data_1OCB # _entry.id 1OCB # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1OCB PDBE EBI-9844 WWPDB D_1290009844 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.content_type _pdbx_database_related.details PDB 1BVW unspecified 'CELLOBIOHYDROLASE II (CEL6A) FROM HUMICOLA INSOLENS' PDB 1GZ1 unspecified ;MUTANT D416A OF THE CELLOBIOHYDROLASE CEL6A FROM HUMICOLA INSOLENS IN COMPLEX WITH METHYL-CELLOBIOSYL-4-DEOXY-4-THIO-BETA-D- CELLOBIOSIDE ; PDB 1HGW unspecified 'CEL6A D175A MUTANT' PDB 1HGY unspecified 'CEL6A D221A MUTANT' PDB 1OC5 unspecified ;D405N MUTANT OF THE CELLOBIOHYDROLASE CEL6A FROM HUMICOLA INSOLENS IN COMPLEX WITH METHYL-CELLOBIOSYL-4-DEOXY-4-THIO-BETA-D- CELLOBIOSIDE ; PDB 1OC6 unspecified 'STRUCTURE NATIVE OF THE D405N MUTANT OF THE CELLOBIOHYDROLASE CEL6A FROM HUMICOLA INSOLENS AT 1.5 ANGSTROM RESOLUTION' PDB 1OC7 unspecified ;D405N MUTANT OF THE CELLOBIOHYDROLASE CEL6A FROM HUMICOLA INSOLENS IN COMPLEX WITH METHYL-TETRATHIO-ALPHA-D-CELLOPENTOSIDE AT 1 .1 ANGSTROM RESOLUTION ; PDB 1OCJ unspecified 'MUTANT D416A OF THE CELLOBIOHYDROLASE CEL6A FROM HUMICOLA INSOLENS IN COMPLEX WITH A THIOPENTASACCHARIDE AT 1.3 ANGSTROM RESOLUTION' PDB 1OCN unspecified ;MUTANT D416A OF THE CELLOBIOHYDROLASE CEL6A FROM HUMICOLA INSOLENS IN COMPLEX WITH A CELLOBIO-DERIVED ISOFAGOMINE AT 1.3 ANGSTROM RESOLUTION ; PDB 1QJW unspecified 'CEL6A (Y169F) WITH A NON-HYDROLYSABLE CELLOTETRAOSE' PDB 1QK0 unspecified 'CEL6A (Y169F) WITH A NON-HYDROLYSABLE CELLOTETRAOSE' PDB 1QK2 unspecified 'WILD TYPE CEL6A WITH A NON-HYDROLYSABLE CELLOTETRAOSE' PDB 2BVW unspecified 'CELLOBIOHYDROLASE II (CEL6A) FROM HUMICOLA INSOLENS IN COMPLEX WITH GLUCOSE AND CELLOTETRAOSE' # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 1OCB _pdbx_database_status.deposit_site PDBE _pdbx_database_status.process_site PDBE _pdbx_database_status.SG_entry . _pdbx_database_status.recvd_initial_deposition_date 2003-02-07 _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_sf ? _pdbx_database_status.status_code_mr ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Varrot, A.' 1 'Frandsen, T.P.' 2 'Von Ossowski, I.' 3 'Boyer, V.' 4 'Driguez, H.' 5 'Schulein, M.' 6 'Davies, G.J.' 7 # _citation.id primary _citation.title 'Structural Basis for Ligand Binding and Processivity in Cellobiohydrolase Cel6A from Humicola Insolens' _citation.journal_abbrev Structure _citation.journal_volume 11 _citation.page_first 855 _citation.page_last ? _citation.year 2003 _citation.journal_id_ASTM STRUE6 _citation.country UK _citation.journal_id_ISSN 0969-2126 _citation.journal_id_CSD 2005 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 12842048 _citation.pdbx_database_id_DOI '10.1016/S0969-2126(03)00124-2' # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Varrot, A.' 1 primary 'Frandsen, T.P.' 2 primary 'Von Ossowski, I.' 3 primary 'Boyer, V.' 4 primary 'Driguez, H.' 5 primary 'Schulein, M.' 6 primary 'Davies, G.J.' 7 # _cell.entry_id 1OCB _cell.length_a 49.763 _cell.length_b 155.681 _cell.length_c 51.218 _cell.angle_alpha 90.00 _cell.angle_beta 118.42 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? # _symmetry.entry_id 1OCB _symmetry.space_group_name_H-M 'P 1 21 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 4 # 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 'CELLOBIOHYDROLASE II' 40014.512 2 3.2.1.91 ? 'CATALYTIC CORE DOMAIN, RESIDUES 89-450' 'N-LINKED N-ACETYLGLUCOSAMINE ON RESIDUE ASN 141' 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 3 non-polymer man O1-METHYL-4-DEOXY-4-THIO-BETA-D-GLUCOSE 210.248 4 ? ? ? ? 4 non-polymer man BETA-D-GLUCOSE 180.156 8 ? ? ? ? 5 non-polymer syn 4-DEOXY-4-AMINO-BETA-D-GLUCOSE 179.171 2 ? ? ? ? 6 non-polymer syn GLYCEROL 92.094 2 ? ? ? ? 7 non-polymer syn FLUORESCEINYLTHIOUREIDO 434.464 1 ? ? ? ? 8 water nat water 18.015 715 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'CELLULASE, CEL6A' # _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 ;YNGNPFEGVQLWANNYYRSEVHTLAIPQITDPALRAAASAVAEVPSFQWLDRNVTVDTLLVQTLSEIREANQAGANPQYA AQIVVYDLPDRDCAAAASNGEWAIANNGVNNYKAYINRIREILISFSDVRTILVIEPDSLANMVTNMNVPKCSGAASTYR ELTIYALKQLDLPHVAMYMDAGHAGWLGWPANIQPAAELFAKIYEDAGKPRAVRGLATNVANYNAWSVSSPPPYTSPNPN YDEKHYIEAFRPLLEARGFPAQFIVDQGRSGKQPTGQKEWGHWCNAIGTGFGMRPTANTGHQYVDAFVWVKPGGECDGTS DTTAARYDYHCGLEDALKPAPEAGQWFNEYFIQLLRNANPPF ; _entity_poly.pdbx_seq_one_letter_code_can ;YNGNPFEGVQLWANNYYRSEVHTLAIPQITDPALRAAASAVAEVPSFQWLDRNVTVDTLLVQTLSEIREANQAGANPQYA AQIVVYDLPDRDCAAAASNGEWAIANNGVNNYKAYINRIREILISFSDVRTILVIEPDSLANMVTNMNVPKCSGAASTYR ELTIYALKQLDLPHVAMYMDAGHAGWLGWPANIQPAAELFAKIYEDAGKPRAVRGLATNVANYNAWSVSSPPPYTSPNPN YDEKHYIEAFRPLLEARGFPAQFIVDQGRSGKQPTGQKEWGHWCNAIGTGFGMRPTANTGHQYVDAFVWVKPGGECDGTS DTTAARYDYHCGLEDALKPAPEAGQWFNEYFIQLLRNANPPF ; _entity_poly.pdbx_strand_id A,B _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 TYR n 1 2 ASN n 1 3 GLY n 1 4 ASN n 1 5 PRO n 1 6 PHE n 1 7 GLU n 1 8 GLY n 1 9 VAL n 1 10 GLN n 1 11 LEU n 1 12 TRP n 1 13 ALA n 1 14 ASN n 1 15 ASN n 1 16 TYR n 1 17 TYR n 1 18 ARG n 1 19 SER n 1 20 GLU n 1 21 VAL n 1 22 HIS n 1 23 THR n 1 24 LEU n 1 25 ALA n 1 26 ILE n 1 27 PRO n 1 28 GLN n 1 29 ILE n 1 30 THR n 1 31 ASP n 1 32 PRO n 1 33 ALA n 1 34 LEU n 1 35 ARG n 1 36 ALA n 1 37 ALA n 1 38 ALA n 1 39 SER n 1 40 ALA n 1 41 VAL n 1 42 ALA n 1 43 GLU n 1 44 VAL n 1 45 PRO n 1 46 SER n 1 47 PHE n 1 48 GLN n 1 49 TRP n 1 50 LEU n 1 51 ASP n 1 52 ARG n 1 53 ASN n 1 54 VAL n 1 55 THR n 1 56 VAL n 1 57 ASP n 1 58 THR n 1 59 LEU n 1 60 LEU n 1 61 VAL n 1 62 GLN n 1 63 THR n 1 64 LEU n 1 65 SER n 1 66 GLU n 1 67 ILE n 1 68 ARG n 1 69 GLU n 1 70 ALA n 1 71 ASN n 1 72 GLN n 1 73 ALA n 1 74 GLY n 1 75 ALA n 1 76 ASN n 1 77 PRO n 1 78 GLN n 1 79 TYR n 1 80 ALA n 1 81 ALA n 1 82 GLN n 1 83 ILE n 1 84 VAL n 1 85 VAL n 1 86 TYR n 1 87 ASP n 1 88 LEU n 1 89 PRO n 1 90 ASP n 1 91 ARG n 1 92 ASP n 1 93 CYS n 1 94 ALA n 1 95 ALA n 1 96 ALA n 1 97 ALA n 1 98 SER n 1 99 ASN n 1 100 GLY n 1 101 GLU n 1 102 TRP n 1 103 ALA n 1 104 ILE n 1 105 ALA n 1 106 ASN n 1 107 ASN n 1 108 GLY n 1 109 VAL n 1 110 ASN n 1 111 ASN n 1 112 TYR n 1 113 