A CD 4305 N N . LEU A 238 ? 0.49997 0.54149 0.58634 0.00762 -0.07494 -0.05081 238 LEU A N 4306 C CA . LEU A 238 ? 0.47127 0.48894 0.53163 0.00837 -0.07183 -0.04609 238 LEU A CA 4307 C C . LEU A 238 ? 0.48343 0.48867 0.53463 0.00376 -0.07556 -0.04767 238 LEU A C 4308 O O . LEU A 238 ? 0.49371 0.48361 0.52782 0.00252 -0.07020 -0.04428 238 LEU A O 4309 C CB . LEU A 238 ? 0.53901 0.54419 0.58235 0.01798 -0.07795 -0.04541 238 LEU A CB 4310 C CG . LEU A 238 ? 0.57628 0.58816 0.62619 0.02401 -0.07526 -0.04517 238 LEU A CG 4311 C CD1 . LEU A 238 ? 0.67024 0.66457 0.70303 0.03258 -0.08320 -0.04323 238 LEU A CD1 4312 C CD2 . LEU A 238 ? 0.61171 0.62489 0.66104 0.01957 -0.06221 -0.04099 238 LEU A CD2 4324 N N . ARG A 239 ? 0.47872 0.49148 0.54226 0.00145 -0.08491 -0.05392 239 ARG A N 4325 C CA . ARG A 239 ? 0.49959 0.50055 0.55595 -0.00274 -0.08968 -0.05793 239 ARG A CA 4326 C C . ARG A 239 ? 0.51724 0.51321 0.57884 -0.01128 -0.08008 -0.05444 239 ARG A C 4327 O O . ARG A 239 ? 0.46602 0.44662 0.51571 -0.01248 -0.08133 -0.05715 239 ARG A O 4328 C CB . ARG A 239 ? 0.50701 0.51948 0.58035 -0.00469 -0.10251 -0.06630 239 ARG A CB 4329 C CG . ARG A 239 ? 0.50774 0.50866 0.57665 -0.00937 -0.10935 -0.07313 239 ARG A CG 4330 C CD . ARG A 239 ? 0.54898 0.55578 0.62119 -0.00646 -0.12612 -0.08285 239 ARG A CD 4331 N NE . ARG A 239 ? 0.52425 0.51998 0.56716 0.00438 -0.13244 -0.08305 239 ARG A NE 4332 C CZ . ARG A 239 ? 0.53755 0.53937 0.57730 0.01281 -0.13745 -0.08042 239 ARG A CZ 4333 N NH1 . ARG A 239 ? 0.55927 0.58151 0.62532 0.01333 -0.14042 -0.08154 239 ARG A NH1 4334 N NH2 . ARG A 239 ? 0.58785 0.57505 0.59791 0.02099 -0.13905 -0.07611 239 ARG A NH2 4348 N N . VAL A 240 ? 0.48373 0.49223 0.56192 -0.01648 -0.07084 -0.04860 240 VAL A N 4349 C CA . VAL A 240 ? 0.48064 0.48338 0.56396 -0.02447 -0.06326 -0.04370 240 VAL A CA 4350 C C . VAL A 240 ? 0.50677 0.50869 0.58178 -0.02276 -0.05138 -0.03536 240 VAL A C 4351 O O . VAL A 240 ? 0.52045 0.52646 0.60480 -0.02902 -0.04400 -0.02883 240 VAL A O 4352 C CB . VAL A 240 ? 0.49282 0.51066 0.60416 -0.03510 -0.06360 -0.04262 240 VAL A CB 4353 C CG1 . VAL A 240 ? 0.56130 0.57590 0.68113 -0.03843 -0.07638 -0.05185 240 VAL A CG1 4354 C CG2 . VAL A 240 ? 0.52119 0.56567 0.64951 -0.03520 -0.05952 -0.04031 240 VAL A CG2 4364 N N . LEU A 241 ? 0.47355 0.46891 0.53024 -0.01477 -0.05029 -0.03514 241 LEU A N 4365 C CA . LEU A 241 ? 0.50012 0.49274 0.54737 -0.01289 -0.04070 -0.02880 241 LEU A CA 4366 C C . LEU A 241 ? 0.49329 0.46853 0.52574 -0.01269 -0.03793 -0.02760 241 LEU A C 4367 O O . LEU A 241 ? 0.51550 0.47943 0.53124 -0.00807 -0.04131 -0.03090 241 LEU A O 4368 C CB . LEU A 241 ? 0.47684 0.47026 0.51446 -0.00543 -0.04170 -0.02936 241 LEU A CB 4369 C CG . LEU A 241 ? 0.49308 0.48249 0.52042 -0.00331 -0.03382 -0.02444 241 LEU A CG 4370 C CD1 . LEU A 241 ? 0.50751 0.51049 0.54710 -0.00745 -0.02604 -0.02053 241 LEU A CD1 4371 C CD2 . LEU A 241 ? 0.57050 0.55799 0.59100 0.00334 -0.03713 -0.02571 241 LEU A CD2 4383 N N . TYR A 242 ? 0.47365 0.44801 0.51204 -0.01717 -0.03169 -0.02255 242 TYR A N 4384 C CA . TYR A 242 ? 0.48399 0.44452 0.51240 -0.01602 -0.02846 -0.02153 242 TYR A CA 4385 C C . TYR A 242 ? 0.51499 0.47987 0.54262 -0.01592 -0.01977 -0.01387 242 TYR A C 4386 O O . TYR A 242 ? 0.47545 0.45326 0.51255 -0.01882 -0.01629 -0.00898 242 TYR A O 4387 C CB . TYR A 242 ? 0.49318 0.44532 0.53132 -0.02081 -0.03190 -0.02335 242 TYR A CB 4388 C CG . TYR A 242 ? 0.51262 0.45877 0.55065 -0.02082 -0.04177 -0.03294 242 TYR A CG 4389 C CD1 . TYR A 242 ? 0.53926 0.49536 0.59317 -0.02597 -0.04787 -0.03513 242 TYR A CD1 4390 C CD2 . TYR A 242 ? 0.56163 0.49432 0.58410 -0.01557 -0.04505 -0.04052 242 TYR A CD2 4391 C CE1 . TYR A 242 ? 0.58568 0.53733 0.64023 -0.02602 -0.05841 -0.04479 242 TYR A CE1 4392 C CE2 . TYR A 242 ? 0.53379 0.46165 0.55429 -0.01512 -0.05499 -0.05040 242 TYR A CE2 4393 C CZ . TYR A 242 ? 0.60448 0.54124 0.64113 -0.02041 -0.06237 -0.05260 242 TYR A CZ 4394 O OH . TYR A 242 ? 0.66428 0.59725 0.69956 -0.01994 -0.07391 -0.06344 242 TYR A OH 4404 N N . SER A 243 ? 0.50521 0.46121 0.52162 -0.01232 -0.01637 -0.01351 243 SER A N 4405 C CA . SER A 243 ? 0.48721 0.44741 0.50248 -0.01154 -0.00951 -0.00733 243 SER A CA 4406 C C . SER A 243 ? 0.59660 0.54718 0.61028 -0.00971 -0.00770 -0.00685 243 SER A C 4407 O O . SER A 243 ? 0.54159 0.48185 0.54997 -0.00711 -0.01053 -0.01310 243 SER A O 4408 C CB . SER A 243 ? 0.53634 0.49912 0.54062 -0.00793 -0.00702 -0.00770 243 SER A CB 4409 O OG . SER A 243 ? 0.53393 0.50261 0.53885 -0.00772 -0.00157 -0.00290 243 SER A OG 4415 N N . GLY A 244 ? 0.48343 0.43833 0.50148 -0.01015 -0.00350 -0.00010 244 GLY A N 4416 C CA . GLY A 244 ? 0.49241 0.44142 0.50858 -0.00608 -0.00126 0.00048 244 GLY A CA 4417 C C . GLY A 244 ? 0.50471 0.46209 0.51422 -0.00316 0.00364 0.00167 244 GLY A C 4418 O O . GLY A 244 ? 0.52144 0.48762 0.52914 -0.00493 0.00493 0.00330 244 GLY A O 4422 N N . ILE A 245 ? 0.43827 0.39328 0.44560 0.00146 0.00604 -0.00012 245 ILE A N 4423 C CA . ILE A 245 ? 0.42840 0.39272 0.43263 0.00322 0.01063 0.00106 245 ILE A CA 4424 C C . ILE A 245 ? 0.44764 0.41332 0.45830 0.00777 0.01198 0.00254 245 ILE A C 4425 O O . ILE A 245 ? 0.46912 0.42635 0.48138 0.01213 0.01083 -0.00172 245 ILE A O 4426 C CB . ILE A 245 ? 0.44265 0.40656 0.43613 0.00428 0.01320 -0.00390 245 ILE A CB 4427 C CG1 . ILE A 245 ? 0.49533 0.45610 0.48208 0.00117 0.01017 -0.00496 245 ILE A CG1 4428 C CG2 . ILE A 245 ? 0.50263 0.47698 0.49638 0.00405 0.01798 -0.00162 245 ILE A CG2 4429 C CD1 . ILE A 245 ? 0.57500 0.53282 0.54852 0.00204 0.01166 -0.00790 245 ILE A CD1 4441 N N . GLY A 246 ? 0.42607 0.40243 0.44081 0.00757 0.01345 0.00755 246 GLY A N 4442 C CA . GLY A 246 ? 0.43530 0.41586 0.45702 0.01283 0.01394 0.00904 246 GLY A CA 4443 C C . GLY A 246 ? 0.47837 0.47328 0.50068 0.01276 0.01759 0.00835 246 GLY A C 4444 O O . GLY A 246 ? 0.46868 0.46997 0.48816 0.00801 0.01795 0.00989 246 GLY A O 4448 N N . LEU A 247 ? 0.43999 0.44048 0.46751 0.01817 0.02008 0.00508 247 LEU A N 4449 C CA . LEU A 247 ? 0.42567 0.44217 0.45756 0.01741 0.02362 0.00445 247 LEU A CA 4450 C C . LEU A 247 ? 0.47634 0.50231 0.52047 0.02403 0.02174 0.00573 247 LEU A C 4451 O O . LEU A 247 ? 0.45762 0.47742 0.50631 0.03139 0.02036 0.00367 247 LEU A O 4452 C CB . LEU A 247 ? 0.44176 0.46217 0.46960 0.01694 0.03012 -0.00103 247 LEU A CB 4453 C CG . LEU A 247 ? 0.49851 0.50837 0.51257 0.01282 0.03167 -0.00293 247 LEU A CG 4454 C CD1 . LEU A 247 ? 0.51685 0.53284 0.52616 0.01407 0.03867 -0.00735 247 LEU A CD1 4455 C CD2 . LEU A 247 ? 0.50175 0.51104 0.51152 0.00530 0.03014 0.00090 247 LEU A CD2 4467 N N . ALA A 248 ? 0.43439 0.47511 0.48451 0.02201 0.02073 0.00822 248 ALA A N 4468 C CA . ALA A 248 ? 0.43438 0.48758 0.49719 0.02855 0.01798 0.00920 248 ALA A CA 4469 C C . ALA A 248 ? 0.47811 0.55115 0.54861 0.02454 0.02030 0.00702 248 ALA A C 4470 O O . ALA A 248 ? 0.50999 0.58401 0.57514 0.01613 0.02233 0.00651 248 ALA A O 4471 C CB . ALA A 248 ? 0.49343 0.54308 0.55602 0.03069 0.01040 0.01703 248 ALA A CB 4477 N N . LYS A 249 ? 0.44708 0.53578 0.53191 0.03063 0.01918 0.00554 249 LYS A N 4478 C CA A LYS A 249 ? 0.44588 0.55620 0.54230 0.02650 0.02088 0.00305 249 LYS A CA 4479 C CA B LYS A 249 ? 0.44562 0.55588 0.54196 0.02645 0.02085 0.00308 249 LYS A CA 4480 C C . LYS A 249 ? 0.48892 0.61298 0.59631 0.03135 0.01254 0.00546 249 LYS A C 4481 O O . LYS A 249 ? 0.48898 0.61098 0.60104 0.04142 0.00785 0.00763 249 LYS A O 4482 C CB A LYS A 249 ? 0.47129 0.59436 0.57753 0.02879 0.02927 -0.00275 249 LYS A CB 4483 C CB B LYS A 249 ? 0.47104 0.59431 0.57729 0.02853 0.02927 -0.00271 249 LYS A CB 4484 C CG A LYS A 249 ? 0.47937 0.62718 0.60101 0.02310 0.03183 -0.00476 249 LYS A CG 4485 C CG B LYS A 249 ? 0.47983 0.62702 0.60061 0.02207 0.03183 -0.00453 249 LYS A CG 4486 C CD A LYS A 249 ? 0.52714 0.68877 0.65609 0.02360 0.04260 -0.00956 249 LYS A CD 4487 C CD B LYS A 249 ? 0.53182 0.69612 0.66366 0.02451 0.04143 -0.00962 249 LYS A CD 4488 C CE A LYS A 249 ? 0.52478 0.71163 0.67025 0.01475 0.04627 -0.01029 249 LYS A CE 4489 C CE B LYS A 249 ? 0.51059 0.70173 0.66113 0.01713 0.04362 -0.01067 249 LYS A CE 4490 N NZ A LYS A 249 ? 0.53007 0.74205 0.69885 0.02300 0.04293 -0.01379 249 LYS A NZ 4491 N NZ B LYS A 249 ? 0.54061 0.75114 0.70076 0.01675 0.05553 -0.01462 249 LYS A NZ 4518 N N . GLY A 250 ? 0.44708 0.58425 0.55856 0.02448 0.00965 0.00491 250 GLY A N 4519 C CA . GLY A 250 ? 0.47938 0.63279 0.60142 0.02923 0.00091 0.00611 250 GLY A CA 4520 C C . GLY A 250 ? 0.47253 0.63865 0.59760 0.02020 -0.00282 0.00342 250 GLY A C 4521 O O . GLY A 250 ? 0.46929 0.62956 0.58881 0.01022 0.00119 0.00103 250 GLY A O 4525 N N . LYS A 251 ? 0.43896 0.69722 0.58930 0.06733 -0.02104 -0.00345 251 LYS A N 4526 C CA . LYS A 251 ? 0.43713 0.71196 0.59373 0.05523 -0.02548 -0.00820 251 LYS A CA 4527 C C . LYS A 251 ? 0.46946 0.70339 0.59616 0.05252 -0.02826 0.00456 251 LYS A C 4528 O O . LYS A 251 ? 0.53515 0.74215 0.64001 0.06830 -0.03657 0.01055 251 LYS A O 4529 C CB . LYS A 251 ? 0.46607 0.77976 0.64260 0.07052 -0.04154 -0.02320 251 LYS A CB 4530 C CG . LYS A 251 ? 0.59921 0.92928 0.78011 0.05984 -0.04931 -0.02941 251 LYS A CG 4531 C CD . LYS A 251 ? 1.17927 1.52789 1.36375 0.08412 -0.07264 -0.03964 251 LYS A CD 4532 C CE . LYS A 251 ? 1.44014 1.73569 1.58098 0.09770 -0.08397 -0.02516 251 LYS A CE 4533 N NZ . LYS A 251 ? 1.21791 1.52420 1.35413 0.10303 -0.10253 -0.03280 251 LYS A NZ 4547 N N . VAL A 252 ? 