LYS n 1 114 ALA n 1 115 TYR n 1 116 ILE n 1 117 ASN n 1 118 ARG n 1 119 ILE n 1 120 ARG n 1 121 GLU n 1 122 ILE n 1 123 LEU n 1 124 ILE n 1 125 SER n 1 126 PHE n 1 127 SER n 1 128 ASP n 1 129 VAL n 1 130 ARG n 1 131 THR n 1 132 ILE n 1 133 LEU n 1 134 VAL n 1 135 ILE n 1 136 GLU n 1 137 PRO n 1 138 ASP n 1 139 SER n 1 140 LEU n 1 141 ALA n 1 142 ASN n 1 143 MET n 1 144 VAL n 1 145 THR n 1 146 ASN n 1 147 MET n 1 148 ASN n 1 149 VAL n 1 150 PRO n 1 151 LYS n 1 152 CYS n 1 153 SER n 1 154 GLY n 1 155 ALA n 1 156 ALA n 1 157 SER n 1 158 THR n 1 159 TYR n 1 160 ARG n 1 161 GLU n 1 162 LEU n 1 163 THR n 1 164 ILE n 1 165 TYR n 1 166 ALA n 1 167 LEU n 1 168 LYS n 1 169 GLN n 1 170 LEU n 1 171 ASP n 1 172 LEU n 1 173 PRO n 1 174 HIS n 1 175 VAL n 1 176 ALA n 1 177 MET n 1 178 TYR n 1 179 MET n 1 180 ASP n 1 181 ALA n 1 182 GLY n 1 183 HIS n 1 184 ALA n 1 185 GLY n 1 186 TRP n 1 187 LEU n 1 188 GLY n 1 189 TRP n 1 190 PRO n 1 191 ALA n 1 192 ASN n 1 193 ILE n 1 194 GLN n 1 195 PRO n 1 196 ALA n 1 197 ALA n 1 198 GLU n 1 199 LEU n 1 200 PHE n 1 201 ALA n 1 202 LYS n 1 203 ILE n 1 204 TYR n 1 205 GLU n 1 206 ASP n 1 207 ALA n 1 208 GLY n 1 209 LYS n 1 210 PRO n 1 211 ARG n 1 212 ALA n 1 213 VAL n 1 214 ARG n 1 215 GLY n 1 216 LEU n 1 217 ALA n 1 218 THR n 1 219 ASN n 1 220 VAL n 1 221 ALA n 1 222 ASN n 1 223 TYR n 1 224 ASN n 1 225 ALA n 1 226 TRP n 1 227 SER n 1 228 VAL n 1 229 SER n 1 230 SER n 1 231 PRO n 1 232 PRO n 1 233 PRO n 1 234 TYR n 1 235 THR n 1 236 SER n 1 237 PRO n 1 238 ASN n 1 239 PRO n 1 240 ASN n 1 241 TYR n 1 242 ASP n 1 243 GLU n 1 244 LYS n 1 245 HIS n 1 246 TYR n 1 247 ILE n 1 248 GLU n 1 249 ALA n 1 250 PHE n 1 251 ARG n 1 252 PRO n 1 253 LEU n 1 254 LEU n 1 255 GLU n 1 256 ALA n 1 257 ARG n 1 258 GLY n 1 259 PHE n 1 260 PRO n 1 261 ALA n 1 262 GLN n 1 263 PHE n 1 264 ILE n 1 265 VAL n 1 266 ASP n 1 267 GLN n 1 268 GLY n 1 269 ARG n 1 270 SER n 1 271 GLY n 1 272 LYS n 1 273 GLN n 1 274 PRO n 1 275 THR n 1 276 GLY n 1 277 GLN n 1 278 LYS n 1 279 GLU n 1 280 TRP n 1 281 GLY n 1 282 HIS n 1 283 TRP n 1 284 CYS n 1 285 ASN n 1 286 ALA n 1 287 ILE n 1 288 GLY n 1 289 THR n 1 290 GLY n 1 291 PHE n 1 292 GLY n 1 293 MET n 1 294 ARG n 1 295 PRO n 1 296 THR n 1 297 ALA n 1 298 ASN n 1 299 THR n 1 300 GLY n 1 301 HIS n 1 302 GLN n 1 303 TYR n 1 304 VAL n 1 305 ASP n 1 306 ALA n 1 307 PHE n 1 308 VAL n 1 309 TRP n 1 310 VAL n 1 311 LYS n 1 312 PRO n 1 313 GLY n 1 314 GLY n 1 315 GLU n 1 316 CYS n 1 317 ASP n 1 318 GLY n 1 319 THR n 1 320 SER n 1 321 ASP n 1 322 THR n 1 323 THR n 1 324 ALA n 1 325 ALA n 1 326 ARG n 1 327 TYR n 1 328 ASP n 1 329 TYR n 1 330 HIS n 1 331 CYS n 1 332 GLY n 1 333 LEU n 1 334 GLU n 1 335 ASP n 1 336 ALA n 1 337 LEU n 1 338 LYS n 1 339 PRO n 1 340 ALA n 1 341 PRO n 1 342 GLU n 1 343 ALA n 1 344 GLY n 1 345 GLN n 1 346 TRP n 1 347 PHE n 1 348 ASN n 1 349 GLU n 1 350 TYR n 1 351 PHE n 1 352 ILE n 1 353 GLN n 1 354 LEU n 1 355 LEU n 1 356 ARG n 1 357 ASN n 1 358 ALA n 1 359 ASN n 1 360 PRO n 1 361 PRO n 1 362 PHE 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 ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name ? _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene ? _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 'HUMICOLA INSOLENS' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 34413 _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 'ASPERGILLUS ORYZAE' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 5062 _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 'UNDER CONTROL OF THE FUNGAL AMYLASE PROMOTER AND AMYLOGLUCOSIDASE TERMINATOR' _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name PDB _struct_ref.db_code 1OCB _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ? _struct_ref.pdbx_align_begin ? _struct_ref.pdbx_db_accession 1OCB _struct_ref.pdbx_db_isoform ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 1OCB A 1 ? 362 ? 1OCB 89 ? 450 ? 89 450 2 1 1OCB B 1 ? 362 ? 1OCB 89 ? 450 ? 89 450 # 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 BGC saccharide . BETA-D-GLUCOSE ? 'C6 H12 O6' 180.156 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FLG non-polymer . FLUORESCEINYLTHIOUREIDO ? 'C23 H18 N2 O5 S' 434.464 GDA non-polymer . 4-DEOXY-4-AMINO-BETA-D-GLUCOSE ? 'C6 H13 N O5' 179.171 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 GTM non-polymer . O1-METHYL-4-DEOXY-4-THIO-BETA-D-GLUCOSE ? 'C7 H14 O5 S' 210.248 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 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 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 # _exptl.entry_id 1OCB _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.1 _exptl_crystal.density_percent_sol 41.7 _exptl_crystal.description ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method ? _exptl_crystal_grow.temp ? _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 4.60 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details ;THE PROTEIN WAS CONCENTRATED IN WATER TO 7 MG/ML IT WAS INCUBATED 1H PRIOR CRYSTALLISATION WITH THE 5MM OF THE SUBSTRATE 16% PEG5KMME AND 200 MM CALCIUM ACETATE WERE USED AS PRECIPITANT AND 100 MM SODIUM ACETATE PH 4.6 AS BUFFER. ; # _diffrn.id 1 _diffrn.ambient_temp 100.0 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC CCD' _diffrn_detector.pdbx_collection_date 2000-11-15 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.932 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ESRF BEAMLINE ID14-4' _diffrn_source.pdbx_synchrotron_site ESRF _diffrn_source.pdbx_synchrotron_beamline ID14-4 _diffrn_source.pdbx_wavelength 0.932 _diffrn_source.pdbx_wavelength_list ? # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 1OCB _reflns.observed_criterion_sigma_I 2.000 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 40.000 _reflns.d_resolution_high 1.750 _reflns.number_obs 69418 _reflns.number_all ? _reflns.percent_possible_obs 97.5 _reflns.pdbx_Rmerge_I_obs 0.04100 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 17.3000 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 2.200 # _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_ordinal 1 _reflns_shell.d_res_high 1.75 _reflns_shell.d_res_low 1.81 _reflns_shell.percent_possible_all 91.3 _reflns_shell.Rmerge_I_obs 0.12800 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 6.000 _reflns_shell.pdbx_redundancy 2.00 # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 1OCB _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag 'LIKELY RESIDUAL' _refine.ls_number_reflns_obs 63815 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 38.92 _refine.ls_d_res_high 1.75 _refine.ls_percent_reflns_obs 97.7 _refine.ls_R_factor_obs 0.135 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.133 _refine.ls_R_factor_R_free 0.168 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.000 _refine.ls_number_reflns_R_free 3394 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.972 _refine.correlation_coeff_Fo_to_Fc_free 0.958 _refine.B_iso_mean 9.06 _refine.aniso_B[1][1] 1.68000 _refine.aniso_B[2][2] -1.26000 _refine.aniso_B[3][3] -0.17000 _refine.aniso_B[1][2] 0.00000 _refine.aniso_B[1][3] 0.25000 _refine.aniso_B[2][3] 0.00000 _refine.solvent_model_details 'BABINET MODEL WITH MASK' _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.40 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.pdbx_starting_model 'PDB ENTRY 2BVW' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R 0.101 _refine.pdbx_overall_ESU_R_Free 0.097 _refine.overall_SU_ML 0.061 _refine.pdbx_overall_phase_error ? _refine.overall_SU_B 1.877 _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 5630 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 230 _refine_hist.number_atoms_solvent 715 _refine_hist.number_atoms_total 6575 _refine_hist.d_res_high 1.75 _refine_hist.d_res_low 38.92 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function r_bond_refined_d 0.016 0.021 ? 6073 'X-RAY DIFFRACTION' ? r_bond_other_d 0.002 0.020 ? 5176 'X-RAY DIFFRACTION' ? r_angle_refined_deg 1.578 1.967 ? 8320 'X-RAY DIFFRACTION' ? r_angle_other_deg 0.911 3.000 ? 12044 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 5.904 5.000 ? 720 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_chiral_restr 0.100 0.200 ? 918 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.009 0.020 ? 6713 'X-RAY DIFFRACTION' ? r_gen_planes_other 0.006 0.020 ? 1209 'X-RAY DIFFRACTION' ? r_nbd_refined 0.221 0.200 ? 1149 'X-RAY DIFFRACTION' ? r_nbd_other 0.255 0.200 ? 6063 'X-RAY DIFFRACTION' ? r_nbtor_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_other 0.083 0.200 ? 3347 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined 0.131 0.200 ? 500 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined 0.180 0.200 ? 22 'X-RAY DIFFRACTION' ? r_symmetry_vdw_other 0.258 0.200 ? 79 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined 0.154 0.200 ? 36 'X-RAY DIFFRACTION' ? r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcbond_it 0.796 1.500 ? 3620 'X-RAY DIFFRACTION' ? r_mcbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcangle_it 1.348 2.000 ? 5823 'X-RAY DIFFRACTION' ? r_mcangle_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_scbond_it 2.331 3.000 ? 2453 'X-RAY DIFFRACTION' ? r_scbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_scangle_it 3.500 4.500 ? 2497 'X-RAY DIFFRACTION' ? r_scangle_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_long_range_B_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_long_range_B_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 1.75 _refine_ls_shell.d_res_low 1.79 _refine_ls_shell.number_reflns_R_work 4393 _refine_ls_shell.R_factor_R_work 0.1470 _refine_ls_shell.percent_reflns_obs ? _refine_ls_shell.R_factor_R_free 0.2000 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 252 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? # _struct.entry_id 1OCB _struct.title 'Structure of the wild-type cellobiohydrolase Cel6A from Humicolas insolens in complex with a fluorescent substrate' _struct.pdbx_descriptor 'CELLOBIOHYDROLASE II (E.C.3.2.1.91)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1OCB _struct_keywords.pdbx_keywords HYDROLASE _struct_keywords.text 'HYDROLASE, CELLULOSE DEGRADATION, CELLOBIOHYDROLASE, CELLULASE, GLYCOSIDE HYDROLASE FAMILY 6, PROCESSIVE MECHANISM' # 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 1 ? C N N 2 ? D N N 3 ? E N N 4 ? F N N 4 ? G N N 5 ? H N N 3 ? I N N 4 ? J N N 4 ? K N N 6 ? L N N 2 ? M N N 3 ? N N N 4 ? O N N 4 ? P N N 5 ? Q N N 3 ? R N N 4 ? S N N 4 ? T N N 6 ? U N N 7 ? V N N 8 ? W N N 8 ? # _struct_biol.id 1 # 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 1 ASN A 14 ? LEU A 24 ? ASN A 102 LEU A 112 1 ? 11 HELX_P HELX_P2 2 ALA A 25 ? ILE A 29 ? ALA A 113 ILE A 117 5 ? 5 HELX_P HELX_P3 3 ASP A 31 ? ALA A 42 ? ASP A 119 ALA A 130 1 ? 12 HELX_P HELX_P4 4 ARG A 52 ? VAL A 56 ? ARG A 140 VAL A 144 5 ? 5 HELX_P HELX_P5 5 THR A 58 ? GLY A 74 ? THR A 146 GLY A 162 1 ? 17 HELX_P HELX_P6 6 ALA A 103 ? ASN A 106 ? ALA A 191 ASN A 194 5 ? 4 HELX_P HELX_P7 7 ASN A 107 ? PHE A 126 ? ASN A 195 PHE A 214 1 ? 20 HELX_P HELX_P8 8 ASP A 138 ? ASN A 146 ? ASP A 226 ASN A 234 1 ? 9 HELX_P HELX_P9 9 VAL A 149 ? LEU A 170 ? VAL A 237 LEU A 258 1 ? 22 HELX_P HELX_P10 10 TRP A 189 ? ALA A 207 ? TRP A 277 ALA A 295 1 ? 19 HELX_P HELX_P11 11 PRO A 232 ? SER A 236 ? PRO A 320 SER A 324 5 ? 5 HELX_P HELX_P12 12 ASP A 242 ? ARG A 257 ? ASP A 330 ARG A 345 1 ? 16 HELX_P HELX_P13 13 ASP A 328 ? LEU A 333 ? ASP A 416 LEU A 421 5 ? 6 HELX_P HELX_P14 14 PHE A 347 ? ASN A 357 ? PHE A 435 ASN A 445 1 ? 11 HELX_P HELX_P15 15 ASN B 14 ? LEU B 24 ? ASN B 102 LEU B 112 1 ? 11 HELX_P HELX_P16 16 ALA B 25 ? ILE B 29 ? ALA B 113 ILE B 117 5 ? 5 HELX_P HELX_P17 17 ASP B 31 ? ALA B 42 ? ASP B 119 ALA B 130 1 ? 12 HELX_P HELX_P18 18 ARG B 52 ? VAL B 56 ? ARG B 140 VAL B 144 5 ? 5 HELX_P HELX_P19 19 THR B 58 ? ALA B 73 ? THR B 146 ALA B 161 1 ? 16 HELX_P HELX_P20 20 ALA B 103 ? ASN B 106 ? ALA B 191 ASN B 194 5 ? 4 HELX_P HELX_P21 21 ASN B 107 ? PHE B 126 ? ASN B 195 PHE B 214 1 ? 20 HELX_P HELX_P22 22 ASP B 138 ? ASN B 146 ? ASP B 226 ASN B 234 1 ? 