0.41348 0.63954 0.53553 0.03251 -0.02060 0.00770 252 VAL A N 4548 C CA . VAL A 252 ? 0.41213 0.60366 0.50914 0.02898 -0.02130 0.01721 252 VAL A CA 4549 C C . VAL A 252 ? 0.47084 0.67285 0.56891 0.01566 -0.02454 0.01235 252 VAL A C 4550 O O . VAL A 252 ? 0.44873 0.68138 0.56584 0.00415 -0.02268 0.00227 252 VAL A O 4551 C CB . VAL A 252 ? 0.44001 0.60370 0.52554 0.02100 -0.00931 0.02565 252 VAL A CB 4552 C CG1 . VAL A 252 ? 0.50657 0.65915 0.58998 0.03227 -0.00609 0.02924 252 VAL A CG1 4553 C CG2 . VAL A 252 ? 0.44901 0.61966 0.54093 0.00404 -0.00025 0.02297 252 VAL A CG2 4563 N N . ILE A 253 ? 0.41211 0.58770 0.48805 0.01572 -0.02816 0.01820 253 ILE A N 4564 C CA . ILE A 253 ? 0.40667 0.58379 0.47765 0.00227 -0.03025 0.01478 253 ILE A CA 4565 C C . ILE A 253 ? 0.44847 0.60197 0.50843 -0.01197 -0.01801 0.02005 253 ILE A C 4566 O O . ILE A 253 ? 0.49327 0.62108 0.54096 -0.00723 -0.01288 0.02737 253 ILE A O 4567 C CB . ILE A 253 ? 0.44751 0.60638 0.49655 0.01099 -0.04124 0.01708 253 ILE A CB 4568 C CG1 . ILE A 253 ? 0.51636 0.69587 0.57174 0.02871 -0.05745 0.01025 253 ILE A CG1 4569 C CG2 . ILE A 253 ? 0.50605 0.66342 0.54784 -0.00379 -0.04255 0.01350 253 ILE A CG2 4570 C CD1 . ILE A 253 ? 0.63981 0.78912 0.66223 0.04203 -0.06937 0.01440 253 ILE A CD1 4582 N N . GLU A 254 ? 0.42537 0.58668 0.48829 -0.02922 -0.01344 0.01463 254 GLU A N 4583 C CA . GLU A 254 ? 0.45749 0.58996 0.50258 -0.04048 -0.00444 0.01860 254 GLU A CA 4584 C C . GLU A 254 ? 0.52865 0.64940 0.55816 -0.05152 -0.00704 0.01591 254 GLU A C 4585 O O . GLU A 254 ? 0.52464 0.66711 0.56215 -0.06311 -0.00986 0.00713 254 GLU A O 4586 C CB . GLU A 254 ? 0.49974 0.63664 0.54839 -0.05304 0.00524 0.01530 254 GLU A CB 4587 C CG . GLU A 254 ? 0.52366 0.62168 0.54508 -0.06069 0.01193 0.01965 254 GLU A CG 4588 C CD . GLU A 254 ? 0.72346 0.81587 0.73858 -0.07189 0.02179 0.01767 254 GLU A CD 4589 O OE1 . GLU A 254 ? 0.65031 0.77307 0.68330 -0.08188 0.02655 0.00984 254 GLU A OE1 4590 O OE2 . GLU A 254 ? 0.74067 0.79893 0.73271 -0.06917 0.02437 0.02272 254 GLU A OE2 4597 N N . GLY A 255 ? 0.46771 0.55692 0.47662 -0.04828 -0.00596 0.02128 255 GLY A N 4598 C CA . GLY A 255 ? 0.51723 0.59111 0.50800 -0.05825 -0.00782 0.01856 255 GLY A CA 4599 C C . GLY A 255 ? 0.49745 0.54005 0.46909 -0.05017 -0.00615 0.02307 255 GLY A C 4600 O O . GLY A 255 ? 0.47665 0.51131 0.45095 -0.03919 -0.00259 0.02670 255 GLY A O 4604 N N . ASN A 256 ? 0.50488 0.53238 0.45865 -0.05657 -0.00832 0.02059 256 ASN A N 4605 C CA . ASN A 256 ? 0.53611 0.53621 0.47193 -0.04978 -0.00575 0.02187 256 ASN A CA 4606 C C . ASN A 256 ? 0.52431 0.52866 0.46081 -0.04048 -0.00787 0.02354 256 ASN A C 4607 O O . ASN A 256 ? 0.54471 0.55551 0.47571 -0.04309 -0.01510 0.02217 256 ASN A O 4608 C CB . ASN A 256 ? 0.54436 0.52121 0.45579 -0.06086 -0.00613 0.01803 256 ASN A CB 4609 C CG . ASN A 256 ? 0.59457 0.54978 0.49121 -0.06944 -0.00199 0.01694 256 ASN A CG 4610 O OD1 . ASN A 256 ? 0.59922 0.53627 0.48976 -0.05939 0.00079 0.01865 256 ASN A OD1 4611 N ND2 . ASN A 256 ? 0.65073 0.60658 0.53935 -0.08843 -0.00179 0.01278 256 ASN A ND2 4618 N N A ILE A 257 ? 0.50344 0.50123 0.44295 -0.03045 -0.00148 0.02509 257 ILE A N 4619 N N B ILE A 257 ? 0.50511 0.50382 0.44537 -0.03041 -0.00163 0.02522 257 ILE A N 4620 C CA A ILE A 257 ? 0.55214 0.54727 0.48694 -0.02421 0.00058 0.02664 257 ILE A CA 4621 C CA B ILE A 257 ? 0.55259 0.54725 0.48684 -0.02441 0.00055 0.02654 257 ILE A CA 4622 C C A ILE A 257 ? 0.55689 0.53485 0.48287 -0.02184 0.01081 0.02237 257 ILE A C 4623 C C B ILE A 257 ? 0.55817 0.53510 0.48296 -0.02244 0.01036 0.02209 257 ILE A C 4624 O O A ILE A 257 ? 0.57792 0.55871 0.51665 -0.01723 0.01619 0.01888 257 ILE A O 4625 O O B ILE A 257 ? 0.57975 0.55706 0.51471 -0.01845 0.01478 0.01837 257 ILE A O 4626 C CB A ILE A 257 ? 0.56512 0.57448 0.51602 -0.01733 0.00133 0.03011 257 ILE A CB 4627 C CB B ILE A 257 ? 0.56528 0.57267 0.51441 -0.01726 0.00193 0.02997 257 ILE A CB 4628 C CG1 A ILE A 257 ? 0.53262 0.56295 0.49374 -0.01732 -0.00907 0.03149 257 ILE A CG1 4629 C CG1 B ILE A 257 ? 0.52525 0.55569 0.49117 -0.01771 -0.00585 0.03144 257 ILE A CG1 4630 C CG2 A ILE A 257 ? 0.56571 0.56076 0.50352 -0.01323 0.00766 0.03104 257 ILE A CG2 4631 C CG2 B ILE A 257 ? 0.59218 0.58633 0.52354 -0.01342 0.00281 0.03204 257 ILE A CG2 4632 C CD1 A ILE A 257 ? 0.61444 0.66182 0.59638 -0.01258 -0.00768 0.03321 257 ILE A CD1 4633 C CD1 B ILE A 257 ? 0.57535 0.61647 0.53744 -0.01596 -0.01725 0.03093 257 ILE A CD1 4656 N N . GLY A 258 ? 0.56260 0.52427 0.46705 -0.02430 0.01316 0.02083 258 GLY A N 4657 C CA . GLY A 258 ? 0.60356 0.55226 0.50083 -0.02352 0.02534 0.01385 258 GLY A CA 4658 C C . GLY A 258 ? 0.61131 0.53835 0.47937 -0.02871 0.02624 0.01186 258 GLY A C 4659 O O . GLY A 258 ? 0.69227 0.61225 0.54237 -0.03171 0.01741 0.01658 258 GLY A O 4664 N N . SER A 259 ? 0.65169 0.56918 0.51524 -0.02814 0.03639 0.00311 259 SER A N 4665 C CA . SER A 259 ? 0.71869 0.61329 0.55316 -0.03305 0.04059 -0.00076 259 SER A CA 4666 C C . SER A 259 ? 0.75008 0.63494 0.57666 -0.03344 0.03368 -0.00355 259 SER A C 4667 O O . SER A 259 ? 0.72213 0.61392 0.56267 -0.03002 0.02763 -0.00311 259 SER A O 4668 C CB . SER A 259 ? 0.74343 0.63408 0.57720 -0.03327 0.05970 -0.01175 259 SER A CB 4669 O OG . SER A 259 ? 0.72730 0.63223 0.58551 -0.02474 0.06326 -0.02232 259 SER A OG 4675 N N . GLU A 260 ? 0.81456 0.67717 0.61262 -0.03836 0.03552 -0.00680 260 GLU A N 4676 C CA . GLU A 260 ? 0.85022 0.69703 0.63597 -0.03888 0.03167 -0.01132 260 GLU A CA 4677 C C . GLU A 260 ? 0.76943 0.61780 0.56988 -0.02716 0.03903 -0.02112 260 GLU A C 4678 O O . GLU A 260 ? 0.95835 0.79254 0.75137 -0.02344 0.03309 -0.02335 260 GLU A O 4679 C CB . GLU A 260 ? 0.92503 0.74587 0.67584 -0.04555 0.03374 -0.01465 260 GLU A CB 4680 C CG . GLU A 260 ? 1.15532 0.97152 0.88628 -0.05326 0.02522 -0.00769 260 GLU A CG 4681 C CD . GLU A 260 ? 1.28263 1.08968 0.99932 -0.05288 0.03677 -0.00783 260 GLU A CD 4682 O OE1 . GLU A 260 ? 1.04301 0.86340 0.78066 -0.04879 0.04861 -0.00987 260 GLU A OE1 4683 O OE2 . GLU A 260 ? 1.37363 1.15703 1.05453 -0.05781 0.03450 -0.00679 260 GLU A OE2 4690 N N . LEU A 261 ? 0.80787 0.67188 0.62700 -0.02108 0.05150 -0.02862 261 LEU A N 4691 C CA . LEU A 261 ? 0.84405 0.71664 0.68152 -0.00716 0.05730 -0.04253 261 LEU A CA 4692 C C . LEU A 261 ? 0.86850 0.75614 0.72975 0.00288 0.04760 -0.04013 261 LEU A C 4693 O O . LEU A 261 ? 0.78731 0.66720 0.64915 0.01666 0.04176 -0.04730 261 LEU A O 4694 C CB . LEU A 261 ? 0.91301 0.80305 0.76529 -0.00795 0.07584 -0.05486 261 LEU A CB 4695 C CG . LEU A 261 ? 1.10297 0.98109 0.93880 -0.01021 0.09099 -0.06859 261 LEU A CG 4696 C CD1 . LEU A 261 ? 1.02644 0.93476 0.89312 -0.00731 0.10954 -0.08780 261 LEU A CD1 4697 C CD2 . LEU A 261 ? 1.03636 0.89281 0.85499 -0.00027 0.08409 -0.07468 261 LEU A CD2 4709 N N . LYS A 262 ? 0.67831 0.58297 0.55452 -0.00246 0.04492 -0.03032 262 LYS A N 4710 C CA . LYS A 262 ? 0.60347 0.52274 0.50137 0.00618 0.03766 -0.02867 262 LYS A CA 4711 C C . LYS A 262 ? 0.65146 0.57971 0.55367 -0.00343 0.03236 -0.01461 262 LYS A C 4712 O O . LYS A 262 ? 0.61521 0.55142 0.51900 -0.01063 0.03791 -0.01080 262 LYS A O 4713 C CB . LYS A 262 ? 0.65431 0.60015 0.58273 0.01623 0.04595 -0.04222 262 LYS A CB 4714 C CG . LYS A 262 ? 0.73711 0.69445 0.68419 0.02884 0.03597 -0.04334 262 LYS A CG 4715 C CD . LYS A 262 ? 0.72915 0.71059 0.69868 0.02299 0.03940 -0.03852 262 LYS A CD 4716 C CE . LYS A 262 ? 0.79347 0.78983 0.78397 0.03668 0.03113 -0.04386 262 LYS A CE 4717 N NZ . LYS A 262 ? 0.79782 0.77734 0.77365 0.03645 0.01879 -0.02994 262 LYS A NZ 4731 N N . ARG A 263 ? 0.62097 0.54479 0.52144 -0.00333 0.02225 -0.00794 263 ARG A N 4732 C CA A ARG A 263 ? 0.60136 0.53805 0.50994 -0.01091 0.01737 0.00252 263 ARG A CA 4733 C CA B ARG A 263 ? 0.60180 0.54039 0.51237 -0.01035 0.01816 0.00219 263 ARG A CA 4734 C C . ARG A 263 ? 0.60572 0.55184 0.53067 -0.00323 0.01411 0.00311 263 ARG A C 4735 O O . ARG A 263 ? 0.57690 0.51212 0.49881 0.00766 0.01144 -0.00309 263 ARG A O 4736 C CB A ARG A 263 ? 0.68492 0.60952 0.57458 -0.02327 0.01029 0.00819 263 ARG A CB 4737 C CB B ARG A 263 ? 0.69680 0.62741 0.59066 -0.02321 0.01138 0.00883 263 ARG A CB 4738 C CG A ARG A 263 ? 0.70507 0.63130 0.58453 -0.03195 0.00922 0.01040 263 ARG A CG 4739 C CG B ARG A 263 ? 0.71178 0.62219 0.58873 -0.02786 0.00644 0.00881 263 ARG A CG 4740 C CD A ARG A 263 ? 0.79772 0.70640 0.65395 -0.04307 0.00393 0.00929 263 ARG A CD 4741 C CD B ARG A 263 ? 0.76275 0.66320 0.62004 -0.04281 0.00288 0.00954 263 ARG A CD 4742 N NE A ARG A 263 ? 0.86544 0.76652 0.70477 -0.04667 0.00360 0.00791 263 ARG A NE 4743 N NE B ARG A 263 ? 0.85466 0.73847 0.69398 -0.04162 0.00549 0.00493 263 ARG A NE 4744 C CZ A ARG A 263 ? 0.84862 0.76207 0.68911 -0.04796 -0.00097 0.01131 263 ARG A CZ 4745 C CZ B ARG A 263 ? 0.84402 0.71598 0.66294 -0.05324 0.00208 0.00382 263 ARG A CZ 4746 N NH1 A ARG A 263 ? 0.83882 0.77591 0.69950 -0.04589 -0.00581 0.01564 263 ARG A NH1 4747 N NH1 B ARG A 263 ? 0.88676 0.76538 0.70373 -0.06795 -0.00405 0.00514 263 ARG A NH1 4748 N NH2 A ARG A 263 ? 0.86377 0.76194 0.68070 -0.04985 -0.00141 0.00983 263 ARG A NH2 4749 N NH2 B ARG A 263 ? 0.92897 0.78394 0.72982 -0.05108 0.00560 -0.00062 263 ARG A NH2 4776 N N A ASP A 264 ? 0.51424 0.47788 0.45295 -0.00755 0.01285 0.01014 264 ASP A N 4777 N N B ASP A 264 ? 0.50818 0.47235 0.44762 -0.00714 0.01314 0.00988 264 ASP A N 4778 C CA A ASP A 264 ? 0.54760 0.51935 0.49887 -0.00283 0.00992 0.01209 264 ASP A CA 4779 C CA B ASP A 264 ? 