9 HELX_P HELX_P23 23 VAL B 149 ? LEU B 170 ? VAL B 237 LEU B 258 1 ? 22 HELX_P HELX_P24 24 TRP B 189 ? ALA B 207 ? TRP B 277 ALA B 295 1 ? 19 HELX_P HELX_P25 25 PRO B 232 ? SER B 236 ? PRO B 320 SER B 324 5 ? 5 HELX_P HELX_P26 26 ASP B 242 ? ARG B 257 ? ASP B 330 ARG B 345 1 ? 16 HELX_P HELX_P27 27 ASP B 328 ? LEU B 333 ? ASP B 416 LEU B 421 5 ? 6 HELX_P HELX_P28 28 PHE B 347 ? ASN B 357 ? PHE B 435 ASN B 445 1 ? 11 # _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 disulf1 disulf ? ? A CYS 93 SG ? ? ? 1_555 A CYS 152 SG ? ? A CYS 181 A CYS 240 1_555 ? ? ? ? ? ? ? 2.104 ? disulf2 disulf ? ? A CYS 284 SG ? ? ? 1_555 A CYS 331 SG ? ? A CYS 372 A CYS 419 1_555 ? ? ? ? ? ? ? 2.047 ? disulf3 disulf ? ? B CYS 93 SG ? ? ? 1_555 B CYS 152 SG ? ? B CYS 181 B CYS 240 1_555 ? ? ? ? ? ? ? 2.097 ? disulf4 disulf ? ? B CYS 284 SG ? ? ? 1_555 B CYS 331 SG ? ? B CYS 372 B CYS 419 1_555 ? ? ? ? ? ? ? 2.045 ? covale1 covale ? ? A ASN 53 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 141 A NAG 451 1_555 ? ? ? ? ? ? ? 1.444 ? covale2 covale ? ? D GTM . S4 ? ? ? 1_555 E BGC . C1 ? ? A GTM 452 A BGC 453 1_555 ? ? ? ? ? ? ? 1.827 ? covale3 covale ? ? E BGC . O4 ? ? ? 1_555 F BGC . C1 ? ? A BGC 453 A BGC 454 1_555 ? ? ? ? ? ? ? 1.423 ? covale4 covale ? ? F BGC . O4 ? ? ? 1_555 G GDA . C1 ? ? A BGC 454 A GDA 455 1_555 ? ? ? ? ? ? ? 1.414 ? covale5 covale ? ? H GTM . S4 ? ? ? 1_555 I BGC . C1 ? ? A GTM 456 A BGC 457 1_555 ? ? ? ? ? ? ? 1.788 ? covale6 covale ? ? I BGC . O4 ? ? ? 1_555 J BGC . C1 ? ? A BGC 457 A BGC 458 1_555 ? ? ? ? ? ? ? 1.431 ? covale7 covale ? ? B ASN 53 ND2 ? ? ? 1_555 L NAG . C1 ? ? B ASN 141 B NAG 451 1_555 ? ? ? ? ? ? ? 1.441 ? covale8 covale ? ? M GTM . S4 ? ? ? 1_555 N BGC . C1 ? ? B GTM 452 B BGC 453 1_555 ? ? ? ? ? ? ? 1.842 ? covale9 covale ? ? N BGC . O4 ? ? ? 1_555 O BGC . C1 ? ? B BGC 453 B BGC 454 1_555 ? ? ? ? ? ? ? 1.410 ? covale10 covale ? ? O BGC . O4 ? ? ? 1_555 P GDA . C1 ? ? B BGC 454 B GDA 455 1_555 ? ? ? ? ? ? ? 1.421 ? covale11 covale ? ? Q GTM . S4 ? ? ? 1_555 R BGC . C1 ? ? B GTM 456 B BGC 457 1_555 ? ? ? ? ? ? ? 1.785 ? covale12 covale ? ? R BGC . O4 ? ? ? 1_555 S BGC . C1 ? ? B BGC 457 B BGC 458 1_555 ? ? ? ? ? ? ? 1.434 ? covale13 covale ? ? U FLG . C6 ? ? ? 1_555 A GLN 62 NE2 A ? B FLG 460 A GLN 150 1_454 ? ? ? ? ? ? ? 1.778 ? covale14 covale ? ? U FLG . O3 ? ? ? 1_555 A GLN 62 NE2 A ? B FLG 460 A GLN 150 1_454 ? ? ? ? ? ? ? 1.702 ? covale15 covale ? ? U FLG . C7 ? ? ? 1_555 A GLN 62 NE2 A ? B FLG 460 A GLN 150 1_454 ? ? ? ? ? ? ? 1.877 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 ASN 76 A . ? ASN 164 A PRO 77 A ? PRO 165 A 1 -2.87 2 SER 236 A . ? SER 324 A PRO 237 A ? PRO 325 A 1 -1.64 3 GLN 273 A . ? GLN 361 A PRO 274 A ? PRO 362 A 1 -9.45 4 LYS 338 A . ? LYS 426 A PRO 339 A ? PRO 427 A 1 -5.38 5 ASN 359 A . ? ASN 447 A PRO 360 A ? PRO 448 A 1 -0.21 6 ASN 76 B . ? ASN 164 B PRO 77 B ? PRO 165 B 1 -3.47 7 SER 236 B . ? SER 324 B PRO 237 B ? PRO 325 B 1 -0.57 8 GLN 273 B . ? GLN 361 B PRO 274 B ? PRO 362 B 1 -5.46 9 LYS 338 B . ? LYS 426 B PRO 339 B ? PRO 427 B 1 -8.46 10 ASN 359 B . ? ASN 447 B PRO 360 B ? PRO 448 B 1 5.18 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA ? 3 ? AB ? 7 ? BA ? 3 ? BB ? 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 AA 1 2 ? parallel AA 2 3 ? parallel AB 1 2 ? parallel AB 2 3 ? parallel AB 3 4 ? parallel AB 4 5 ? parallel AB 5 6 ? parallel AB 6 7 ? parallel BA 1 2 ? parallel BA 2 3 ? parallel BB 1 2 ? parallel BB 2 3 ? parallel BB 3 4 ? parallel BB 4 5 ? parallel BB 5 6 ? parallel BB 6 7 ? 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 AA 1 GLN A 10 ? LEU A 11 ? GLN A 98 LEU A 99 AA 2 TYR A 79 ? VAL A 85 ? TYR A 167 VAL A 173 AA 3 GLN A 48 ? LEU A 50 ? GLN A 136 LEU A 138 AB 1 GLN A 10 ? LEU A 11 ? GLN A 98 LEU A 99 AB 2 TYR A 79 ? VAL A 85 ? TYR A 167 VAL A 173 AB 3 THR A 131 ? ILE A 135 ? THR A 219 ILE A 223 AB 4 VAL A 175 ? ASP A 180 ? VAL A 263 ASP A 268 AB 5 VAL A 213 ? THR A 218 ? VAL A 301 THR A 306 AB 6 GLN A 262 ? ASP A 266 ? GLN A 350 ASP A 354 AB 7 VAL A 304 ? VAL A 308 ? VAL A 392 VAL A 396 BA 1 GLN B 10 ? LEU B 11 ? GLN B 98 LEU B 99 BA 2 TYR B 79 ? VAL B 85 ? TYR B 167 VAL B 173 BA 3 GLN B 48 ? LEU B 50 ? GLN B 136 LEU B 138 BB 1 GLN B 10 ? LEU B 11 ? GLN B 98 LEU B 99 BB 2 TYR B 79 ? VAL B 85 ? TYR B 167 VAL B 173 BB 3 THR B 131 ? ILE B 135 ? THR B 219 ILE B 223 BB 4 VAL B 175 ? ASP B 180 ? VAL B 263 ASP B 268 BB 5 VAL B 213 ? THR B 218 ? VAL B 301 THR B 306 BB 6 GLN B 262 ? ASP B 266 ? GLN B 350 ASP B 354 BB 7 VAL B 304 ? VAL B 308 ? VAL B 392 VAL B 396 # 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 AA 1 2 O GLN A 10 ? O GLN A 98 N ALA A 80 ? N ALA A 168 AA 2 3 N VAL A 84 ? N VAL A 172 O GLN A 48 ? O GLN A 136 AB 1 2 O GLN A 10 ? O GLN A 98 N ALA A 80 ? N ALA A 168 AB 2 3 N ILE A 83 ? N ILE A 171 O ILE A 132 ? O ILE A 220 AB 3 4 N LEU A 133 ? N LEU A 221 O ALA A 176 ? O ALA A 264 AB 4 5 O MET A 177 ? O MET A 265 N ARG A 214 ? N ARG A 302 AB 5 6 N LEU A 216 ? N LEU A 304 O GLN A 262 ? O GLN A 350 AB 6 7 O PHE A 263 ? O PHE A 351 N ASP A 305 ? N ASP A 393 BA 1 2 O GLN B 10 ? O GLN B 98 N ALA B 80 ? N ALA B 168 BA 2 3 N VAL B 84 ? N VAL B 172 O GLN B 48 ? O GLN B 136 BB 1 2 O GLN B 10 ? O GLN B 98 N ALA B 80 ? N ALA B 168 BB 2 3 N ILE B 83 ? N ILE B 171 O ILE B 132 ? O ILE B 220 BB 3 4 N LEU B 133 ? N LEU B 221 O ALA B 176 ? O ALA B 264 BB 4 5 O MET B 177 ? O MET B 265 N ARG B 214 ? N ARG B 302 BB 5 6 N LEU B 216 ? N LEU B 304 O GLN B 262 ? O GLN B 350 BB 6 7 O PHE B 263 ? O PHE B 351 N ASP B 305 ? N ASP B 393 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 10 'BINDING SITE FOR RESIDUE NAG A 451' AC2 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE BGC A 453' AC3 Software ? ? ? ? 11 'BINDING SITE FOR RESIDUE BGC A 454' AC4 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE BGC A 457' AC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE BGC A 458' AC6 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG B 451' AC7 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE BGC B 453' AC8 Software ? ? ? ? 