0.54725 0.51869 0.49808 -0.00308 0.00982 0.01222 264 ASP A CA 4780 C C A ASP A 264 ? 0.53365 0.51025 0.48283 -0.01378 0.00626 0.01978 264 ASP A C 4781 C C B ASP A 264 ? 0.53257 0.50627 0.47858 -0.01476 0.00597 0.01962 264 ASP A C 4782 O O A ASP A 264 ? 0.54436 0.53458 0.49845 -0.01999 0.00577 0.02310 264 ASP A O 4783 O O B ASP A 264 ? 0.55441 0.53790 0.50099 -0.02259 0.00503 0.02240 264 ASP A O 4784 C CB A ASP A 264 ? 0.59134 0.58468 0.56634 0.00300 0.01484 0.00989 264 ASP A CB 4785 C CB B ASP A 264 ? 0.60264 0.59659 0.57754 0.00192 0.01402 0.01148 264 ASP A CB 4786 C CG A ASP A 264 ? 0.56201 0.55940 0.54710 0.01314 0.01924 -0.00232 264 ASP A CG 4787 C CG B ASP A 264 ? 0.54094 0.54147 0.52666 0.00896 0.02111 0.00076 264 ASP A CG 4788 O OD1 A ASP A 264 ? 0.56070 0.55101 0.54445 0.02417 0.01322 -0.00842 264 ASP A OD1 4789 O OD1 B ASP A 264 ? 0.57232 0.56502 0.55478 0.01757 0.01957 -0.00828 264 ASP A OD1 4790 O OD2 A ASP A 264 ? 0.57211 0.57889 0.56471 0.01019 0.02879 -0.00729 264 ASP A OD2 4791 O OD2 B ASP A 264 ? 0.49187 0.50511 0.48875 0.00584 0.02873 -0.00014 264 ASP A OD2 4800 N N . TYR A 265 ? 0.53420 0.49895 0.47429 -0.01568 0.00369 0.02101 265 TYR A N 4801 C CA . TYR A 265 ? 0.50305 0.47701 0.44494 -0.02793 0.00354 0.02512 265 TYR A CA 4802 C C . TYR A 265 ? 0.49933 0.49391 0.46310 -0.02099 0.00460 0.02732 265 TYR A C 4803 O O . TYR A 265 ? 0.54137 0.52634 0.50283 -0.01281 0.00389 0.02640 265 TYR A O 4804 C CB . TYR A 265 ? 0.58364 0.52829 0.49801 -0.03711 0.00381 0.02475 265 TYR A CB 4805 C CG . TYR A 265 ? 0.57691 0.53611 0.49538 -0.05476 0.00731 0.02542 265 TYR A CG 4806 C CD1 . TYR A 265 ? 0.66067 0.63076 0.57916 -0.07042 0.00765 0.02223 265 TYR A CD1 4807 C CD2 . TYR A 265 ? 0.58942 0.55599 0.51470 -0.05571 0.01045 0.02701 265 TYR A CD2 4808 C CE1 . TYR A 265 ? 0.71257 0.70531 0.64185 -0.08704 0.01148 0.01850 265 TYR A CE1 4809 C CE2 . TYR A 265 ? 0.67454 0.65976 0.60737 -0.07260 0.01593 0.02457 265 TYR A CE2 4810 C CZ . TYR A 265 ? 0.68974 0.69084 0.62705 -0.08823 0.01660 0.01930 265 TYR A CZ 4811 O OH . TYR A 265 ? 0.73657 0.76468 0.68774 -0.10544 0.02258 0.01268 265 TYR A OH 4822 N N . THR A 266 ? 0.47659 0.49646 0.45863 -0.02205 0.00488 0.02940 266 THR A N 4823 C CA . THR A 266 ? 0.48397 0.51902 0.48394 -0.01388 0.00643 0.03099 266 THR A CA 4824 C C . THR A 266 ? 0.53047 0.58836 0.54353 -0.01586 0.00480 0.03295 266 THR A C 4825 O O . THR A 266 ? 0.48617 0.55352 0.49858 -0.02382 0.00169 0.03141 266 THR A O 4826 C CB . THR A 266 ? 0.48533 0.51779 0.49000 -0.00456 0.00920 0.02827 266 THR A CB 4827 O OG1 . THR A 266 ? 0.50010 0.54265 0.51914 0.00150 0.01134 0.02803 266 THR A OG1 4828 C CG2 . THR A 266 ? 0.52551 0.55912 0.52648 -0.00605 0.01066 0.02891 266 THR A CG2 4836 N N . ILE A 267 ? 0.43906 0.50644 0.46404 -0.00786 0.00610 0.03458 267 ILE A N 4837 C CA . ILE A 267 ? 0.42524 0.51133 0.46055 -0.00484 0.00289 0.03537 267 ILE A CA 4838 C C . ILE A 267 ? 0.48701 0.56535 0.51631 0.00377 0.00223 0.03754 267 ILE A C 4839 O O . ILE A 267 ? 0.51388 0.57755 0.53713 0.00510 0.00804 0.03760 267 ILE A O 4840 C CB . ILE A 267 ? 0.40265 0.50168 0.45100 -0.00328 0.00544 0.03508 267 ILE A CB 4841 C CG1 . ILE A 267 ? 0.46692 0.55470 0.51562 0.00291 0.00975 0.03655 267 ILE A CG1 4842 C CG2 . ILE A 267 ? 0.46474 0.56769 0.51226 -0.01513 0.00812 0.03225 267 ILE A CG2 4843 C CD1 . ILE A 267 ? 0.51686 0.61470 0.57543 0.00614 0.01186 0.03656 267 ILE A CD1 4855 N N . LEU A 268 ? 0.46633 0.55409 0.49569 0.00959 -0.00488 0.03761 268 LEU A N 4856 C CA A LEU A 268 ? 0.49121 0.56248 0.50380 0.01881 -0.00745 0.04022 268 LEU A CA 4857 C CA B LEU A 268 ? 0.49129 0.56248 0.50398 0.01882 -0.00731 0.04025 268 LEU A CA 4858 C C . LEU A 268 ? 0.48923 0.57381 0.50875 0.03081 -0.01498 0.03932 268 LEU A C 4859 O O . LEU A 268 ? 0.54149 0.65317 0.57656 0.03215 -0.02292 0.03416 268 LEU A O 4860 C CB A LEU A 268 ? 0.56790 0.62748 0.56089 0.01788 -0.01385 0.03996 268 LEU A CB 4861 C CB B LEU A 268 ? 0.56790 0.62638 0.56055 0.01756 -0.01310 0.04010 268 LEU A CB 4862 C CG A LEU A 268 ? 0.60438 0.63722 0.57617 0.01181 -0.00618 0.04106 268 LEU A CG 4863 C CG B LEU A 268 ? 0.62944 0.65487 0.59057 0.02220 -0.01158 0.04332 268 LEU A CG 4864 C CD1 A LEU A 268 ? 0.57969 0.60520 0.53280 0.01121 -0.01538 0.04011 268 LEU A CD1 4865 C CD1 B LEU A 268 ? 0.69753 0.70597 0.65361 0.01347 0.00390 0.04301 268 LEU A CD1 4866 C CD2 A LEU A 268 ? 0.70735 0.71443 0.66048 0.01490 0.00207 0.04348 268 LEU A CD2 4867 C CD2 B LEU A 268 ? 0.61624 0.63277 0.55718 0.02259 -0.02121 0.04242 268 LEU A CD2 4890 N N . GLY A 269 ? 0.52826 0.59451 0.53606 0.03927 -0.01228 0.04236 269 GLY A N 4891 C CA . GLY A 269 ? 0.52307 0.59620 0.53174 0.05474 -0.02134 0.04080 269 GLY A CA 4892 C C . GLY A 269 ? 0.51601 0.56845 0.51468 0.06047 -0.01458 0.04382 269 GLY A C 4893 O O . GLY A 269 ? 0.48159 0.52278 0.48024 0.05053 -0.00234 0.04557 269 GLY A O 4897 N N . ASP A 270 ? 0.53859 0.58860 0.53021 0.07794 -0.02395 0.04239 270 ASP A N 4898 C CA A ASP A 270 ? 0.59544 0.61581 0.56754 0.08490 -0.01874 0.04534 270 ASP A CA 4899 C CA B ASP A 270 ? 0.59560 0.61597 0.56767 0.08494 -0.01878 0.04534 270 ASP A CA 4900 C C . ASP A 270 ? 0.53774 0.57371 0.53371 0.07660 -0.00742 0.04421 270 ASP A C 4901 O O . ASP A 270 ? 0.56152 0.57178 0.54301 0.07258 0.00213 0.04637 270 ASP A O 4902 C CB A ASP A 270 ? 0.62633 0.64084 0.58533 0.10930 -0.03354 0.04262 270 ASP A CB 4903 C CB B ASP A 270 ? 0.62601 0.64086 0.58517 0.10941 -0.03370 0.04255 270 ASP A CB 4904 C CG A ASP A 270 ? 0.68471 0.65682 0.61272 0.11708 -0.02847 0.04619 270 ASP A CG 4905 C CG B ASP A 270 ? 0.70465 0.68982 0.62672 0.12153 -0.04729 0.04416 270 ASP A CG 4906 O OD1 A ASP A 270 ? 0.69984 0.62504 0.58990 0.10879 -0.01988 0.05174 270 ASP A OD1 4907 O OD1 B ASP A 270 ? 0.75280 0.70448 0.64608 0.10972 -0.04028 0.04969 270 ASP A OD1 4908 O OD2 A ASP A 270 ? 0.64265 0.62712 0.58281 0.12980 -0.03144 0.04231 270 ASP A OD2 4909 O OD2 B ASP A 270 ? 0.77464 0.77022 0.69541 0.14388 -0.06557 0.03840 270 ASP A OD2 4918 N N . ALA A 271 ? 0.48230 0.55743 0.51132 0.07261 -0.00779 0.03987 271 ALA A N 4919 C CA . ALA A 271 ? 0.48596 0.57068 0.53113 0.06553 0.00177 0.03891 271 ALA A CA 4920 C C . ALA A 271 ? 0.48873 0.55657 0.52826 0.05185 0.01166 0.04144 271 ALA A C 4921 O O . ALA A 271 ? 0.46904 0.53328 0.51233 0.04859 0.01822 0.04046 271 ALA A O 4922 C CB . ALA A 271 ? 0.45950 0.58087 0.53202 0.05948 0.00194 0.03385 271 ALA A CB 4928 N N . VAL A 272 ? 0.50872 0.56885 0.54087 0.04434 0.01231 0.04268 272 VAL A N 4929 C CA . VAL A 272 ? 0.47082 0.52078 0.50184 0.03334 0.02133 0.04130 272 VAL A CA 4930 C C . VAL A 272 ? 0.51063 0.53369 0.52319 0.03197 0.02928 0.04077 272 VAL A C 4931 O O . VAL A 272 ? 0.47929 0.50326 0.49981 0.02535 0.03659 0.03636 272 VAL A O 4932 C CB . VAL A 272 ? 0.49555 0.54335 0.52220 0.02653 0.02133 0.04095 272 VAL A CB 4933 C CG1 . VAL A 272 ? 0.50834 0.54996 0.53702 0.01744 0.03098 0.03581 272 VAL A CG1 4934 C CG2 . VAL A 272 ? 0.46749 0.53666 0.50839 0.02448 0.01524 0.04058 272 VAL A CG2 4944 N N . ASN A 273 ? 0.52681 0.52233 0.51066 0.03740 0.02781 0.04414 273 ASN A N 4945 C CA A ASN A 273 ? 0.57275 0.53393 0.53076 0.03270 0.03791 0.04337 273 ASN A CA 4946 C CA B ASN A 273 ? 0.57283 0.53233 0.52879 0.03404 0.03708 0.04386 273 ASN A CA 4947 C C . ASN A 273 ? 0.54509 0.50676 0.50846 0.03822 0.03857 0.04240 273 ASN A C 4948 O O . ASN A 273 ? 0.55340 0.49937 0.50937 0.02827 0.04951 0.03845 273 ASN A O 4949 C CB A ASN A 273 ? 0.62448 0.54430 0.53890 0.03869 0.03544 0.04801 273 ASN A CB 4950 C CB B ASN A 273 ? 0.60231 0.52232 0.51606 0.04446 0.03176 0.04896 273 ASN A CB 4951 C CG A ASN A 273 ? 0.65084 0.54792 0.54363 0.02322 0.04681 0.04632 273 ASN A CG 4952 C CG B ASN A 273 ? 0.68747 0.60384 0.58947 0.04539 0.02563 0.05119 273 ASN A CG 4953 O OD1 A ASN A 273 ? 0.66500 0.58454 0.58148 0.01008 0.05493 0.04050 273 ASN A OD1 4954 O OD1 B ASN A 273 ? 0.70908 0.65879 0.63617 0.04995 0.01569 0.05084 273 ASN A OD1 4955 N ND2 A ASN A 273 ? 0.74989 0.59913 0.59379 0.02602 0.04726 0.05040 273 ASN A ND2 4956 N ND2 B ASN A 273 ? 0.64201 0.51372 0.50082 0.04012 0.03197 0.05306 273 ASN A ND2 4969 N N . VAL A 274 ? 0.52352 0.50417 0.50000 0.05246 0.02822 0.04404 274 VAL A N 4970 C CA . VAL A 274 ? 0.49969 0.47987 0.47964 0.05849 0.02948 0.04246 274 VAL A CA 4971 C C . VAL A 274 ? 0.50901 0.50863 0.51279 0.04647 0.03643 0.03797 274 VAL A C 4972 O O . VAL A 274 ? 0.51141 0.49749 0.50904 0.04214 0.04314 0.03488 274 VAL A O 4973 C CB . VAL A 274 ? 0.56441 0.56650 0.55682 0.07611 0.01833 0.04210 274 VAL A CB 4974 C CG1 . VAL A 274 ? 0.54936 0.55237 0.54640 0.08180 0.02137 0.03935 274 VAL A CG1 4975 C CG2 . VAL A 274 ? 0.63788 0.61894 0.60413 0.09303 0.00757 0.04409 274 VAL A CG2 4985 N N . ALA A 275 ? 0.47700 0.50481 0.50424 0.04153 0.03388 0.03680 275 ALA A N 4986 C CA . ALA A 275 ? 0.46474 0.50633 0.50883 0.03382 0.03688 0.03196 275 ALA A CA 4987 C C . ALA A 275 ? 0.47285 0.50381 0.51381 0.02257 0.04495 0.02554 275 ALA A C 4988 O O . ALA A 275 ? 0.44571 0.47957 0.49359 0.01834 0.04786 0.01917 275 ALA A O 4989 C CB . ALA A 275 ? 0.43327 0.49596 0.49249 0.03182 0.03189 0.03214 275 ALA A CB 4995 N N . ALA A 276 ? 0.47064 0.49081 0.50148 0.01649 0.04930 0.02516 276 ALA A N 4996 C CA . ALA A 276 ? 0.47960 0.49431 0.51024 0.00268 0.06022 0.01560 276 ALA A CA 4997 C C . ALA A 276 ? 0.52985 0.51779 0.54026 -0.00351 0.06963 0.01311 276 ALA A C 4998 O O . ALA A 276 ? 