12 'BINDING SITE FOR RESIDUE BGC B 454' AC9 Software ? ? ? ? 10 'BINDING SITE FOR RESIDUE BGC B 457' BC1 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE BGC B 458' BC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GTM A 452' BC3 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE GTM A 456' BC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GTM B 452' BC5 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE GTM B 456' BC6 Software ? ? ? ? 12 'BINDING SITE FOR RESIDUE GDA A 455' BC7 Software ? ? ? ? 12 'BINDING SITE FOR RESIDUE GDA B 455' BC8 Software ? ? ? ? 11 'BINDING SITE FOR RESIDUE FLG B 460' BC9 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE GOL A 459' CC1 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE GOL B 459' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 10 ASN A 53 ? ASN A 141 . ? 1_555 ? 2 AC1 10 ASP A 57 ? ASP A 145 . ? 1_555 ? 3 AC1 10 ASN A 111 ? ASN A 199 . ? 1_555 ? 4 AC1 10 HOH V . ? HOH A 2059 . ? 1_555 ? 5 AC1 10 HOH V . ? HOH A 2060 . ? 1_555 ? 6 AC1 10 HOH V . ? HOH A 2151 . ? 1_555 ? 7 AC1 10 HOH V . ? HOH A 2388 . ? 1_555 ? 8 AC1 10 HOH V . ? HOH A 2389 . ? 1_555 ? 9 AC1 10 HOH V . ? HOH A 2390 . ? 1_555 ? 10 AC1 10 HOH V . ? HOH A 2391 . ? 1_555 ? 11 AC2 9 THR A 145 ? THR A 233 . ? 1_555 ? 12 AC2 9 GLY A 185 ? GLY A 273 . ? 1_555 ? 13 AC2 9 TRP A 186 ? TRP A 274 . ? 1_555 ? 14 AC2 9 TRP A 189 ? TRP A 277 . ? 1_555 ? 15 AC2 9 ASN A 192 ? ASN A 280 . ? 1_555 ? 16 AC2 9 GTM D . ? GTM A 452 . ? 1_555 ? 17 AC2 9 BGC F . ? BGC A 454 . ? 1_555 ? 18 AC2 9 HOH V . ? HOH A 2395 . ? 1_555 ? 19 AC2 9 HOH V . ? HOH A 2396 . ? 1_555 ? 20 AC3 11 ASN A 146 ? ASN A 234 . ? 1_555 ? 21 AC3 11 HIS A 183 ? HIS A 271 . ? 1_555 ? 22 AC3 11 GLY A 185 ? GLY A 273 . ? 1_555 ? 23 AC3 11 ASN A 222 ? ASN A 310 . ? 1_555 ? 24 AC3 11 GLY A 281 ? GLY A 369 . ? 1_555 ? 25 AC3 11 TRP A 283 ? TRP A 371 . ? 1_555 ? 26 AC3 11 BGC E . ? BGC A 453 . ? 1_555 ? 27 AC3 11 GDA G . ? GDA A 455 . ? 1_555 ? 28 AC3 11 HOH V . ? HOH A 2308 . ? 1_555 ? 29 AC3 11 HOH V . ? HOH A 2396 . ? 1_555 ? 30 AC3 11 HOH V . ? HOH A 2397 . ? 1_555 ? 31 AC4 8 ASP A 51 ? ASP A 139 . ? 1_555 ? 32 AC4 8 ARG A 52 ? ARG A 140 . ? 1_555 ? 33 AC4 8 GLU A 315 ? GLU A 403 . ? 1_555 ? 34 AC4 8 GLY A 344 ? GLY A 432 . ? 1_555 ? 35 AC4 8 GTM H . ? GTM A 456 . ? 1_555 ? 36 AC4 8 BGC J . ? BGC A 458 . ? 1_555 ? 37 AC4 8 HOH V . ? HOH A 2401 . ? 1_555 ? 38 AC4 8 HOH V . ? HOH A 2403 . ? 1_555 ? 39 AC5 5 ARG A 52 ? ARG A 140 . ? 1_555 ? 40 AC5 5 LEU A 59 ? LEU A 147 . ? 1_555 ? 41 AC5 5 GLN A 345 ? GLN A 433 . ? 1_555 ? 42 AC5 5 BGC I . ? BGC A 457 . ? 1_555 ? 43 AC5 5 HOH V . ? HOH A 2366 . ? 1_555 ? 44 AC6 7 ASP B 31 ? ASP B 119 . ? 1_555 ? 45 AC6 7 ASN B 53 ? ASN B 141 . ? 1_555 ? 46 AC6 7 ASP B 57 ? ASP B 145 . ? 1_555 ? 47 AC6 7 ASN B 111 ? ASN B 199 . ? 1_555 ? 48 AC6 7 HOH W . ? HOH B 2046 . ? 1_555 ? 49 AC6 7 HOH W . ? HOH B 2112 . ? 1_555 ? 50 AC6 7 HOH W . ? HOH B 2297 . ? 1_555 ? 51 AC7 9 THR B 145 ? THR B 233 . ? 1_555 ? 52 AC7 9 GLY B 185 ? GLY B 273 . ? 1_555 ? 53 AC7 9 TRP B 186 ? TRP B 274 . ? 1_555 ? 54 AC7 9 TRP B 189 ? TRP B 277 . ? 1_555 ? 55 AC7 9 ASN B 192 ? ASN B 280 . ? 1_555 ? 56 AC7 9 GTM M . ? GTM B 452 . ? 1_555 ? 57 AC7 9 BGC O . ? BGC B 454 . ? 1_555 ? 58 AC7 9 HOH W . ? HOH B 2300 . ? 1_555 ? 59 AC7 9 HOH W . ? HOH B 2301 . ? 1_555 ? 60 AC8 12 ASN B 146 ? ASN B 234 . ? 1_555 ? 61 AC8 12 HIS B 183 ? HIS B 271 . ? 1_555 ? 62 AC8 12 GLY B 185 ? GLY B 273 . ? 1_555 ? 63 AC8 12 TRP B 186 ? TRP B 274 . ? 1_555 ? 64 AC8 12 ASN B 222 ? ASN B 310 . ? 1_555 ? 65 AC8 12 GLY B 281 ? GLY B 369 . ? 1_555 ? 66 AC8 12 TRP B 283 ? TRP B 371 . ? 1_555 ? 67 AC8 12 BGC N . ? BGC B 453 . ? 1_555 ? 68 AC8 12 GDA P . ? GDA B 455 . ? 1_555 ? 69 AC8 12 HOH W . ? HOH B 2229 . ? 1_555 ? 70 AC8 12 HOH W . ? HOH B 2301 . ? 1_555 ? 71 AC8 12 HOH W . ? HOH B 2302 . ? 1_555 ? 72 AC9 10 ASP B 51 ? ASP B 139 . ? 1_555 ? 73 AC9 10 ARG B 52 ? ARG B 140 . ? 1_555 ? 74 AC9 10 GLU B 315 ? GLU B 403 . ? 1_555 ? 75 AC9 10 GLY B 344 ? GLY B 432 . ? 1_555 ? 76 AC9 10 GTM Q . ? GTM B 456 . ? 1_555 ? 77 AC9 10 BGC S . ? BGC B 458 . ? 1_555 ? 78 AC9 10 FLG U . ? FLG B 460 . ? 1_555 ? 79 AC9 10 HOH W . ? HOH B 2308 . ? 1_555 ? 80 AC9 10 HOH W . ? HOH B 2309 . ? 1_555 ? 81 AC9 10 HOH W . ? HOH B 2310 . ? 1_555 ? 82 BC1 8 ARG B 52 ? ARG B 140 . ? 1_555 ? 83 BC1 8 LEU B 59 ? LEU B 147 . ? 1_555 ? 84 BC1 8 GLN B 345 ? GLN B 433 . ? 1_555 ? 85 BC1 8 BGC R . ? BGC B 457 . ? 1_555 ? 86 BC1 8 FLG U . ? FLG B 460 . ? 1_555 ? 87 BC1 8 HOH W . ? HOH B 2014 . ? 1_555 ? 88 BC1 8 HOH W . ? HOH B 2280 . ? 1_555 ? 89 BC1 8 HOH W . ? HOH B 2310 . ? 1_555 ? 90 BC2 5 TRP A 189 ? TRP A 277 . ? 1_555 ? 91 BC2 5 PRO A 237 ? PRO A 325 . ? 1_555 ? 92 BC2 5 BGC E . ? BGC A 453 . ? 1_555 ? 93 BC2 5 HOH V . ? HOH A 2393 . ? 1_555 ? 94 BC2 5 HOH V . ? HOH A 2394 . ? 1_555 ? 95 BC3 9 TRP A 49 ? TRP A 137 . ? 1_555 ? 96 BC3 9 ASP A 51 ? ASP A 139 . ? 1_555 ? 97 BC3 9 SER A 98 ? SER A 186 . ? 1_555 ? 98 BC3 9 LYS A 311 ? LYS A 399 . ? 1_555 ? 99 BC3 9 PRO A 312 ? PRO A 400 . ? 1_555 ? 100 BC3 9 GLU A 315 ? GLU A 403 . ? 1_555 ? 101 BC3 9 GLY A 344 ? GLY A 432 . ? 1_555 ? 102 BC3 9 BGC I . ? BGC A 457 . ? 1_555 ? 103 BC3 9 HOH V . ? HOH A 2347 . ? 1_555 ? 104 BC4 5 TRP B 189 ? TRP B 277 . ? 1_555 ? 105 BC4 5 ALA B 191 ? ALA B 279 . ? 1_555 ? 106 BC4 5 BGC N . ? BGC B 453 . ? 1_555 ? 107 BC4 5 HOH W . ? HOH B 2298 . ? 1_555 ? 108 BC4 5 HOH W . ? HOH B 2299 . ? 1_555 ? 109 BC5 9 TRP B 49 ? TRP B 137 . ? 1_555 ? 110 BC5 9 ASP B 51 ? ASP B 139 . ? 1_555 ? 111 BC5 9 SER B 98 ? SER B 186 . ? 1_555 ? 112 BC5 9 LYS B 311 ? LYS B 399 . ? 1_555 ? 113 BC5 9 PRO B 312 ? PRO B 400 . ? 1_555 ? 114 BC5 9 GLU B 315 ? GLU B 403 . ? 1_555 ? 115 BC5 9 GLY B 344 ? GLY B 432 . ? 1_555 ? 116 BC5 9 BGC R . ? BGC B 457 . ? 1_555 ? 117 BC5 9 HOH W . ? HOH B 2264 . ? 1_555 ? 118 BC6 12 ASP A 92 ? ASP A 180 . ? 1_555 ? 119 BC6 12 ASP A 138 ? ASP A 226 . ? 1_555 ? 120 BC6 12 HIS A 183 ? HIS A 271 . ? 1_555 ? 121 BC6 12 ASN A 222 ? ASN A 310 . ? 1_555 ? 122 BC6 12 TRP A 283 ? TRP A 371 . ? 1_555 ? 123 BC6 12 BGC F . ? BGC A 454 . ? 