0.52510 0.51856 0.54484 -0.01538 0.07766 0.00183 276 ALA A O 4999 C CB . ALA A 276 ? 0.49679 0.50342 0.51734 -0.00383 0.06521 0.01523 276 ALA A CB 5005 N N . ARG A 277 ? 0.52718 0.48515 0.50854 0.00502 0.06797 0.02192 277 ARG A N 5006 C CA . ARG A 277 ? 0.57287 0.49571 0.52644 0.00066 0.07639 0.02047 277 ARG A CA 5007 C C . ARG A 277 ? 0.55404 0.49098 0.52422 0.00338 0.07418 0.01659 277 ARG A C 5008 O O . ARG A 277 ? 0.59138 0.51345 0.55294 -0.00853 0.08383 0.00904 277 ARG A O 5009 C CB . ARG A 277 ? 0.69250 0.57711 0.60756 0.01527 0.07099 0.03048 277 ARG A CB 5010 C CG . ARG A 277 ? 0.97041 0.81445 0.85268 0.01787 0.07549 0.03079 277 ARG A CG 5011 C CD . ARG A 277 ? 1.35926 1.14935 1.18867 0.02768 0.07336 0.03803 277 ARG A CD 5012 N NE . ARG A 277 ? 1.38609 1.18373 1.21697 0.05588 0.05538 0.04401 277 ARG A NE 5013 C CZ . ARG A 277 ? 1.26338 1.07341 1.09703 0.07019 0.04219 0.04831 277 ARG A CZ 5014 N NH1 . ARG A 277 ? 1.25056 1.06099 1.08084 0.05988 0.04459 0.04957 277 ARG A NH1 5015 N NH2 . ARG A 277 ? 1.12142 0.94719 0.96374 0.09502 0.02644 0.04935 277 ARG A NH2 5029 N N . LEU A 278 ? 0.52568 0.48901 0.51674 0.01708 0.06276 0.02072 278 LEU A N 5030 C CA . LEU A 278 ? 0.49216 0.46567 0.49456 0.01951 0.06108 0.01712 278 LEU A CA 5031 C C . LEU A 278 ? 0.49932 0.49405 0.52376 0.00691 0.06346 0.00584 278 LEU A C 5032 O O . LEU A 278 ? 0.51489 0.50518 0.53854 0.00136 0.06681 -0.00135 278 LEU A O 5033 C CB . LEU A 278 ? 0.50999 0.50520 0.52644 0.03398 0.05126 0.02258 278 LEU A CB 5034 C CG . LEU A 278 ? 0.57308 0.55684 0.57501 0.04994 0.04679 0.02896 278 LEU A CG 5035 C CD1 . LEU A 278 ? 0.57978 0.59534 0.60311 0.05931 0.03997 0.03022 278 LEU A CD1 5036 C CD2 . LEU A 278 ? 0.76203 0.71383 0.73902 0.05553 0.05061 0.02808 278 LEU A CD2 5048 N N . GLU A 279 ? 0.45815 0.47638 0.50206 0.00392 0.06029 0.00266 279 GLU A N 5049 C CA . GLU A 279 ? 0.47214 0.51340 0.53845 -0.00378 0.05952 -0.01101 279 GLU A CA 5050 C C . GLU A 279 ? 0.46309 0.49528 0.52544 -0.02111 0.07268 -0.02365 279 GLU A C 5051 O O . GLU A 279 ? 0.48620 0.53098 0.56141 -0.02737 0.07275 -0.03649 279 GLU A O 5052 C CB . GLU A 279 ? 0.43876 0.50129 0.52181 -0.00175 0.05420 -0.01305 279 GLU A CB 5053 C CG . GLU A 279 ? 0.38778 0.47749 0.49537 -0.00191 0.04766 -0.02821 279 GLU A CG 5054 C CD . GLU A 279 ? 0.51382 0.61547 0.63500 -0.01698 0.05804 -0.04655 279 GLU A CD 5055 O OE1 . GLU A 279 ? 0.44570 0.53490 0.55697 -0.02951 0.07213 -0.04726 279 GLU A OE1 5056 O OE2 . GLU A 279 ? 0.43072 0.55442 0.57152 -0.01719 0.05238 -0.06214 279 GLU A OE2 5063 N N . ALA A 280 ? 0.49150 0.49895 0.53240 -0.03037 0.08446 -0.02114 280 ALA A N 5064 C CA . ALA A 280 ? 0.53820 0.53078 0.56869 -0.05180 0.10126 -0.03394 280 ALA A CA 5065 C C . ALA A 280 ? 0.54094 0.50794 0.55181 -0.05584 0.10558 -0.03499 280 ALA A C 5066 O O . ALA A 280 ? 0.58499 0.55308 0.59915 -0.07485 0.11667 -0.05073 280 ALA A O 5067 C CB . ALA A 280 ? 0.60638 0.56602 0.60574 -0.06058 0.11355 -0.02872 280 ALA A CB 5073 N N . LEU A 281 ? 0.56299 0.50887 0.55469 -0.03882 0.09751 -0.02059 281 LEU A N 5074 C CA . LEU A 281 ? 0.60920 0.52847 0.58017 -0.03948 0.10061 -0.02120 281 LEU A CA 5075 C C . LEU A 281 ? 0.61821 0.56688 0.61634 -0.04399 0.09634 -0.03401 281 LEU A C 5076 O O . LEU A 281 ? 0.64776 0.57634 0.63083 -0.05316 0.10291 -0.04061 281 LEU A O 5077 C CB . LEU A 281 ? 0.71144 0.61317 0.66493 -0.01625 0.09079 -0.00588 281 LEU A CB 5078 C CG . LEU A 281 ? 0.98234 0.83535 0.89182 -0.00856 0.09391 0.00427 281 LEU A CG 5079 C CD1 . LEU A 281 ? 0.92218 0.77725 0.83031 0.01765 0.08102 0.01402 281 LEU A CD1 5080 C CD2 . LEU A 281 ? 0.90642 0.70808 0.77458 -0.02374 0.10835 -0.00096 281 LEU A CD2 5092 N N . THR A 282 ? 0.52823 0.51940 0.56125 -0.03699 0.08447 -0.03807 282 THR A N 5093 C CA . THR A 282 ? 0.49362 0.50907 0.54722 -0.03750 0.07664 -0.05035 282 THR A CA 5094 C C . THR A 282 ? 0.52346 0.54996 0.58888 -0.05966 0.08642 -0.07205 282 THR A C 5095 O O . THR A 282 ? 0.62848 0.66826 0.70466 -0.06228 0.08099 -0.08423 282 THR A O 5096 C CB . THR A 282 ? 0.46490 0.51570 0.54537 -0.02415 0.06064 -0.05123 282 THR A CB 5097 O OG1 . THR A 282 ? 0.45149 0.52438 0.55158 -0.02992 0.06258 -0.05935 282 THR A OG1 5098 C CG2 . THR A 282 ? 0.49183 0.53418 0.56158 -0.00669 0.05309 -0.03271 282 THR A CG2 5106 N N . ARG A 283 ? 0.52757 0.55175 0.59242 -0.07674 0.10089 -0.07925 283 ARG A N 5107 C CA . ARG A 283 ? 0.51153 0.54844 0.58859 -0.10253 0.11432 -0.10317 283 ARG A CA 5108 C C . ARG A 283 ? 0.72654 0.72252 0.77046 -0.11747 0.12659 -0.10506 283 ARG A C 5109 O O . ARG A 283 ? 0.71106 0.72105 0.76740 -0.13861 0.13476 -0.12695 283 ARG A O 5110 C CB . ARG A 283 ? 0.57502 0.61329 0.65303 -0.12058 0.13142 -0.11082 283 ARG A CB 5111 C CG . ARG A 283 ? 0.59462 0.66931 0.70210 -0.10742 0.12166 -0.11037 283 ARG A CG 5112 C CD . ARG A 283 ? 0.54294 0.67382 0.69751 -0.09897 0.10558 -0.12954 283 ARG A CD 5113 N NE . ARG A 283 ? 0.45532 0.61740 0.63514 -0.08780 0.09805 -0.13273 283 ARG A NE 5114 C CZ . ARG A 283 ? 0.40654 0.56570 0.58259 -0.06444 0.08219 -0.11499 283 ARG A CZ 5115 N NH1 . ARG A 283 ? 0.47140 0.60334 0.62357 -0.05016 0.07280 -0.09375 283 ARG A NH1 5116 N NH2 . ARG A 283 ? 0.38417 0.56812 0.58028 -0.05648 0.07702 -0.12027 283 ARG A NH2 5130 N N . GLN A 284 ? 0.67615 0.62260 0.67837 -0.10658 0.12766 -0.08457 284 GLN A N 5131 C CA . GLN A 284 ? 0.76752 0.66598 0.73056 -0.11772 0.13872 -0.08510 284 GLN A CA 5132 C C . GLN A 284 ? 0.80762 0.70339 0.76829 -0.10018 0.12524 -0.07936 284 GLN A C 5133 O O . GLN A 284 ? 0.79630 0.65306 0.72524 -0.10761 0.13294 -0.08092 284 GLN A O 5134 C CB . GLN A 284 ? 0.79061 0.62545 0.69917 -0.11651 0.14974 -0.06888 284 GLN A CB 5135 C CG . GLN A 284 ? 1.09665 0.92691 0.99911 -0.12506 0.15924 -0.06695 284 GLN A CG 5136 C CD . GLN A 284 ? 1.53855 1.30901 1.38748 -0.11108 0.15999 -0.04668 284 GLN A CD 5137 O OE1 . GLN A 284 ? 1.54599 1.27083 1.35650 -0.09993 0.15786 -0.03768 284 GLN A OE1 5138 N NE2 . GLN A 284 ? 1.45650 1.22623 1.30130 -0.10973 0.16164 -0.04067 284 GLN A NE2 5147 N N . LEU A 285 ? 0.71499 0.64661 0.70379 -0.07861 0.10684 -0.07350 285 LEU A N 5148 C CA . LEU A 285 ? 0.71598 0.64499 0.70059 -0.06208 0.09531 -0.06780 285 LEU A CA 5149 C C . LEU A 285 ? 0.76621 0.73775 0.78398 -0.06311 0.08274 -0.08337 285 LEU A C 5150 O O . LEU A 285 ? 0.73138 0.74083 0.78070 -0.06908 0.07871 -0.09612 285 LEU A O 5151 C CB . LEU A 285 ? 0.75031 0.67924 0.73216 -0.03663 0.08545 -0.04812 285 LEU A CB 5152 C CG . LEU A 285 ? 0.81726 0.70763 0.76746 -0.02937 0.09262 -0.03384 285 LEU A CG 5153 C CD1 . LEU A 285 ? 0.90469 0.80961 0.86346 -0.00661 0.08202 -0.01948 285 LEU A CD1 5154 C CD2 . LEU A 285 ? 0.93289 0.77525 0.84402 -0.02898 0.09994 -0.03257 285 LEU A CD2 5166 N N . SER A 286 ? 0.76099 0.72507 0.76958 -0.05518 0.07530 -0.08335 286 SER A N 5167 C CA . SER A 286 ? 0.79751 0.79638 0.83028 -0.05028 0.05893 -0.09566 286 SER A CA 5168 C C . SER A 286 ? 0.78575 0.80493 0.83107 -0.02964 0.04426 -0.08482 286 SER A C 5169 O O . SER A 286 ? 0.71829 0.76721 0.78434 -0.02443 0.02941 -0.09573 286 SER A O 5170 C CB . SER A 286 ? 0.89856 0.87815 0.91161 -0.04852 0.05559 -0.09875 286 SER A CB 5171 O OG . SER A 286 ? 0.97662 0.92521 0.96244 -0.03326 0.05829 -0.07989 286 SER A OG 5177 N N . GLN A 287 ? 0.67499 0.67770 0.70662 -0.01784 0.04766 -0.06528 287 GLN A N 5178 C CA . GLN A 287 ? 0.56917 0.58506 0.60682 -0.00171 0.03674 -0.05486 287 GLN A CA 5179 C C . GLN A 287 ? 0.51010 0.54908 0.56938 -0.00272 0.03454 -0.05602 287 GLN A C 5180 O O . GLN A 287 ? 0.57706 0.61233 0.63843 -0.01207 0.04567 -0.05523 287 GLN A O 5181 C CB . GLN A 287 ? 0.61837 0.61340 0.63688 0.00930 0.04236 -0.03732 287 GLN A CB 5182 C CG . GLN A 287 ? 0.64441 0.62024 0.64248 0.01450 0.04311 -0.03635 287 GLN A CG 5183 C CD . GLN A 287 ? 0.79137 0.73947 0.77127 0.00758 0.05420 -0.03926 287 GLN A CD 5184 O OE1 . GLN A 287 ? 0.70596 0.64370 0.68337 -0.00189 0.06254 -0.04068 287 GLN A OE1 5185 N NE2 . GLN A 287 ? 0.97514 0.90563 0.93674 0.01172 0.05516 -0.04041 287 GLN A NE2 5194 N N . ALA A 288 ? 0.48328 0.54051 0.55292 0.00764 0.02019 -0.05771 288 ALA A N 5195 C CA . ALA A 288 ? 0.48723 0.56510 0.57559 0.00969 0.01619 -0.05956 288 ALA A CA 5196 C C . ALA A 288 ? 0.42274 0.49142 0.50166 0.01808 0.01757 -0.04151 288 ALA A C 5197 O O . ALA A 288 ? 0.46743 0.54862 0.55813 0.01935 0.01571 -0.04131 288 ALA A O 5198 C CB . ALA A 288 ? 0.51800 0.61704 0.61921 0.01898 -0.00241 -0.07338 288 ALA A CB 5204 N N . LEU A 289 ? 0.45009 0.49996 0.50960 0.02344 0.02076 -0.02879 289 LEU A N 5205 C CA . LEU A 289 ? 0.43780 0.48316 0.49053 0.02938 0.02318 -0.01455 289 LEU A CA 5206 C C . LEU A 289 ? 0.53203 0.56395 0.57517 0.02959 0.03419 -0.00666 289 LEU A C 5207 O O . LEU A 289 ? 0.49533 0.51477 0.52679 0.03090 0.03723 -0.00781 289 LEU A O 5208 C CB . LEU A 289 ? 0.46599 0.50482 0.50410 0.03672 0.01557 -0.01073 289 LEU A CB 5209 C CG . LEU A 289 ? 0.45350 0.48794 0.48270 0.03884 0.02145 0.00086 289 LEU A CG 5210 C CD1 . LEU A 289 ? 0.49317 0.53779 0.53262 0.03800 0.02020 0.00514 289 LEU A CD1 5211 C CD2 . LEU A 289 ? 0.55689 0.57676 0.56335 0.04128 0.01786 0.00201 289 LEU A CD2 5223 N N A VAL A 290 ? 0.43945 0.47215 0.48523 0.03031 0.03880 0.00039 290 VAL A N 5224 N N B VAL A 290 ? 0.43850 0.47157 0.48462 0.03020 0.03865 0.00030 290 VAL A N 5225 C CA A VAL A 290 ? 0.46662 0.48679 0.50169 0.03613 0.04520 0.00691 290 VAL A CA 5226 C CA B VAL A 290 ? 0.46564 0.48634 0.50157 0.03557 0.04518 0.00700 290 VAL A CA 5227 C C A VAL A 290 ? 