1_555 ? 124 BC6 12 HOH V . ? HOH A 2122 . ? 1_555 ? 125 BC6 12 HOH V . ? HOH A 2124 . ? 1_555 ? 126 BC6 12 HOH V . ? HOH A 2194 . ? 1_555 ? 127 BC6 12 HOH V . ? HOH A 2398 . ? 1_555 ? 128 BC6 12 HOH V . ? HOH A 2399 . ? 1_555 ? 129 BC6 12 HOH V . ? HOH A 2400 . ? 1_555 ? 130 BC7 12 ASP B 92 ? ASP B 180 . ? 1_555 ? 131 BC7 12 ASP B 138 ? ASP B 226 . ? 1_555 ? 132 BC7 12 HIS B 183 ? HIS B 271 . ? 1_555 ? 133 BC7 12 ASN B 222 ? ASN B 310 . ? 1_555 ? 134 BC7 12 TRP B 283 ? TRP B 371 . ? 1_555 ? 135 BC7 12 BGC O . ? BGC B 454 . ? 1_555 ? 136 BC7 12 HOH W . ? HOH B 2085 . ? 1_555 ? 137 BC7 12 HOH W . ? HOH B 2142 . ? 1_555 ? 138 BC7 12 HOH W . ? HOH B 2303 . ? 1_555 ? 139 BC7 12 HOH W . ? HOH B 2304 . ? 1_555 ? 140 BC7 12 HOH W . ? HOH B 2305 . ? 1_555 ? 141 BC7 12 HOH W . ? HOH B 2306 . ? 1_555 ? 142 BC8 11 ASN A 15 ? ASN A 103 . ? 1_555 ? 143 BC8 11 GLN A 62 ? GLN A 150 . ? 1_555 ? 144 BC8 11 GLU A 66 ? GLU A 154 . ? 1_555 ? 145 BC8 11 ASN B 15 ? ASN B 103 . ? 1_555 ? 146 BC8 11 TYR B 16 ? TYR B 104 . ? 1_555 ? 147 BC8 11 SER B 19 ? SER B 107 . ? 1_555 ? 148 BC8 11 GLU B 20 ? GLU B 108 . ? 1_555 ? 149 BC8 11 LEU B 59 ? LEU B 147 . ? 1_555 ? 150 BC8 11 GLN B 62 ? GLN B 150 . ? 1_555 ? 151 BC8 11 BGC R . ? BGC B 457 . ? 1_555 ? 152 BC8 11 BGC S . ? BGC B 458 . ? 1_555 ? 153 BC9 8 TRP A 12 ? TRP A 100 . ? 1_555 ? 154 BC9 8 ALA A 13 ? ALA A 101 . ? 1_555 ? 155 BC9 8 ARG A 18 ? ARG A 106 . ? 1_555 ? 156 BC9 8 HOH V . ? HOH A 2011 . ? 1_555 ? 157 BC9 8 HOH V . ? HOH A 2014 . ? 1_555 ? 158 BC9 8 HOH V . ? HOH A 2111 . ? 1_555 ? 159 BC9 8 HOH V . ? HOH A 2404 . ? 1_555 ? 160 BC9 8 HIS B 22 ? HIS B 110 . ? 1_555 ? 161 CC1 8 HIS A 22 ? HIS A 110 . ? 1_555 ? 162 CC1 8 HOH V . ? HOH A 2018 . ? 1_555 ? 163 CC1 8 LEU B 11 ? LEU B 99 . ? 1_555 ? 164 CC1 8 TRP B 12 ? TRP B 100 . ? 1_555 ? 165 CC1 8 ALA B 13 ? ALA B 101 . ? 1_555 ? 166 CC1 8 ARG B 18 ? ARG B 106 . ? 1_555 ? 167 CC1 8 TYR B 79 ? TYR B 167 . ? 1_555 ? 168 CC1 8 HOH W . ? HOH B 2010 . ? 1_555 ? # _database_PDB_matrix.entry_id 1OCB _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 1OCB _atom_sites.fract_transf_matrix[1][1] 0.020095 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.010874 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.006423 _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] 0.022200 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . ASN A 1 2 ? 13.366 5.705 -14.599 1.00 24.43 ? 90 ASN A N 1 ATOM 2 C CA . ASN A 1 2 ? 14.624 5.098 -14.014 1.00 23.45 ? 90 ASN A CA 1 ATOM 3 C C . ASN A 1 2 ? 15.077 5.697 -12.665 1.00 21.72 ? 90 ASN A C 1 ATOM 4 O O . ASN A 1 2 ? 15.892 5.111 -11.902 1.00 21.63 ? 90 ASN A O 1 ATOM 5 C CB . ASN A 1 2 ? 15.779 5.178 -15.011 1.00 23.99 ? 90 ASN A CB 1 ATOM 6 C CG . ASN A 1 2 ? 16.745 4.029 -14.844 1.00 26.90 ? 90 ASN A CG 1 ATOM 7 O OD1 . ASN A 1 2 ? 16.338 2.866 -14.914 1.00 28.69 ? 90 ASN A OD1 1 ATOM 8 N ND2 . ASN A 1 2 ? 18.028 4.340 -14.590 1.00 29.65 ? 90 ASN A ND2 1 ATOM 9 N N . GLY A 1 3 ? 14.522 6.864 -12.358 1.00 18.76 ? 91 GLY A N 1 ATOM 10 C CA . GLY A 1 3 ? 14.848 7.534 -11.125 1.00 15.71 ? 91 GLY A CA 1 ATOM 11 C C . GLY A 1 3 ? 14.206 6.912 -9.906 1.00 12.10 ? 91 GLY A C 1 ATOM 12 O O . GLY A 1 3 ? 13.025 6.558 -9.873 1.00 11.36 ? 91 GLY A O 1 ATOM 13 N N . ASN A 1 4 ? 14.980 6.843 -8.845 1.00 10.28 ? 92 ASN A N 1 ATOM 14 C CA . ASN A 1 4 ? 14.384 6.494 -7.556 1.00 7.84 ? 92 ASN A CA 1 ATOM 15 C C . ASN A 1 4 ? 13.556 7.719 -7.076 1.00 8.23 ? 92 ASN A C 1 ATOM 16 O O . ASN A 1 4 ? 14.129 8.794 -6.897 1.00 7.95 ? 92 ASN A O 1 ATOM 17 C CB . ASN A 1 4 ? 15.521 6.178 -6.611 1.00 8.10 ? 92 ASN A CB 1 ATOM 18 C CG . ASN A 1 4 ? 15.057 5.834 -5.206 1.00 8.36 ? 92 ASN A CG 1 ATOM 19 O OD1 . ASN A 1 4 ? 13.886 6.001 -4.873 1.00 8.36 ? 92 ASN A OD1 1 ATOM 20 N ND2 . ASN A 1 4 ? 15.974 5.349 -4.390 1.00 7.21 ? 92 ASN A ND2 1 ATOM 21 N N . PRO A 1 5 ? 12.239 7.590 -6.927 1.00 7.61 ? 93 PRO A N 1 ATOM 22 C CA . PRO A 1 5 ? 11.418 8.744 -6.529 1.00 8.48 ? 93 PRO A CA 1 ATOM 23 C C . PRO A 1 5 ? 11.703 9.226 -5.114 1.00 8.86 ? 93 PRO A C 1 ATOM 24 O O . PRO A 1 5 ? 11.243 10.291 -4.745 1.00 10.46 ? 93 PRO A O 1 ATOM 25 C CB . PRO A 1 5 ? 9.981 8.225 -6.628 1.00 9.48 ? 93 PRO A CB 1 ATOM 26 C CG . PRO A 1 5 ? 10.086 6.792 -6.446 1.00 10.20 ? 93 PRO A CG 1 ATOM 27 C CD . PRO A 1 5 ? 11.414 6.380 -7.132 1.00 8.37 ? 93 PRO A CD 1 ATOM 28 N N . PHE A 1 6 ? 12.364 8.421 -4.304 1.00 7.87 ? 94 PHE A N 1 ATOM 29 C CA . PHE A 1 6 ? 12.765 8.857 -2.966 1.00 7.22 ? 94 PHE A CA 1 ATOM 30 C C . PHE A 1 6 ? 14.083 9.617 -2.918 1.00 7.56 ? 94 PHE A C 1 ATOM 31 O O . PHE A 1 6 ? 14.441 10.146 -1.861 1.00 8.13 ? 94 PHE A O 1 ATOM 32 C CB . PHE A 1 6 ? 12.816 7.644 -2.009 1.00 6.26 ? 94 PHE A CB 1 ATOM 33 C CG . PHE A 1 6 ? 11.482 7.032 -1.760 1.00 6.06 ? 94 PHE A CG 1 ATOM 34 C CD1 . PHE A 1 6 ? 10.973 6.089 -2.604 1.00 7.87 ? 94 PHE A CD1 1 ATOM 35 C CD2 . PHE A 1 6 ? 10.723 7.417 -0.658 1.00 8.21 ? 94 PHE A CD2 1 ATOM 36 C CE1 . PHE A 1 6 ? 9.738 5.535 -2.378 1.00 6.78 ? 94 PHE A CE1 1 ATOM 37 C CE2 . PHE A 1 6 ? 9.526 6.856 -0.410 1.00 8.94 ? 94 PHE A CE2 1 ATOM 38 C CZ . PHE A 1 6 ? 9.008 5.930 -1.288 1.00 7.85 ? 94 PHE A CZ 1 ATOM 39 N N . GLU A 1 7 ? 14.815 9.662 -4.022 1.00 8.34 ? 95 GLU A N 1 ATOM 40 C CA . GLU A 1 7 ? 16.091 10.411 -4.096 1.00 9.47 ? 95 GLU A CA 1 ATOM 41 C C . GLU A 1 7 ? 15.813 11.859 -4.507 1.00 10.02 ? 95 GLU A C 1 ATOM 42 O O . GLU A 1 7 ? 14.930 12.117 -5.355 1.00 10.69 ? 95 GLU A O 1 ATOM 43 C CB . GLU A 1 7 ? 17.070 9.736 -5.068 1.00 11.21 ? 95 GLU A CB 1 ATOM 44 C CG . GLU A 1 7 ? 17.654 8.453 -4.513 1.00 14.09 ? 95 GLU A CG 1 ATOM 45 C CD . GLU A 1 7 ? 18.837 8.659 -3.572 1.00 22.10 ? 95 GLU A CD 1 ATOM 46 O OE1 . GLU A 1 7 ? 19.230 9.828 -3.349 1.00 28.68 ? 95 GLU A OE1 1 ATOM 47 O OE2 . GLU A 1 7 ? 19.379 7.635 -3.055 1.00 23.94 ? 95 GLU A OE2 1 ATOM 48 N N . GLY A 1 8 ? 16.505 12.800 -3.874 1.00 10.59 ? 96 GLY A N 1 ATOM 49 C CA . GLY A 1 8 ? 16.383 14.200 -4.230 1.00 11.34 ? 96 GLY A CA 1 ATOM 50 C C . GLY A 1 8 ? 15.204 14.955 -3.672 1.00 11.33 ? 96 GLY A C 1 ATOM 51 O O . GLY A 1 8 ? 14.954 16.086 -4.108 1.00 12.40 ? 96 GLY A O 1 ATOM 52 N N . VAL A 1 9 ? 14.490 14.335 -2.749 1.00 10.64 ? 97 VAL A N 1 ATOM 53 C CA . VAL A 1 9 ? 13.342 14.962 -2.106 1.00 10.11 ? 97 VAL A CA 1 ATOM 54 C C . VAL A 1 9 ? 13.398 14.690 -0.614 1.00 10.12 ? 97 VAL A C 1 ATOM 55 O O . VAL A 1 9 ? 14.081 13.764 -0.182 1.00 9.54 ? 97 VAL A O 1 ATOM 56 C CB . VAL A 1 9 ? 12.044 14.426 -2.679 1.00 10.32 ? 97 VAL A CB 1 ATOM 57 C CG1 . VAL A 1 9 ? 11.918 14.802 -4.171 1.00 13.22 ? 97 VAL A CG1 1 ATOM 58 C CG2 . VAL A 1 9 ? 11.937 12.961 -2.497 1.00 11.46 ? 97 VAL A CG2 1 ATOM 59 N N . GLN A 1 10 ? 12.652 15.488 0.155 1.00 9.43 ? 98 GLN A N 1 ATOM 60 C CA . GLN A 1 10 ? 12.371 15.229 1.546 1.00 9.74 ? 98 GLN A CA 1 ATOM 61 C C . GLN A 1 10 ? 10.953 14.666 1.537 1.00 8.91 ? 98 GLN A C 1 ATOM 62 O O . GLN A 1 10 ? 10.141 15.024 0.688 1.00 9.08 ? 98 GLN A O 1 ATOM 63 C CB . GLN A 1 10 ? 12.314 16.543 2.359 1.00 10.73 ? 98 GLN A CB 1 ATOM 64 C CG . GLN A 1 10 ? 13.474 17.421 2.313 1.00 13.76 ? 98 GLN A CG 1 ATOM 65 C CD . GLN A 1 10 ? 13.304 18.554 3.285 1.00 16.38 ? 98 GLN A CD 1 ATOM 66 O OE1 . GLN A 1 10 ? 13.216 18.327 4.523 1.00 18.24 ? 98 GLN A OE1 1 ATOM 67 N NE2 . GLN A 1 10 ? 13.280 19.756 2.771 1.00 14.72 ? 98 GLN A NE2 1 ATOM 68 N N . LEU A 1 11 ? 10.651 13.807 2.485 1.00 8.67 ? 99 LEU A N 1 ATOM 69 C CA . LEU A 1 11 ? 9.308 13.280 2.616 1.00 7.19 ? 99 LEU A CA 1 ATOM 70 C C . LEU A 1 11 ? 8.464 14.132 3.530 1.00 6.75 ? 99 LEU A C 1 ATOM 71 O O . LEU A 1 11 ? 8.809 14.331 4.697 1.00 8.45 ? 99 LEU A O 1 ATOM 72 C CB . LEU A 1 11 ? 9.415 11.853 3.086 1.00 7.59 ? 99 LEU A CB 1 ATOM 73 C CG . LEU A 1 11 ? 10.147 10.871 2.132 1.00 8.16 ? 99 LEU A CG 1 ATOM 74 C CD1 . LEU A 1 11 ? 10.204 9.507 2.770 1.00 10.43 ? 99 LEU A CD1 1 ATOM 75 C CD2 . LEU A 1 11 ? 9.519 10.808 0.761 1.00 11.92 ? 99 LEU A CD2 1 ATOM 76 N N . TRP A 1 12 ? 7.305 14.552 3.036 1.00 7.41 ? 100 TRP A N 1 ATOM 77 C CA . TRP A 1 12 ? 6.360 15.354 3.835 1.00 7.67 ? 100 TRP A CA 1 ATOM 78 C C . TRP A 1 12 ? 5.739 14.495 4.923 1.00 8.31 ? 100 TRP A C 1 ATOM 79 O O . TRP A 1 12 ? 5.165 13.458 4.645 1.00 6.92 ? 100 TRP A O 1 ATOM 80 C CB . TRP A 1 12 ? 5.241 15.868 2.941 1.00 7.32 ? 100 TRP A CB 1 ATOM 81 C CG . TRP A 1 12 ? 4.263 16.765 3.626 1.00 5.75 ? 100 TRP A CG 1 ATOM 82 C CD1 . TRP A 1 12 ? 2.985 16.422 4.001 1.00 9.09 ? 100 TRP A CD1 1 ATOM 83 C CD2 . TRP A 1 12 ? 4.392 18.147 3.855 1.00 4.63 ? 100 TRP A CD2 1 ATOM 84 N NE1 . TRP A 1 12 ? 2.342 17.520 4.541 1.00 6.80 ? 100 TRP A NE1 1 ATOM 85 C CE2 . TRP A 1 12 ? 3.172 18.601 4.434 1.00 9.23 ? 100 TRP A CE2 1 ATOM 86 C CE3 . TRP A 1 12 ? 5.403 19.091 3.621 1.00 6.89 ? 100 TRP A CE3 1 ATOM 87 C CZ2 . TRP A 1 12 ? 2.977 19.924 4.833 1.00 7.21 ? 100 TRP A CZ2 1 ATOM 88 C CZ3 . TRP A 1 12 ? 5.197 20.399 3.978 1.00 6.65 ? 100 TRP A CZ3 1 ATOM 89 C CH2 . TRP A 1 12 ? 3.979 20.811 4.602 1.00 6.48 ? 100 TRP A CH2 1 ATOM 90 N N . ALA A 1 13 ? 5.795 14.979 6.165 1.00 8.80 ? 101 ALA A N 1 ATOM 91 C CA . ALA A 1 13 ? 5.058 14.373 7.256 1.00 8.42 ? 101 ALA A CA 1 ATOM 92 C C . ALA A 1 13 ? 3.662 15.004 7.341 1.00 8.49 ? 101 ALA A C 1 ATOM 93 O O . ALA A 1 13 ? 3.511 16.237 7.458 1.00 8.63 ? 101 ALA A O 1 ATOM 94 C CB . ALA A 1 13 ? 5.789 14.566 8.552 1.00 8.20 ? 101 ALA A CB 1 ATOM 95 N N . ASN A 1 14 ? 2.646 14.199 7.153 1.00 7.25 ? 102 ASN A N 1 ATOM 96 C CA . ASN A 1 14 ? 1.330 14.776 7.032 1.00 7.25 ? 102 ASN A CA 1 ATOM 97 C C . ASN A 1 14 ? 0.753 15.206 8.372 1.00 6.74 ? 102 ASN A C 1 ATOM 98 O O . ASN A 1 14 ? 1.152 14.736 9.454 1.00 7.61 ? 102 ASN A O 1 ATOM 99 C CB . ASN A 1 14 ? 0.387 13.827 6.268 1.00 8.08 ? 102 ASN A CB 1 ATOM 100 C CG . ASN A 1 14 ? 0.006 12.584 7.077 1.00 9.27 ? 102 ASN A CG 1 ATOM 101 O OD1 . ASN A 1 14 ? -0.808 12.655 8.006 1.00 7.44 ? 102 ASN A OD1 1 ATOM 102 N ND2 . ASN A 1 14 ? 0.620 11.449 6.749 1.00 7.21 ? 102 ASN A ND2 1 ATOM 103 N N . ASN A 1 15 ? -0.212 16.120 8.319 1.00 6.48 ? 103 ASN A N 1 ATOM 104 C CA . ASN A 1 15 ? -0.720 16.682 9.562 1.00 6.74 ? 103 ASN A CA 1 ATOM 105 C C . ASN A 1 15 ? -1.772 15.801 10.254 1.00 6.60 ? 103 ASN A C 1 ATOM 106 O O . ASN A 1 15 ? -2.214 16.116 11.352 1.00 7.16 ? 103 ASN A O 1 ATOM 107 C CB . ASN A 1 15 ? -1.299 18.052 9.298 1.00 6.31 ? 103 ASN A CB 1 ATOM 108 C CG . ASN A 1 15 ? -1.490 18.849 10.542 1.00 8.21 ? 103 ASN A CG 1 ATOM 109 O OD1 . ASN A 1 15 ? -0.571 18.971 11.340 1.00 6.01 ? 103 ASN A OD1 1 ATOM 110 N ND2 . ASN A 1 15 ? -2.684 19.360 10.735 1.00 5.36 ? 103 ASN A ND2 1 ATOM 111 N N . TYR A 1 16 ? -2.203 14.735 9.595 1.00 6.79 ? 104 TYR A N 1 ATOM 112 C CA . TYR A 1 16 ? -3.278 13.870 10.135 1.00 7.17 ? 104 TYR A CA 1 ATOM 113 C C . TYR A 1 16 ? -2.711 12.983 11.211 1.00 6.49 ? 104 TYR A C 1 ATOM 114 O O . TYR A 1 16 ? -3.271 12.943 12.294 1.00 6.38 ? 104 TYR A O 1 ATOM 115 C CB . TYR A 1 16 ? -4.002 13.103 9.036 1.00 7.16 ? 104 TYR A CB 1 ATOM 116 C CG . TYR A 1 16 ? -4.260 14.076 7.927 1.00 9.79 ? 104 TYR A CG 1 ATOM 117 C CD1 . TYR A 1 16 ? -5.004 15.195 8.137 1.00 15.82 ? 104 TYR A CD1 1 ATOM 118 C CD2 . TYR A 1 16 ? -3.598 13.925 6.679 1.00 13.00 ? 104 TYR A CD2 1 ATOM 119 C CE1 . TYR A 1 16 ? -5.182 16.132 7.113 1.00 21.49 ? 104 TYR A CE1 1 ATOM 120 C CE2 . TYR A 1 16 ? -3.782 14.846 5.706 1.00 15.18 ? 104 TYR A CE2 1 ATOM 121 C CZ . TYR A 1 16 ? -4.533 15.927 5.923 1.00 18.19 ? 104 TYR A CZ 1 ATOM 122 O OH . TYR A 1 16 ? -4.600 16.812 4.856 1.00 26.82 ? 104 TYR A OH 1 ATOM 123 N N . TYR A 1 17 ? -1.559 12.368 10.940 1.00 6.10 ? 105 TYR A N 1 ATOM 124 C CA . TYR A 1 17 ? -0.878 11.590 11.943 1.00 6.65 ? 105 TYR A CA 1 ATOM 125 C C . TYR A 1 17 ? -0.404 12.517 13.087 1.00 7.08 ? 105 TYR A C 1 ATOM 126 O O . TYR A 1 17 ? -0.578 12.201 14.249 1.00 6.88 ? 105 TYR A O 1 ATOM 127 C CB . TYR A 1 17 ? 0.306 10.839 11.345 1.00 7.61 ? 105 TYR A CB 1 ATOM 128 C CG . TYR A 1 17 ? 0.976 9.900 12.292 1.00 6.66 ? 105 TYR A CG 1 ATOM 129 C CD1 . TYR A 1 17 ? 0.383 8.688 12.621 1.00 7.25 ? 105 TYR A CD1 1 ATOM 130 C CD2 . TYR A 1 17 ? 2.184 10.228 12.941 1.00 8.65 ? 105 TYR A CD2 1 ATOM 131 C CE1 . TYR A 1 17 ? 0.986 7.799 13.509 1.00 7.01 ? 