0.48199 0.51327 0.52284 0.04177 0.04387 0.01455 290 VAL A C 5228 C C B VAL A 290 ? 0.47929 0.51278 0.52126 0.04174 0.04324 0.01457 290 VAL A C 5229 O O A VAL A 290 ? 0.48149 0.52132 0.53031 0.03805 0.04134 0.01575 290 VAL A O 5230 O O B VAL A 290 ? 0.45771 0.50262 0.50858 0.03855 0.03952 0.01577 290 VAL A O 5231 C CB A VAL A 290 ? 0.52391 0.52238 0.54674 0.03117 0.05222 0.00457 290 VAL A CB 5232 C CB B VAL A 290 ? 0.53336 0.53588 0.55992 0.02979 0.05175 0.00550 290 VAL A CB 5233 C CG1 A VAL A 290 ? 0.56056 0.54893 0.57765 0.02319 0.05471 -0.00497 290 VAL A CG1 5234 C CG1 B VAL A 290 ? 0.56826 0.55474 0.57989 0.04034 0.05400 0.01309 290 VAL A CG1 5235 C CG2 A VAL A 290 ? 0.47459 0.47537 0.50238 0.02291 0.05425 0.00370 290 VAL A CG2 5236 C CG2 B VAL A 290 ? 0.57597 0.56385 0.59405 0.02096 0.05633 -0.00363 290 VAL A CG2 5255 N N . PHE A 291 ? 0.45480 0.48829 0.49307 0.05078 0.04563 0.01769 291 PHE A N 5256 C CA . PHE A 291 ? 0.42336 0.47387 0.47087 0.05554 0.04388 0.02158 291 PHE A CA 5257 C C . PHE A 291 ? 0.50753 0.55706 0.55195 0.06899 0.04481 0.02141 291 PHE A C 5258 O O . PHE A 291 ? 0.49733 0.53252 0.53110 0.07542 0.04777 0.01885 291 PHE A O 5259 C CB . PHE A 291 ? 0.44969 0.51654 0.50390 0.05074 0.04389 0.02119 291 PHE A CB 5260 C CG . PHE A 291 ? 0.43043 0.49255 0.47635 0.05032 0.04808 0.01775 291 PHE A CG 5261 C CD1 . PHE A 291 ? 0.42449 0.49587 0.47283 0.05629 0.05427 0.01483 291 PHE A CD1 5262 C CD2 . PHE A 291 ? 0.46336 0.51284 0.49869 0.04497 0.04510 0.01576 291 PHE A CD2 5263 C CE1 . PHE A 291 ? 0.51122 0.57622 0.54897 0.05467 0.06014 0.01105 291 PHE A CE1 5264 C CE2 . PHE A 291 ? 0.52261 0.56276 0.54437 0.04464 0.04837 0.01275 291 PHE A CE2 5265 C CZ . PHE A 291 ? 0.51648 0.56300 0.53824 0.04825 0.05719 0.01101 291 PHE A CZ 5276 N N . SER A 292 ? 0.48888 0.55356 0.54196 0.07475 0.04081 0.02287 292 SER A N 5277 C CA . SER A 292 ? 0.48538 0.55264 0.53716 0.09188 0.03737 0.02052 292 SER A CA 5278 C C . SER A 292 ? 0.51669 0.61091 0.58440 0.09787 0.04102 0.01303 292 SER A C 5279 O O . SER A 292 ? 0.46928 0.58030 0.54726 0.08590 0.04697 0.01100 292 SER A O 5280 C CB . SER A 292 ? 0.55050 0.62823 0.60724 0.09639 0.02959 0.02232 292 SER A CB 5281 O OG . SER A 292 ? 0.52877 0.63970 0.60772 0.08743 0.03035 0.01991 292 SER A OG 5287 N N . SER A 293 ? 0.51114 0.60766 0.57821 0.11719 0.03754 0.00766 293 SER A N 5288 C CA . SER A 293 ? 0.47932 0.60673 0.56528 0.12423 0.04241 -0.00311 293 SER A CA 5289 C C . SER A 293 ? 0.51017 0.68203 0.62475 0.11575 0.04396 -0.00950 293 SER A C 5290 O O . SER A 293 ? 0.50747 0.70559 0.63741 0.10910 0.05413 -0.01850 293 SER A O 5291 C CB . SER A 293 ? 0.60787 0.73028 0.68835 0.15124 0.03549 -0.00986 293 SER A CB 5292 O OG . SER A 293 ? 0.66812 0.79236 0.74768 0.16452 0.02213 -0.00926 293 SER A OG 5298 N N . GLU A 294 ? 0.50322 0.68243 0.62293 0.11407 0.03550 -0.00620 294 GLU A N 5299 C CA . GLU A 294 ? 0.50144 0.72052 0.64619 0.10249 0.03779 -0.01309 294 GLU A CA 5300 C C . GLU A 294 ? 0.48211 0.69657 0.62227 0.07735 0.04973 -0.00931 294 GLU A C 5301 O O . GLU A 294 ? 0.46806 0.71010 0.62281 0.06443 0.05903 -0.01798 294 GLU A O 5302 C CB . GLU A 294 ? 0.55166 0.77430 0.69819 0.10558 0.02542 -0.00994 294 GLU A CB 5303 C CG . GLU A 294 ? 0.66894 0.89931 0.81816 0.13283 0.01079 -0.01661 294 GLU A CG 5304 C CD . GLU A 294 ? 0.96854 1.14863 1.08291 0.14896 0.00443 -0.00754 294 GLU A CD 5305 O OE1 . GLU A 294 ? 0.74168 0.88552 0.83411 0.13615 0.01108 0.00359 294 GLU A OE1 5306 O OE2 . GLU A 294 ? 1.24147 1.41735 1.34878 0.17471 -0.00741 -0.01320 294 GLU A OE2 5313 N N . VAL A 295 ? 0.45738 0.63589 0.57514 0.07027 0.04967 0.00179 295 VAL A N 5314 C CA . VAL A 295 ? 0.42034 0.58711 0.52668 0.05182 0.05759 0.00476 295 VAL A CA 5315 C C . VAL A 295 ? 0.47492 0.64149 0.57631 0.04963 0.06862 -0.00123 295 VAL A C 5316 O O . VAL A 295 ? 0.48350 0.65553 0.58100 0.03467 0.07903 -0.00530 295 VAL A O 5317 C CB . VAL A 295 ? 0.44750 0.58177 0.53544 0.04888 0.05181 0.01447 295 VAL A CB 5318 C CG1 . VAL A 295 ? 0.45336 0.57097 0.52475 0.03602 0.05591 0.01618 295 VAL A CG1 5319 C CG2 . VAL A 295 ? 0.47515 0.60997 0.56665 0.04833 0.04378 0.01912 295 VAL A CG2 5329 N N . LYS A 296 ? 0.45559 0.61098 0.55206 0.06325 0.06771 -0.00215 296 LYS A N 5330 C CA . LYS A 296 ? 0.45462 0.60843 0.54488 0.06262 0.07841 -0.00858 296 LYS A CA 5331 C C . LYS A 296 ? 0.49629 0.68914 0.60823 0.05981 0.08921 -0.02204 296 LYS A C 5332 O O . LYS A 296 ? 0.50717 0.70097 0.61129 0.04606 0.10315 -0.02747 296 LYS A O 5333 C CB . LYS A 296 ? 0.54426 0.67972 0.62607 0.07970 0.07474 -0.00850 296 LYS A CB 5334 C CG . LYS A 296 ? 0.55130 0.67939 0.62272 0.08043 0.08514 -0.01480 296 LYS A CG 5335 C CD . LYS A 296 ? 0.56880 0.71755 0.65507 0.09924 0.08763 -0.02601 296 LYS A CD 5336 C CE . LYS A 296 ? 0.65298 0.79263 0.72731 0.10011 0.09918 -0.03299 296 LYS A CE 5337 N NZ . LYS A 296 ? 0.74993 0.93082 0.84913 0.10669 0.10955 -0.04957 296 LYS A NZ 5351 N N . ASN A 297 ? 0.50339 0.72900 0.64150 0.07205 0.08325 -0.02940 297 ASN A N 5352 C CA . ASN A 297 ? 0.49112 0.76347 0.65754 0.07136 0.09299 -0.04720 297 ASN A CA 5353 C C . ASN A 297 ? 0.50061 0.79298 0.67460 0.04548 0.10329 -0.05177 297 ASN A C 5354 O O . ASN A 297 ? 0.48391 0.81064 0.67575 0.03498 0.11839 -0.06803 297 ASN A O 5355 C CB . ASN A 297 ? 0.53128 0.83377 0.72332 0.09703 0.07959 -0.05638 297 ASN A CB 5356 C CG . ASN A 297 ? 0.58569 0.86835 0.76686 0.12288 0.07367 -0.05683 297 ASN A CG 5357 O OD1 . ASN A 297 ? 0.68814 0.95639 0.85714 0.12097 0.08455 -0.05852 297 ASN A OD1 5358 N ND2 . ASN A 297 ? 0.66892 0.94600 0.84929 0.14724 0.05645 -0.05574 297 ASN A ND2 5365 N N . SER A 298 ? 0.49994 0.76973 0.65870 0.03380 0.09706 -0.03919 298 SER A N 5366 C CA . SER A 298 ? 0.55061 0.82705 0.70677 0.00835 0.10638 -0.04171 298 SER A CA 5367 C C . SER A 298 ? 0.54926 0.78624 0.66776 -0.01201 0.11938 -0.03589 298 SER A C 5368 O O . SER A 298 ? 0.61119 0.84547 0.71840 -0.03536 0.13076 -0.03931 298 SER A O 5369 C CB . SER A 298 ? 0.59851 0.86626 0.75296 0.00779 0.09236 -0.03176 298 SER A CB 5370 O OG . SER A 298 ? 0.65062 0.94950 0.83283 0.02603 0.07933 -0.03718 298 SER A OG 5376 N N . ALA A 299 ? 0.51836 0.72082 0.61281 -0.00405 0.11728 -0.02780 299 ALA A N 5377 C CA . ALA A 299 ? 0.60263 0.76457 0.65652 -0.01997 0.12693 -0.02348 299 ALA A CA 5378 C C . ALA A 299 ? 0.58422 0.76061 0.63628 -0.03460 0.14951 -0.03772 299 ALA A C 5379 O O . ALA A 299 ? 0.60099 0.81636 0.68404 -0.02529 0.15562 -0.05062 299 ALA A O 5380 C CB . ALA A 299 ? 0.60290 0.72860 0.63446 -0.00648 0.11646 -0.01357 299 ALA A CB 5386 N N . THR A 300 ? 0.61488 0.75672 0.62680 -0.05748 0.16262 -0.03657 300 THR A N 5387 C CA . THR A 300 ? 0.66363 0.81207 0.66569 -0.07661 0.18811 -0.05065 300 THR A CA 5388 C C . THR A 300 ? 0.74180 0.84116 0.69657 -0.07816 0.19404 -0.04593 300 THR A C 5389 O O . THR A 300 ? 0.78583 0.89273 0.73512 -0.08921 0.21530 -0.05846 300 THR A O 5390 C CB . THR A 300 ? 0.75742 0.90118 0.74277 -0.10818 0.20509 -0.05688 300 THR A CB 5391 O OG1 . THR A 300 ? 0.76384 0.84007 0.69004 -0.11766 0.19993 -0.04196 300 THR A OG1 5392 C CG2 . THR A 300 ? 0.73290 0.92361 0.76257 -0.10789 0.19774 -0.06216 300 THR A CG2 5400 N N . LYS A 301 ? 0.67745 0.72942 0.59909 -0.06727 0.17585 -0.03034 301 LYS A N 5401 C CA . LYS A 301 ? 0.75912 0.76356 0.63440 -0.06615 0.17703 -0.02639 301 LYS A CA 5402 C C . LYS A 301 ? 0.70277 0.72303 0.60084 -0.04369 0.16894 -0.02759 301 LYS A C 5403 O O . LYS A 301 ? 0.65863 0.71186 0.59814 -0.02630 0.15677 -0.02677 301 LYS A O 5404 C CB . LYS A 301 ? 0.78072 0.72831 0.60903 -0.06379 0.15907 -0.01243 301 LYS A CB 5405 C CG . LYS A 301 ? 0.92029 0.83933 0.71507 -0.08450 0.16578 -0.01013 301 LYS A CG 5406 C CD . LYS A 301 ? 1.15792 1.04460 0.93322 -0.07331 0.14150 0.00207 301 LYS A CD 5407 C CE . LYS A 301 ? 1.30531 1.11726 1.00459 -0.07751 0.13723 0.00783 301 LYS A CE 5408 N NZ . LYS A 301 ? 1.39754 1.17906 1.07714 -0.06539 0.11369 0.01664 301 LYS A NZ 5422 N N . SER A 302 ? 0.68329 0.67395 0.54780 -0.04508 0.17655 -0.02979 302 SER A N 5423 C CA . SER A 302 ? 0.70643 0.70534 0.58497 -0.02639 0.17168 -0.03233 302 SER A CA 5424 C C . SER A 302 ? 0.71581 0.68373 0.57877 -0.01177 0.14705 -0.02078 302 SER A C 5425 O O . SER A 302 ? 0.75808 0.68944 0.58521 -0.00957 0.14285 -0.01923 302 SER A O 5426 C CB . SER A 302 ? 0.87743 0.86088 0.72805 -0.03539 0.19235 -0.04194 302 SER A CB 5427 O OG . SER A 302 ? 1.14375 1.16095 1.01186 -0.05184 0.21762 -0.05623 302 SER A OG 5433 N N . TRP A 303 ? 0.61678 0.60258 0.50876 -0.00233 0.13104 -0.01463 303 TRP A N 5434 C CA . TRP A 303 ? 0.59953 0.56800 0.48795 0.00998 0.10966 -0.00746 303 TRP A CA 5435 C C . TRP A 303 ? 0.59908 0.56849 0.49471 0.02237 0.10758 -0.01110 303 TRP A C 5436 O O . TRP A 303 ? 0.56978 0.56112 0.48466 0.02751 0.11888 -0.01770 303 TRP A O 5437 C CB . TRP A 303 ? 0.58398 0.57565 0.50497 0.01571 0.09773 -0.00241 303 TRP A CB 5438 C CG . TRP A 303 ? 0.63404 0.62260 0.54787 0.00471 0.09764 0.00138 303 TRP A CG 5439 C CD1 . TRP A 303 ? 0.62605 0.64238 0.56105 -0.00363 0.10750 -0.00116 303 TRP A CD1 5440 C CD2 . TRP A 303 ? 0.59265 0.54670 0.47410 0.00191 0.08592 0.00699 303 TRP A CD2 5441 N NE1 . TRP A 303 ? 0.61093 0.60862 0.52616 -0.01398 0.10434 0.00361 303 TRP A NE1 5442 C CE2 . TRP A 303 ? 0.60537 0.56285 0.48614 -0.00921 0.09071 0.00901 303 TRP A CE2 5443 C CE3 . TRP A 303 ? 0.60812 0.52915 0.46081 0.00922 0.07035 0.00880 303 TRP A CE3 5444 C CZ2 . TRP A 303 ? 0.65404 0.57705 0.50181 -0.01220 0.08103 0.01408 303 TRP A CZ2 5445 C CZ3 . TRP A 303 ? 0.70217 0.59339 0.52521 0.00868 0.05882 0.01257 303 TRP A CZ3 5446 C CH2 . TRP A 303 ? 0.73997 0.62939 0.55849 -0.00152 0.06454 0.01584 303 TRP A CH2 5457 N N . ASN A 304 ? 0.59957 0.54615 0.48080 0.02809 0.09197 -0.00840 304 ASN A N 5458 C CA . ASN A 304 ? 0.60161 0.54321 0.48496 0.03705 0.08928 -0.01229 304 ASN A CA 5459 C C . ASN A 304 ? 0.55626 0.51864 0.47327 0.04563 0.08267 -0.01065 304 ASN A C 5460 O O . ASN A 304 ? 0.58611 0.54143 0.50566 0.04750 0.07042 -0.01009 304 ASN A O 5461 C CB . ASN A 304 ? 0.66735 0.57708 0.51975 0.03700 0.07599 -0.01338 304 ASN A CB 5462 C CG . ASN A 304 ? 0.74360 0.62179 0.55130 0.03013 0.08273 -0.01516 304 ASN A CG 5463 O OD1 . ASN A 304 ? 0.75475 0.63423 0.55495 0.02506 0.10176 -0.01857 304 ASN A OD1 5464 N ND2 . ASN A 304 ? 0.77418 0.62294 0.55000 0.03054 0.06697 -0.01436 304 ASN A ND2 5471 N N . PHE A 305 ? 0.54355 0.53146 0.48488 0.05048 0.09148 -0.01166 305 PHE A N 5472 C CA . PHE A 305 ? 0.53699 0.53774 0.50190 0.05938 0.08547 -0.00936 305 PHE A CA 5473 C C . PHE A 305 ? 0.57106 0.55288 0.52753 0.06723 0.08385 -0.01221 305 PHE A C 5474 O O . PHE A 305 ? 0.53128 0.50255 0.47438 0.07115 0.09139 -0.01771 305 PHE A O 5475 C CB . PHE A 305 ? 0.56213 0.59298 0.55135 0.06659 0.09254 -0.01202 305 PHE A CB 5476 C CG . PHE A 305 ? 0.56185 0.61427 0.56266 0.05683 0.09533 -0.01072 305 PHE A CG 5477 C CD1 . PHE A 305 ? 0.55215 0.60594 0.55904 0.05209 0.08551 -0.00363 305 PHE A CD1 5478 C CD2 . PHE A 305 ? 0.59619 0.66785 0.60163 0.05104 0.10955 -0.01841 305 PHE A CD2 5479 C CE1 . PHE A 305 ? 0.54147 0.61110 0.55548 0.04227 0.08861 -0.00289 305 PHE A CE1 5480 C CE2 . PHE A 305 ? 0.59424 0.68336 0.60772 0.03847 0.11407 -0.01872 305 PHE A CE2 5481 C CZ . PHE A 305 ? 0.53918 0.62537 0.55557 0.03459 0.10301 -0.01037 305 PHE A CZ 5491 N N . ILE A 306 ? 0.52341 0.49901 0.48553 0.06834 0.07592 -0.00931 306 ILE A N 5492 C CA . ILE A 306 ? 0.52624 0.47986 0.47778 0.07413 0.07635 -0.01183 306 ILE A CA 5493 C C . ILE A 306 ? 0.55120 0.50701 0.51224 0.08205 0.07431 -0.00799 306 ILE A C 5494 O O . ILE A 306 ? 0.55704 0.52414 0.53049 0.07661 0.06917 -0.00343 306 ILE A O 5495 C CB . ILE A 306 ? 0.53939 0.47368 0.47854 0.06297 0.07038 -0.01494 306 ILE A CB 5496 C CG1 . ILE A 306 ? 0.57524 0.48156 0.49866 0.06489 0.07359 -0.01839 306 ILE A CG1 5497 C CG2 . ILE A 306 ? 0.57914 0.52660 0.53303 0.05375 0.06169 -0.01280 306 ILE A CG2 5498 C CD1 . ILE A 306 ? 0.67985 0.56962 0.59081 0.05242 0.07032 -0.02579 306 ILE A CD1 5510 N N . TRP A 307 ? 0.57346 0.51602 0.52532 0.09672 0.07765 -0.01032 307 TRP A N 5511 C CA . TRP A 307 ? 0.59778 0.53029 0.54668 0.10821 0.07396 -0.00720 307 TRP A CA 5512 C C . TRP A 307 ? 0.69348 0.58666 0.61783 0.09920 0.07362 -0.00579 307 TRP A C 5513 O O . TRP A 307 ? 0.70799 0.57297 0.61070 0.09685 0.07771 -0.01016 307 TRP A O 5514 C CB . TRP A 307 ? 0.67191 0.60322 0.61675 0.13127 0.07582 -0.01259 307 TRP A CB 5515 C CG . TRP A 307 ? 0.76902 0.69096 0.70823 0.14964 0.06858 -0.01075 307 TRP A CG 5516 C CD1 . TRP A 307 ? 0.85824 0.76837 0.79149 0.14541 0.06258 -0.00364 307 TRP A CD1 5517 C CD2 . TRP A 307 ? 0.96309 0.88417 0.89852 0.17735 0.06535 -0.01747 307 TRP A CD2 5518 N NE1 . TRP A 307 ? 0.93482 0.83191 0.85592 0.16866 0.05485 -0.00416 307 TRP A NE1 5519 C CE2 . TRP A 307 ? 1.04417 0.94916 0.96777 0.19021 0.05502 -0.01319 307 TRP A CE2 5520 C CE3 . TRP A 307 ? 1.03455 0.96713 0.97472 0.19390 0.06982 -0.02821 307 TRP A CE3 5521 C CZ2 . TRP A 307 ? 1.10181 1.00076 1.01699 0.22170 0.04595 -0.01933 307 TRP A CZ2 5522 C CZ3 . TRP A 307 ? 1.05549 0.98754 0.99282 0.22487 0.06227 -0.03570 307 TRP A CZ3 5523 C CH2 . TRP A 307 ? 1.06789 0.98268 0.99222 0.23980 0.04895 -0.03124 307 TRP A CH2 5534 N N . LEU A 308 ? 0.67910 0.56904 0.60490 0.09226 0.07042 -0.00103 308 LEU A N 5535 C CA . LEU A 308 ? 0.79847 0.65373 0.70198 0.07813 0.07364 -0.00184 308 LEU A CA 5536 C C . LEU A 308 ? 0.96807 0.78159 0.83899 0.08986 0.07427 0.00150 308 LEU A C 5537 O O . LEU A 308 ? 0.92501 0.74583 0.79945 0.10359 0.06838 0.00644 308 LEU A O 5538 C CB . LEU A 308 ? 0.69331 0.56887 0.61586 0.06023 0.07203 -0.00114 308 LEU A CB 5539 C CG . LEU A 308 ? 0.68176 0.59138 0.62990 0.05068 0.06819 -0.00482 308 LEU A CG 5540 C CD1 . LEU A 308 ? 0.82054 0.75002 0.78727 0.03911 0.06506 -0.00477 308 LEU A CD1 5541 C CD2 . LEU A 308 ? 0.76569 0.66301 0.70412 0.04092 0.07011 -0.01361 308 LEU A CD2 5553 N N . THR A 309 ? 1.22287 0.98871 1.05784 0.08387 0.08074 -0.00180 309 THR A N 5554 C CA . THR A 309 ? 1.45355 1.16345 1.24293 0.09498 0.08174 0.00128 309 THR A CA 5555 C C . THR A 309 ? 1.47127 1.15232 1.23935 0.07416 0.08799 0.00326 309 THR A C 5556 O O . THR A 309 ? 1.52230 1.14621 1.24507 0.06360 0.09686 0.00121 309 THR A O 5557 C CB . THR A 309 ? 1.18419 0.84844 0.93722 0.09961 0.08704 -0.00376 309 THR A CB 5560 N N . ASP A 310 ? 1.20775 0.92537 1.00531 0.06675 0.08504 0.00639 310 ASP A N 5561 C CA . ASP A 310 ? 1.15020 0.84838 0.93310 0.04534 0.09282 0.00650 310 ASP A CA 5562 C C . ASP A 310 ? 1.05999 0.77070 0.84909 0.05675 0.08499 0.01458 310 ASP A C 5563 O O . ASP A 310 ? 1.00935 0.74326 0.81813 0.04096 0.08773 0.01414 310 ASP A O 5564 C CB . ASP A 310 ? 1.12075 0.85519 0.93741 0.01754 0.09934 -0.00277 310 ASP A CB 5567 N N . SER A 311 ? 1.04583 0.74266 0.81865 0.08552 0.07423 0.02031 311 SER A N 5568 C CA . SER A 311 ? 0.97858 0.68702 0.75544 0.09904 0.06410 0.02657 311 SER A CA 5569 C C . SER A 311 ? 0.98191 0.62211 0.69884 0.09638 0.06783 0.03091 311 SER A C 5570 O O . SER A 311 ? 0.99205 0.58614 0.66555 0.12042 0.05934 0.03421 311 SER A O 5571 C CB . SER A 311 ? 0.96971 0.70414 0.76305 0.13154 0.04932 0.02675 311 SER A CB 5574 N N . GLU A 312 ? 0.98184 0.61380 0.69390 0.06698 0.08088 0.02956 312 GLU A N 5575 C CA . GLU A 312 ? 1.00737 0.57410 0.66077 0.05664 0.08917 0.03274 312 GLU A CA 5576 C C . GLU A 312 ? 0.99607 0.58807 0.66659 0.04874 0.08811 0.03572 312 GLU A C 5577 O O . GLU A 312 ? 1.00797 0.57722 0.65887 0.02239 0.10344 0.03301 312 GLU A O 5578 C CB . GLU A 312 ? 1.01065 0.53768 0.63549 0.02358 0.11091 0.02496 312 GLU A CB 5581 N N . LEU A 313 ? 0.98610 0.62600 0.69328 0.07016 0.07127 0.03976 313 LEU A N 5582 C CA . LEU A 313 ? 1.03353 0.70261 0.76147 0.06369 0.06895 0.04211 313 LEU A CA 5583 C C . LEU A 313 ? 1.07607 0.68201 0.74230 0.06539 0.06955 0.04780 313 LEU A C 5584 O O . LEU A 313 ? 1.07279 0.61279 0.67913 0.07879 0.06682 0.05121 313 LEU A O 5585 C CB . LEU A 313 ? 1.04348 0.77283 0.81914 0.08533 0.05120 0.04396 313 LEU A CB 5588 N N . LYS A 314 ? 1.10275 0.72487 0.77929 0.05242 0.07287 0.04860 314 LYS A N 5589 C CA . LYS A 314 ? 1.12381 0.68909 0.74241 0.05224 0.07370 0.05393 314 LYS A CA 5590 C C . LYS A 314 ? 1.12070 0.72919 0.76991 0.06030 0.06125 0.05679 314 LYS A C 5591 O O . LYS A 314 ? 1.11709 0.79092 0.82677 0.05124 0.06218 0.05302 314 LYS A O 5592 C CB . LYS A 314 ? 1.11076 0.63350 0.69447 0.01593 0.10044 0.04889 314 LYS A CB 5595 N N . GLY A 315 ? 1.10225 0.66930 0.70456 0.07821 0.04852 0.06304 315 GLY A N 5596 C CA . GLY A 315 ? 1.07225 0.67402 0.69645 0.08734 0.03477 0.06519 315 GLY A CA 5597 C C . GLY A 315 ? 1.03211 0.69070 0.70245 0.11582 0.01123 0.06408 315 GLY A C 5598 O O . GLY A 315 ? 0.99418 0.67869 0.67853 0.12518 -0.00241 0.06465 315 GLY A O 5602 N N . LYS A 316 ? 1.02904 0.70862 0.72326 0.12817 0.00729 0.06088 316 LYS A N 5603 C CA . LYS A 316 ? 0.96595 0.70281 0.70607 0.15235 -0.01142 0.05662 316 LYS A CA 5604 C C . LYS A 316 ? 0.93139 0.63757 0.63281 0.18707 -0.03458 0.05645 316 LYS A C 5605 O O . LYS A 316 ? 0.96697 0.60351 0.60184 0.19248 -0.03736 0.06166 316 LYS A O 5606 C CB . LYS A 316 ? 0.97957 0.74476 0.75307 0.15321 -0.00586 0.05198 316 LYS A CB 5609 N N . SER A 317 ? 0.88504 0.64299 0.62663 0.21147 -0.05172 0.04869 317 SER A N 5610 C CA . SER A 317 ? 0.88033 0.62304 0.59643 0.24979 -0.07753 0.04388 317 SER A CA 5611 C C . SER A 317 ? 0.89413 0.61775 0.59625 0.27524 -0.08321 0.03880 317 SER A C 5612 O O . SER A 317 ? 0.93836 0.60304 0.58232 0.30416 -0.09904 0.03896 317 SER A O 5613 C CB . SER A 317 ? 0.81445 0.63495 0.58842 0.26116 -0.09426 0.03381 317 SER A CB 5616 N N . GLU A 318 ? 0.88331 0.65056 0.63245 0.26640 -0.07124 0.03403 318 GLU A N 5617 C CA . GLU A 318 ? 0.91157 0.66425 0.65086 0.28948 -0.07476 0.02804 318 GLU A CA 5618 C C . GLU A 318 ? 0.93319 0.69956 0.69762 0.26328 -0.05143 0.02936 318 GLU A C 5619 O O . GLU A 318 ? 0.92078 0.72796 0.72247 0.27200 -0.05043 0.02070 318 GLU A O 5620 C CB . GLU A 318 ? 0.86723 0.68186 0.65035 0.32289 -0.09559 0.01243 318 GLU A CB 5623 N N . SER A 319 ? 0.96825 0.70159 0.71228 0.23067 -0.03237 0.03848 319 SER A N 5624 C CA . SER A 319 ? 0.99663 0.73837 0.75943 0.20612 -0.01245 0.03850 319 SER A CA 5625 C C . SER A 319 ? 0.98370 0.80675 0.81791 0.19624 -0.00910 0.03293 319 SER A C 5626 O O . SER A 319 ? 0.93940 0.80898 0.80728 0.19770 -0.01705 0.03082 319 SER A O 5627 C CB . SER A 319 ? 1.15323 0.85209 0.88284 0.22233 -0.01163 0.03568 319 SER A CB 5630 N N . ILE A 320 ? 1.15293 0.98884 1.00556 0.18508 0.00290 0.03016 320 ILE A N 5631 C CA . ILE A 320 ? 0.99276 0.89349 0.90155 0.17376 0.00786 0.02552 320 ILE A CA 5632 C C . ILE A 320 ? 0.91469 0.81229 0.82739 0.16607 0.01927 0.02250 320 ILE A C 5633 O O . ILE A 320 ? 0.92672 0.78516 0.81301 0.15081 0.02911 0.02563 320 ILE A O 5634 C CB . ILE A 320 ? 0.85993 0.78321 0.78962 0.14795 0.01370 0.03008 320 ILE A CB 5637 N N . ASP A 321 ? 0.85665 0.79563 0.80140 0.17514 0.01896 0.01475 321 ASP A N 5638 C CA . ASP A 321 ? 0.74838 0.68979 0.69963 0.16501 0.03015 0.01177 321 ASP A CA 5639 C C . ASP A 321 ? 0.70115 0.66326 0.67307 0.13704 0.03839 0.01500 321 ASP A C 5640 O O . ASP A 321 ? 0.71072 0.70866 0.70919 0.12993 0.03632 0.01564 321 ASP A O 5641 C CB . ASP A 321 ? 0.83698 0.81628 0.81440 0.18104 0.02969 0.00126 321 ASP A CB 5642 C CG . ASP A 321 ? 1.01741 0.97225 0.97215 0.21169 0.02184 -0.00479 321 ASP A CG 5643 O OD1 . ASP A 321 ? 1.07741 0.98133 0.99474 0.21385 0.02559 -0.00237 321 ASP A OD1 5644 O OD2 . ASP A 321 ? 1.13240 1.11897 1.10626 0.23413 0.01139 -0.01356 321 ASP A OD2 5649 N N . ILE A 322 ? 0.69760 0.63599 0.65572 0.12223 0.04658 0.01564 322 ILE A N 5650 C CA . ILE A 322 ? 0.62131 0.57285 0.59356 0.09914 0.05134 0.01677 322 ILE A CA 5651 C C . ILE A 322 ? 0.55571 0.52111 0.53829 0.09435 0.05598 0.01203 322 ILE A C 5652 O O . ILE A 322 ? 0.59314 0.53900 0.56018 0.10078 0.05946 0.00839 322 ILE A O 5653 C CB . ILE A 322 ? 0.71909 0.63510 0.66817 0.08407 0.05626 0.01781 322 ILE A CB 5654 C CG1 . ILE A 322 ? 0.88501 0.78252 0.81815 0.08483 0.05389 0.02278 322 ILE A CG1 5655 C CG2 . ILE A 322 ? 0.74502 0.68015 0.71275 0.06452 0.05909 0.01454 322 ILE A CG2 5656 C CD1 . ILE A 322 ? 0.86954 0.79928 0.82412 0.09292 0.04558 0.02604 322 ILE A CD1 5668 N N . TYR A 323 ? 0.50089 0.49382 0.50374 0.08325 0.05582 0.01204 323 TYR A N 5669 C CA . TYR A 323 ? 0.47527 0.47573 0.48070 0.07800 0.05936 0.00813 323 TYR A CA 5670 C C . TYR A 323 ? 0.51552 0.51781 0.52384 0.06287 0.05653 0.00789 323 TYR A C 5671 O O . TYR A 323 ? 0.51478 0.52377 0.53142 0.05678 0.05270 0.01028 323 TYR A O 5672 C CB . TYR A 323 ? 0.51039 0.53994 0.53121 0.08218 0.06198 0.00618 323 TYR A CB 5673 C CG . TYR A 323 ? 0.49969 0.53574 0.52285 0.09926 0.06468 0.00109 323 TYR A CG 5674 C CD1 . TYR A 323 ? 0.54622 0.59291 0.57789 0.11279 0.05905 0.00094 323 TYR A CD1 5675 C CD2 . TYR A 323 ? 0.56767 0.59965 0.58381 0.10378 0.07170 -0.00520 323 TYR A CD2 5676 C CE1 . TYR A 323 ? 0.62507 0.68075 0.66061 0.13290 0.05860 -0.00663 323 TYR A CE1 5677 C CE2 . TYR A 323 ? 0.57159 0.61303 0.59252 0.12199 0.07387 -0.01257 323 TYR A CE2 5678 C CZ . TYR A 323 ? 0.67310 0.72790 0.70510 0.13771 0.06646 -0.01393 323 TYR A CZ 5679 O OH . TYR A 323 ? 0.69340 0.76027 0.73167 0.16017 0.06581 -0.02406 323 TYR A OH 5689 N N . SER A 324 ? 0.50918 0.50559 0.50957 0.05864 0.05732 0.00370 324 SER A N 5690 C CA . SER A 324 ? 0.47608 0.47639 0.47783 0.04942 0.05106 0.00158 324 SER A CA 5691 C C . SER A 324 ? 0.50306 0.50025 0.49230 0.04968 0.05240 -0.00012 324 SER A C 5692 O O . SER A 324 ? 0.49776 0.49739 0.48372 0.05451 0.06047 0.00012 324 SER A O 5693 C CB . SER A 324 ? 0.49445 0.48424 0.49395 0.04188 0.04774 -0.00511 324 SER A CB 5694 O OG . SER A 324 ? 0.50942 0.50834 0.51422 0.03712 0.03831 -0.00998 324 SER A OG 5700 N N . ILE A 325 ? 0.50044 0.49220 0.48135 0.04507 0.04420 -0.00313 325 ILE A N 5701 C CA . ILE A 325 ? 0.52912 0.50679 0.48718 0.04456 0.04373 -0.00516 325 ILE A CA 5702 C C . ILE A 325 ? 0.62586 0.58955 0.57311 0.04385 0.03716 -0.01324 325 ILE A C 5703 O O . ILE A 325 ? 0.59474 0.56439 0.55264 0.04147 0.02749 -0.01896 325 ILE A O 5704 C CB . ILE A 325 ? 0.56473 0.53884 0.51202 0.04236 0.03629 -0.00267 325 ILE A CB 5705 C CG1 . ILE A 325 ? 0.65182 0.63897 0.60807 0.03960 0.04406 0.00380 325 ILE A CG1 5706 C CG2 . ILE A 325 ? 0.63089 0.57910 0.54312 0.04173 0.03446 -0.00492 325 ILE A CG2 5707 C CD1 . ILE A 325 ? 0.66171 0.65476 0.61671 0.03814 0.05946 0.00385 325 ILE A CD1 5719 N N . ASP A 326 ? 0.60809 0.55551 0.53517 0.04500 0.04262 -0.01581 326 ASP A N 5720 C CA A ASP A 326 ? 0.68293 0.61547 0.59673 0.04354 0.03634 -0.02458 326 ASP A CA 5721 C CA B ASP A 326 ? 0.68523 0.61781 0.59908 0.04354 0.03631 -0.02457 326 ASP A CA 5722 C C . ASP A 326 ? 0.79347 0.71030 0.68067 0.04459 0.02542 -0.02735 326 ASP A C 5723 O O . ASP A 326 ? 0.86419 0.76241 0.72443 0.04498 0.03224 -0.02546 326 ASP A O 5724 C CB A ASP A 326 ? 0.65401 0.57282 0.55708 0.04541 0.04829 -0.02635 326 ASP A CB 5725 C CB B ASP A 326 ? 0.65593 0.57484 0.55919 0.04537 0.04823 -0.02637 326 ASP A CB 5726 C CG A ASP A 326 ? 0.73995 0.64175 0.62803 0.04184 0.04254 -0.03625 326 ASP A CG 5727 C CG B ASP A 326 ? 0.74048 0.64302 0.62997 0.04162 0.04248 -0.03634 326 ASP A CG 5728 O OD1 A ASP A 326 ? 0.72967 0.63697 0.62244 0.03780 0.02872 -0.04349 326 ASP A OD1 5729 O OD1 B ASP A 326 ? 0.76908 0.67889 0.67251 0.03557 0.03544 -0.04294 326 ASP A OD1 5730 O OD2 A ASP A 326 ? 0.67560 0.56026 0.54825 0.04362 0.05140 -0.03856 326 ASP A OD2 5731 O OD2 B ASP A 326 ? 0.72470 0.60808 0.58948 0.04322 0.04603 -0.03912 326 ASP A OD2 5740 N N . ASN A 327 ? 0.97563 0.89842 0.86806 0.04588 0.00835 -0.03311 327 ASN A N 5741 C CA A ASN A 327 ? 1.12049 1.02418 0.98364 0.05115 -0.00778 -0.03769 327 ASN A CA 5742 C CA B ASN A 327 ? 1.12044 1.02343 0.98279 0.05106 -0.00749 -0.03779 327 ASN A CA 5743 C C . ASN A 327 ? 1.28270 1.19923 1.15979 0.05288 -0.02560 -0.05292 327 ASN A C 5744 O O . ASN A 327 ? 1.32098 1.25776 1.22689 0.04595 -0.02110 -0.05950 327 ASN A O 5745 C CB A ASN A 327 ? 1.08491 0.98270 0.93719 0.05510 -0.01329 -0.03055 327 ASN A CB 5746 C CB B ASN A 327 ? 1.08800 0.98266 0.93636 0.05489 -0.01238 -0.03028 327 ASN A CB 5747 C CG A ASN A 327 ? 0.98417 0.90845 0.86858 0.05823 -0.02432 -0.03403 327 ASN A CG 5748 C CG B ASN A 327 ? 0.95012 0.82498 0.77227 0.04977 0.00522 -0.02011 327 ASN A CG 5749 O OD1 A ASN A 327 ? 1.04820 0.99691 0.96337 0.05602 -0.02765 -0.04326 327 ASN A OD1 5750 O OD1 B ASN A 327 ? 0.85627 0.71932 0.66324 0.04638 0.01751 -0.02048 327 ASN A OD1 5751 N ND2 A ASN A 327 ? 0.94362 0.86092 0.81835 0.06183 -0.02833 -0.02772 327 ASN A ND2 5752 N ND2 B ASN A 327 ? 0.76646 0.63811 0.58294 0.04803 0.00741 -0.01291 327 ASN A ND2 5765 N N . GLU A 328 ? 1.37216 1.27604 1.22698 0.06200 -0.04630 -0.06022 328 GLU A N 5766 C CA . GLU A 328 ? 1.49745 1.42025 1.36898 0.06518 -0.06583 -0.07910 328 GLU A CA 5767 C C . GLU A 328 ? 1.62155 1.58522 1.54090 0.06227 -0.06802 -0.08688 328 GLU A C 5768 O O . GLU A 328 ? 1.61577 1.60572 1.56290 0.05602 -0.07264 -0.10395 328 GLU A O 5769 C CB . GLU A 328 ? 1.51488 1.41522 1.35074 0.08073 -0.09154 -0.08595 328 GLU A CB 5770 C CG . GLU A 328 ? 1.66896 1.56111 1.49391 0.09257 -0.10210 -0.07964 328 GLU A CG 5771 C CD . GLU A 328 ? 1.67557 1.52134 1.44985 0.09214 -0.09133 -0.06190 328 GLU A CD 5772 O OE1 . GLU A 328 ? 1.67364 1.50385 1.43245 0.08151 -0.07152 -0.05403 328 GLU A OE1 5773 O OE2 . GLU A 328 ? 1.52323 1.34737 1.27214 0.10169 -0.10156 -0.05723 328 GLU A OE2 5780 N N . MET A 329 ? 1.52044 1.35682 1.75464 0.15833 0.10526 -0.50628 329 MET A N 5781 C CA . MET A 329 ? 1.46896 1.34289 1.68863 0.15583 0.04898 -0.46932 329 MET A CA 5782 C C . MET A 329 ? 1.67272 1.50914 1.90629 0.19512 0.02285 -0.44551 329 MET A C 5783 O O . MET A 329 ? 1.78505 1.55995 1.94355 0.17815 0.00531 -0.42328 329 MET A O 5784 C CB . MET A 329 ? 1.26226 1.25332 1.56045 0.16771 0.02363 -0.46547 329 MET A CB 5785 C CG . MET A 329 ? 1.24712 1.28269 1.50220 0.13899 -0.02344 -0.43603 329 MET A CG 5786 S SD . MET A 329 ? 1.30630 1.34822 1.48135 0.07170 -0.00718 -0.44732 329 MET A SD 5787 C CE . MET A 329 ? 1.04391 1.14884 1.30524 0.08205 0.03567 -0.48456 329 MET A CE 5797 N N . THR A 330 ? 1.55754 1.43012 1.88776 0.24815 0.02037 -0.45000 330 THR A N 5798 C CA . THR A 330 ? 1.46585 1.31029 1.81618 0.29026 -0.00646 -0.42638 330 THR A CA 5799 C C . THR A 330 ? 1.58682 1.31532 1.87607 0.28714 0.01792 -0.42828 330 THR A C 5800 O O . THR A 330 ? 1.54692 1.23836 1.83513 0.31555 -0.00421 -0.40485 330 THR A O 5801 C CB . THR A 330 ? 1.37507 1.27715 1.84359 0.34822 -0.00760 -0.43743 330 THR A CB 5802 O OG1 . THR A 330 ? 1.38522 1.27386 1.89237 0.35263 0.04474 -0.47650 330 THR A OG1 5803 C CG2 . THR A 330 ? 1.25461 1.27236 1.78684 0.35836 -0.04437 -0.42818 330 THR A CG2 5811 N N . ARG A 331 ? 1.73699 1.40745 1.97554 0.25430 0.06255 -0.45542 331 ARG A N 5812 C CA . ARG A 331 ? 1.87476 1.43527 2.06010 0.25166 0.08911 -0.46228 331 ARG A CA 5813 C C . ARG A 331 ? 1.98109 1.48000 2.05786 0.20724 0.07331 -0.44150 331 ARG A C 5814 O O . ARG A 331 ? 2.00846 1.44786 2.05638 0.21839 0.05665 -0.41895 331 ARG A O 5815 C CB . ARG A 331 ? 1.70266 1.23061 1.89175 0.24269 0.14676 -0.50474 331 ARG A CB 5816 C CG . ARG A 331 ? 1.79261 1.20896 1.93375 0.24255 0.17695 -0.51649 331 ARG A CG 5817 C CD . ARG A 331 ? 1.82502 1.21173 1.97864 0.24121 0.23450 -0.55938 331 ARG A CD 5818 N NE . ARG A 331 ? 1.76937 1.23192 2.02309 0.27246 0.25054 -0.57909 331 ARG A NE 5819 C CZ . ARG A 331 ? 1.71714 1.23616 1.98636 0.25252 0.27168 -0.59946 331 ARG A CZ 5820 N NH1 . ARG A 331 ? 1.69715 1.21049 1.88755 0.20163 0.27733 -0.60217 331 ARG A NH1 5821 N NH2 . ARG A 331 ? 1.68604 1.26775 2.05336 0.28485 0.28834 -0.61797 331 ARG A NH2 5835 N N . LYS A 332 ? 2.02544 1.53845 2.04298 0.15712 0.07816 -0.44858 332 LYS A N 5836 C CA . LYS A 332 ? 1.98490 1.43676 1.89755 0.11075 0.06837 -0.43505 332 LYS A CA 5837 C C . LYS A 332 ? 1.95407 1.45538 1.85250 0.10275 0.01448 -0.39591 332 LYS A C 5838 O O . LYS A 332 ? 1.89186 1.44853 1.76710 0.07008 -0.00176 -0.39132 332 LYS A O 5839 C CB . LYS A 332 ? 1.83870 1.27841 1.69204 0.06197 0.09993 -0.46285 332 LYS A CB 5842 N N . SER A 333 ? 2.00564 1.48494 1.91738 0.13398 -0.01319 -0.36685 333 SER A N 5843 C CA . SER A 333 ? 2.02703 1.53929 1.91848 0.12933 -0.06337 -0.32706 333 SER A CA 5844 C C . SER A 333 ? 2.10034 1.52279 1.94010 0.13202 -0.07313 -0.30277 333 SER A C 5845 O O . SER A 333 ? 2.23016 1.58163 2.07760 0.15414 -0.04798 -0.31305 333 SER A O 5846 C CB . SER A 333 ? 1.83620 1.44195 1.81779 0.17552 -0.09606 -0.31089 333 SER A CB 5849 N N . SER A 334 ? 2.05927 1.48491 1.84695 0.10878 -0.10927 -0.27038 334 SER A N 5850 C CA . SER A 334 ? 2.11880 1.47129 1.86581 0.11510 -0.12484 -0.24053 334 SER A CA 5851 C C . SER A 334 ? 2.34922 1.72886 2.15987 0.17261 -0.15300 -0.21218 334 SER A C 5852 O O . SER A 334 ? 2.36615 1.69638 2.14808 0.18213 -0.17148 -0.18109 334 SER A O 5853 C CB . SER A 334 ? 1.95649 1.30296 1.62483 0.06851 -0.15225 -0.21607 334 SER A CB 5854 O OG . SER A 334 ? 1.75619 1.05343 1.35456 0.01668 -0.12568 -0.24055 334 SER A OG 5860 N N . GLY A 335 ? 2.17362 1.62968 2.06994 0.21146 -0.15636 -0.22241 335 GLY A N 5861 C CA . GLY A 335 ? 1.97024 1.46345 1.92920 0.26712 -0.18711 -0.19666 335 GLY A CA 5862 C C . GLY A 335 ? 2.03076 1.58076 1.97107 0.26126 -0.23676 -0.15870 335 GLY A C 5863 O O . GLY A 335 ? 2.07527 1.64051 1.95896 0.21408 -0.24763 -0.15303 335 GLY A O 5867 N N . GLY A 336 ? 1.89684 1.47950 1.88653 0.31189 -0.26775 -0.13269 336 GLY A N 5868 C CA . GLY A 336 ? 1.85188 1.47963 1.82263 0.31338 -0.31546 -0.09326 336 GLY A CA 5869 C C . GLY A 336 ? 2.02645 1.56871 1.92674 0.30472 -0.32473 -0.05908 336 GLY A C 5870 O O . GLY A 336 ? 2.10131 1.55056 1.97731 0.30530 -0.29639 -0.06484 336 GLY A O 5874 N N . LEU A 337 ? 2.03484 1.61018 1.90342 0.29628 -0.36457 -0.02333 337 LEU A N 5875 C CA . LEU A 337 ? 2.03640 1.53718 1.83436 0.28228 -0.37521 0.01175 337 LEU A CA 5876 C C . LEU A 337 ? 1.99697 1.43576 1.71462 0.21708 -0.35150 -0.00169 337 LEU A C 5877 O O . LEU A 337 ? 1.91509 1.34682 1.57192 0.18249 -0.37142 0.02208 337 LEU A O 5878 C CB . LEU A 337 ? 1.98911 1.41319 1.80306 0.32676 -0.36354 0.02403 337 LEU A CB 5881 N N . GLU A 338 ? 2.05977 1.45294 1.77645 0.20072 -0.30909 -0.04030 338 GLU A N 5882 C CA . GLU A 338 ? 2.08896 1.43474 1.73344 0.13901 -0.28692 -0.05902 338 GLU A CA 5883 C C . GLU A 338 ? 1.99700 1.42610 1.62966 0.10149 -0.30264 -0.06721 338 GLU A C 5884 O O . GLU A 338 ? 1.90549 1.31587 1.46918 0.05157 -0.30791 -0.06208 338 GLU A O 5885 C CB . GLU A 338 ? 2.11698 1.40283 1.76741 0.13440 -0.23831 -0.10049 338 GLU A CB 5888 N N . ILE A 339 ? 1.96603 1.48781 1.66739 0.12498 -0.31055 -0.08039 339 ILE A N 5889 C CA . ILE A 339 ? 1.85521 1.46093 1.55195 0.09236 -0.32685 -0.08709 339 ILE A CA 5890 C C . ILE A 339 ? 1.60873 1.25231 1.27585 0.08406 -0.37319 -0.04675 339 ILE A C 5891 O O . ILE A 339 ? 1.52787 1.18982 1.14359 0.03669 -0.38421 -0.04421 339 ILE A O 5892 C CB . ILE A 339 ? 1.76857 1.46424 1.55371 0.12306 -0.32412 -0.11025 339 ILE A CB 5893 C CG1 . ILE A 339 ? 1.84011 1.50891 1.63446 0.10802 -0.27547 -0.15510 339 ILE A CG1 5894 C CG2 . ILE A 339 ? 1.43163 1.22986 1.22836 0.10565 -0.35626 -0.10361 339 ILE A CG2 5895 C CD1 . ILE A 339 ? 1.72745 1.46685 1.61704 0.14581 -0.26460 -0.17963 339 ILE A CD1 5907 N N . ALA A 340 ? 1.68519 0.94759 1.55080 -0.24074 -0.39738 0.06002 340 ALA A N 5908 C CA . ALA A 340 ? 1.47801 0.75874 1.28202 -0.30331 -0.39435 0.04717 340 ALA A CA 5909 C C . ALA A 340 ? 1.59808 0.88253 1.36014 -0.32352 -0.37787 0.04505 340 ALA A C 5910 O O . ALA A 340 ? 1.32904 0.65736 1.07437 -0.34891 -0.34178 0.01927 340 ALA A O 5911 C CB . ALA A 340 ? 1.47972 0.75536 1.23450 -0.35196 -0.44258 0.07804 340 ALA A CB 5917 N N . ARG A 341 ? 1.59185 0.84732 1.34231 -0.30696 -0.39529 0.07138 341 ARG A N 5918 C CA . ARG A 341 ? 1.55955 0.82012 1.27182 -0.32746 -0.38234 0.07349 341 ARG A CA 5919 C C . ARG A 341 ? 1.55230 0.83820 1.31149 -0.30385 -0.33857 0.04925 341 ARG A C 5920 O O . ARG A 341 ? 1.43723 0.76367 1.18401 -0.32777 -0.31192 0.04217 341 ARG A O 5921 C CB . ARG A 341 ? 1.48087 0.70181 1.17226 -0.31511 -0.40952 0.10258 341 ARG A CB 5924 N N . ASN A 342 ? 1.54178 0.82748 1.36478 -0.25214 -0.32510 0.04106 342 ASN A N 5925 C CA . ASN A 342 ? 1.48215 0.79918 1.35789 -0.23159 -0.28922 0.02872 342 ASN A CA 5926 C C . ASN A 342 ? 1.50457 0.88198 1.41722 -0.23888 -0.25010 0.00561 342 ASN A C 5927 O O . ASN A 342 ? 1.36613 0.78871 1.30944 -0.24099 -0.21779 0.00475 342 ASN A O 5928 C CB . ASN A 342 ? 1.45509 0.77380 1.38974 -0.17986 -0.28202 0.02545 342 ASN A CB 5931 N N . ILE A 343 ? 1.33780 0.71671 1.25214 -0.24534 -0.25131 -0.01252 343 ILE A N 5932 C CA . ILE A 343 ? 1.30758 0.73202 1.25969 -0.25204 -0.20786 -0.04470 343 ILE A CA 5933 C C . ILE A 343 ? 1.26801 0.72510 1.18010 -0.29427 -0.18396 -0.05325 343 ILE A C 5934 O O . ILE A 343 ? 1.18744 0.68935 1.15511 -0.28817 -0.13610 -0.07044 343 ILE A O 5935 C CB . ILE A 343 ? 1.14637 0.55961 1.09198 -0.26119 -0.21816 -0.06384 343 ILE A CB 5936 C CG1 . ILE A 343 ? 1.23419 0.63660 1.24935 -0.21308 -0.22507 -0.05980 343 ILE A CG1 5937 C CG2 . ILE A 343 ? 1.19770 0.64540 1.15187 -0.28725 -0.17226 -0.10634 343 ILE A CG2 5938 C CD1 . ILE A 343 ? 1.31198 0.68252 1.30490 -0.21461 -0.27011 -0.04370 343 ILE A CD1 5950 N N . GLY A 344 ? 1.28027 0.71925 1.10431 -0.33767 -0.21618 -0.03772 344 GLY A N 5951 C CA . GLY A 344 ? 1.29277 0.76996 1.07286 -0.38339 -0.19401 -0.04482 344 GLY A CA 5952 C C . GLY A 344 ? 1.25598 0.76318 1.06532 -0.37417 -0.17394 -0.02598 344 GLY A C 5953 O O . GLY A 344 ? 1.32393 0.88535 1.15698 -0.38865 -0.12945 -0.04029 344 GLY A O 5957 N N . HIS A 345 ? 1.25679 0.73186 1.06655 -0.35325 -0.20439 0.00631 345 HIS A N 5958 C CA . HIS A 345 ? 1.32174 0.82850 1.15199 -0.35366 -0.19147 0.03018 345 HIS A CA 5959 C C . HIS A 345 ? 1.26292 0.82539 1.20259 -0.31844 -0.14399 0.02224 345 HIS A C 5960 O O . HIS A 345 ? 1.20641 0.82730 1.18520 -0.32792 -0.11369 0.03427 345 HIS A O 5961 C CB . HIS A 345 ? 1.33073 0.78344 1.12684 -0.34658 -0.23319 0.05963 345 HIS A CB 5964 N N . TYR A 346 ? 1.11674 0.66594 1.11542 -0.27854 -0.13853 0.00769 346 TYR A N 5965 C CA . TYR A 346 ? 1.11177 0.71114 1.22483 -0.24543 -0.09824 0.00620 346 TYR A CA 5966 C C . TYR A 346 ? 1.17699 0.82044 1.33947 -0.25341 -0.04561 -0.02430 346 TYR A C 5967 O O . TYR A 346 ? 1.09830 0.79974 1.34619 -0.24464 -0.00809 -0.01160 346 TYR A O 5968 C CB . TYR A 346 ? 1.15774 0.73069 1.31509 -0.20665 -0.10759 -0.00307 346 TYR A CB 5969 C CG . TYR A 346 ? 1.04849 0.66805 1.32955 -0.17354 -0.07167 -0.00152 346 TYR A CG 5970 C CD1 . TYR A 346 ? 1.00550 0.63883 1.34871 -0.16498 -0.03177 -0.03623 346 TYR A CD1 5971 C CD2 . TYR A 346 ? 0.86827 0.51701 1.20416 -0.15564 -0.07842 0.03585 346 TYR A CD2 5972 C CE1 . TYR A 346 ? 0.98226 0.65224 1.45169 -0.13344 -0.00070 -0.03021 346 TYR A CE1 5973 C CE2 . TYR A 346 ? 0.78108 0.47656 1.23676 -0.12920 -0.05217 0.04817 346 TYR A CE2 5974 C CZ . TYR A 346 ? 0.82609 0.52986 1.35554 -0.11491 -0.01377 0.01682 346 TYR A CZ 5975 O OH . TYR A 346 ? 0.73367 0.47931 1.39580 -0.08738 0.01081 0.03397 346 TYR A OH 5985 N N . LEU A 347 ? 1.23594 0.85483 1.34885 -0.27318 -0.04038 -0.06423 347 LEU A N 5986 C CA . LEU A 347 ? 1.29285 0.94524 1.44661 -0.28399 0.01753 -0.10702 347 LEU A CA 5987 C C . LEU A 347 ? 1.28993 0.98757 1.41292 -0.32162 0.04220 -0.10474 347 LEU A C 5988 O O . LEU A 347 ? 1.23072 0.97423 1.42472 -0.31999 0.10315 -0.13041 347 LEU A O 5989 C CB . LEU A 347 ? 1.37011 0.98440 1.46608 -0.30507 0.01350 -0.15163 347 LEU A CB 5990 C CG . LEU A 347 ? 1.28889 0.87096 1.43643 -0.26826 0.00250 -0.16036 347 LEU A CG 5991 C CD1 . LEU A 347 ? 1.20220 0.75275 1.28189 -0.30098 -0.00686 -0.19841 347 LEU A CD1 5992 C CD2 . LEU A 347 ? 1.02201 0.63356 1.30796 -0.22685 0.05262 -0.16996 347 LEU A CD2 6004 N N . GLU A 348 ? 1.34306 1.02876 1.36813 -0.35538 -0.00183 -0.07414 348 GLU A N 6005 C CA . GLU A 348 ? 1.45128 1.18740 1.44961 -0.39269 0.01699 -0.06256 348 GLU A CA 6006 C C . GLU A 348 ? 1.41628 1.21558 1.52674 -0.36665 0.05103 -0.03223 348 GLU A C 6007 O O . GLU A 348 ? 1.42894 1.28992 1.56971 -0.38485 0.09380 -0.03454 348 GLU A O 6008 C CB . GLU A 348 ? 1.42277 1.12694 1.30370 -0.43169 -0.04510 -0.02571 348 GLU A CB 6009 C CG . GLU A 348 ? 1.64677 1.40256 1.48762 -0.47700 -0.03693 -0.00410 348 GLU A CG 6010 C CD . GLU A 348 ? 1.67503 1.47809 1.49354 -0.51592 0.01175 -0.04644 348 GLU A CD 6011 O OE1 . GLU A 348 ? 1.66656 1.49413 1.40542 -0.56881 -0.00119 -0.03116 348 GLU A OE1 6012 O OE2 . GLU A 348 ? 1.78364 1.59951 1.66129 -0.49800 0.06450 -0.09641 348 GLU A OE2 6019 N N . ARG A 349 ? 1.38592 1.17872 1.56326 -0.32743 0.03340 -0.00039 349 ARG A N 6020 C CA . ARG A 349 ? 1.32823 1.18509 1.60156 -0.31288 0.04824 0.04705 349 ARG A CA 6021 C C . ARG A 349 ? 1.36336 1.26213 1.79527 -0.26849 0.09914 0.04126 349 ARG A C 6022 O O . ARG A 349 ? 1.43285 1.39670 1.96582 -0.25704 0.11322 0.08835 349 ARG A O 6023 C CB . ARG A 349 ? 1.26887 1.09991 1.50334 -0.31230 -0.00857 0.09474 349 ARG A CB 6026 N N . VAL A 350 ? 1.28062 1.14504 1.74183 -0.24651 0.12422 -0.00972 350 VAL A N 6027 C CA . VAL A 350 ? 1.21087 1.10752 1.82984 -0.20651 0.17745 -0.01968 350 VAL A CA 6028 C C . VAL A 350 ? 1.26645 1.18369 1.91839 -0.21724 0.24800 -0.07573 350 VAL A C 6029 O O . VAL A 350 ? 1.24676 1.22912 1.96300 -0.22277 0.28750 -0.05985 350 VAL A O 6030 C CB . VAL A 350 ? 1.18006 1.02555 1.82727 -0.17437 0.16326 -0.03869 350 VAL A CB 6031 C CG1 . VAL A 350 ? 1.16077 0.97575 1.74017 -0.17202 0.09567 0.00036 350 VAL A CG1 6032 C CG2 . VAL A 350 ? 1.19277 0.98309 1.77161 -0.18895 0.17999 -0.11075 350 VAL A CG2 # If you find results from this site helpful for your research, please cite one of our papers:
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