105 TYR A CE1 1 ATOM 132 C CE2 . TYR A 1 17 ? 2.805 9.352 13.828 1.00 9.56 ? 105 TYR A CE2 1 ATOM 133 C CZ . TYR A 1 17 ? 2.210 8.121 14.108 1.00 8.75 ? 105 TYR A CZ 1 ATOM 134 O OH . TYR A 1 17 ? 2.783 7.223 15.006 1.00 8.35 ? 105 TYR A OH 1 ATOM 135 N N . ARG A 1 18 ? 0.169 13.665 12.729 1.00 6.47 ? 106 ARG A N 1 ATOM 136 C CA . ARG A 1 18 ? 0.552 14.654 13.737 1.00 5.98 ? 106 ARG A CA 1 ATOM 137 C C . ARG A 1 18 ? -0.589 15.024 14.636 1.00 5.90 ? 106 ARG A C 1 ATOM 138 O O . ARG A 1 18 ? -0.452 15.056 15.844 1.00 5.82 ? 106 ARG A O 1 ATOM 139 C CB . ARG A 1 18 ? 1.108 15.918 13.063 1.00 6.60 ? 106 ARG A CB 1 ATOM 140 C CG . ARG A 1 18 ? 1.663 16.919 14.082 1.00 6.30 ? 106 ARG A CG 1 ATOM 141 C CD . ARG A 1 18 ? 2.126 18.223 13.483 1.00 7.08 ? 106 ARG A CD 1 ATOM 142 N NE . ARG A 1 18 ? 3.233 17.938 12.580 1.00 6.09 ? 106 ARG A NE 1 ATOM 143 C CZ . ARG A 1 18 ? 3.198 18.001 11.249 1.00 8.90 ? 106 ARG A CZ 1 ATOM 144 N NH1 . ARG A 1 18 ? 2.130 18.385 10.596 1.00 7.51 ? 106 ARG A NH1 1 ATOM 145 N NH2 . ARG A 1 18 ? 4.285 17.679 10.574 1.00 11.67 ? 106 ARG A NH2 1 ATOM 146 N N . SER A 1 19 ? -1.749 15.269 14.045 1.00 5.87 ? 107 SER A N 1 ATOM 147 C CA . SER A 1 19 ? -2.914 15.645 14.827 1.00 6.71 ? 107 SER A CA 1 ATOM 148 C C . SER A 1 19 ? -3.381 14.523 15.768 1.00 6.34 ? 107 SER A C 1 ATOM 149 O O . SER A 1 19 ? -3.822 14.805 16.885 1.00 7.57 ? 107 SER A O 1 ATOM 150 C CB . SER A 1 19 ? -4.046 16.148 13.903 1.00 7.60 ? 107 SER A CB 1 ATOM 151 O OG . SER A 1 19 ? -3.678 17.319 13.193 1.00 6.90 ? 107 SER A OG 1 ATOM 152 N N . GLU A 1 20 ? -3.339 13.264 15.323 1.00 7.49 ? 108 GLU A N 1 ATOM 153 C CA . GLU A 1 20 ? -3.683 12.144 16.180 1.00 6.93 ? 108 GLU A CA 1 ATOM 154 C C . GLU A 1 20 ? -2.776 12.111 17.394 1.00 6.52 ? 108 GLU A C 1 ATOM 155 O O . GLU A 1 20 ? -3.215 12.026 18.566 1.00 5.55 ? 108 GLU A O 1 ATOM 156 C CB . GLU A 1 20 ? -3.565 10.817 15.434 1.00 8.43 ? 108 GLU A CB 1 ATOM 157 C CG . GLU A 1 20 ? -4.644 10.637 14.380 1.00 12.35 ? 108 GLU A CG 1 ATOM 158 C CD . GLU A 1 20 ? -4.439 9.350 13.595 1.00 12.21 ? 108 GLU A CD 1 ATOM 159 O OE1 . GLU A 1 20 ? -3.297 9.070 13.161 1.00 12.81 ? 108 GLU A OE1 1 ATOM 160 O OE2 . GLU A 1 20 ? -5.425 8.576 13.470 1.00 17.49 ? 108 GLU A OE2 1 ATOM 161 N N . VAL A 1 21 ? -1.466 12.194 17.134 1.00 6.23 ? 109 VAL A N 1 ATOM 162 C CA . VAL A 1 21 ? -0.534 12.111 18.248 1.00 5.81 ? 109 VAL A CA 1 ATOM 163 C C . VAL A 1 21 ? -0.709 13.275 19.234 1.00 4.95 ? 109 VAL A C 1 ATOM 164 O O . VAL A 1 21 ? -0.763 13.088 20.452 1.00 6.27 ? 109 VAL A O 1 ATOM 165 C CB . VAL A 1 21 ? 0.891 12.093 17.722 1.00 6.00 ? 109 VAL A CB 1 ATOM 166 C CG1 . VAL A 1 21 ? 1.891 12.226 18.862 1.00 7.00 ? 109 VAL A CG1 1 ATOM 167 C CG2 . VAL A 1 21 ? 1.161 10.872 16.889 1.00 7.79 ? 109 VAL A CG2 1 ATOM 168 N N . HIS A 1 22 ? -0.830 14.494 18.732 1.00 4.66 ? 110 HIS A N 1 ATOM 169 C CA . HIS A 1 22 ? -0.936 15.664 19.583 1.00 4.36 ? 110 HIS A CA 1 ATOM 170 C C . HIS A 1 22 ? -2.278 15.887 20.254 1.00 5.59 ? 110 HIS A C 1 ATOM 171 O O . HIS A 1 22 ? -2.324 16.398 21.376 1.00 6.16 ? 110 HIS A O 1 ATOM 172 C CB . HIS A 1 22 ? -0.496 16.906 18.808 1.00 5.37 ? 110 HIS A CB 1 ATOM 173 C CG . HIS A 1 22 ? 0.989 17.056 18.710 1.00 4.73 ? 110 HIS A CG 1 ATOM 174 N ND1 . HIS A 1 22 ? 1.721 17.609 19.738 1.00 4.59 ? 110 HIS A ND1 1 ATOM 175 C CD2 . HIS A 1 22 ? 1.872 16.744 17.734 1.00 8.54 ? 110 HIS A CD2 1 ATOM 176 C CE1 . HIS A 1 22 ? 3.002 17.600 19.402 1.00 7.44 ? 110 HIS A CE1 1 ATOM 177 N NE2 . HIS A 1 22 ? 3.118 17.087 18.188 1.00 5.54 ? 110 HIS A NE2 1 ATOM 178 N N . THR A 1 23 ? -3.369 15.506 19.621 1.00 5.44 ? 111 THR A N 1 ATOM 179 C CA . THR A 1 23 ? -4.686 15.749 20.233 1.00 5.82 ? 111 THR A CA 1 ATOM 180 C C . THR A 1 23 ? -5.203 14.554 21.007 1.00 5.97 ? 111 THR A C 1 ATOM 181 O O . THR A 1 23 ? -6.076 14.721 21.863 1.00 6.00 ? 111 THR A O 1 ATOM 182 C CB . THR A 1 23 ? -5.753 16.184 19.204 1.00 5.08 ? 111 THR A CB 1 ATOM 183 O OG1 . THR A 1 23 ? -6.032 15.091 18.325 1.00 7.64 ? 111 THR A OG1 1 ATOM 184 C CG2 . THR A 1 23 ? -5.322 17.342 18.360 1.00 7.49 ? 111 THR A CG2 1 ATOM 185 N N . LEU A 1 24 ? -4.737 13.354 20.693 1.00 5.97 ? 112 LEU A N 1 ATOM 186 C CA . LEU A 1 24 ? -5.253 12.124 21.308 1.00 7.43 ? 112 LEU A CA 1 ATOM 187 C C . LEU A 1 24 ? -4.234 11.463 22.198 1.00 7.66 ? 112 LEU A C 1 ATOM 188 O O . LEU A 1 24 ? -4.555 11.151 23.349 1.00 8.64 ? 112 LEU A O 1 ATOM 189 C CB . LEU A 1 24 ? -5.676 11.095 20.268 1.00 8.03 ? 112 LEU A CB 1 ATOM 190 C CG . LEU A 1 24 ? -6.726 11.571 19.279 1.00 12.76 ? 112 LEU A CG 1 ATOM 191 C CD1 . LEU A 1 24 ? -6.987 10.520 18.167 1.00 15.07 ? 112 LEU A CD1 1 ATOM 192 C CD2 . LEU A 1 24 ? -7.975 11.932 20.047 1.00 15.53 ? 112 LEU A CD2 1 ATOM 193 N N . ALA A 1 25 ? -3.011 11.294 21.705 1.00 7.45 ? 113 ALA A N 1 ATOM 194 C CA . ALA A 1 25 ? -2.001 10.523 22.436 1.00 6.76 ? 113 ALA A CA 1 ATOM 195 C C . ALA A 1 25 ? -1.316 11.307 23.555 1.00 6.87 ? 113 ALA A C 1 ATOM 196 O O . ALA A 1 25 ? -1.363 10.897 24.751 1.00 7.34 ? 113 ALA A O 1 ATOM 197 C CB . ALA A 1 25 ? -0.927 9.946 21.484 1.00 7.75 ? 113 ALA A CB 1 ATOM 198 N N . ILE A 1 26 ? -0.663 12.417 23.209 1.00 5.86 ? 114 ILE A N 1 ATOM 199 C CA . ILE A 1 26 ? 0.064 13.201 24.165 1.00 5.60 ? 114 ILE A CA 1 ATOM 200 C C . ILE A 1 26 ? -0.725 13.643 25.414 1.00 6.13 ? 114 ILE A C 1 ATOM 201 O O . ILE A 1 26 ? -0.210 13.528 26.518 1.00 5.87 ? 114 ILE A O 1 ATOM 202 C CB . ILE A 1 26 ? 0.876 14.387 23.484 1.00 6.15 ? 114 ILE A CB 1 ATOM 203 C CG1 . ILE A 1 26 ? 2.082 13.793 22.699 1.00 6.62 ? 114 ILE A CG1 1 ATOM 204 C CG2 . ILE A 1 26 ? 1.357 15.375 24.482 1.00 8.32 ? 114 ILE A CG2 1 ATOM 205 C CD1 . ILE A 1 26 ? 2.706 14.715 21.728 1.00 5.86 ? 114 ILE A CD1 1 ATOM 206 N N . PRO A 1 27 ? -1.946 14.137 25.276 1.00 6.26 ? 115 PRO A N 1 ATOM 207 C CA . PRO A 1 27 ? -2.734 14.475 26.465 1.00 7.54 ? 115 PRO A CA 1 ATOM 208 C C . PRO A 1 27 ? -2.949 13.280 27.400 1.00 7.93 ? 115 PRO A C 1 ATOM 209 O O . PRO A 1 27 ? -3.266 13.539 28.579 1.00 8.89 ? 115 PRO A O 1 ATOM 210 C CB . PRO A 1 27 ? -4.070 14.934 25.866 1.00 8.67 ? 115 PRO A CB 1 ATOM 211 C CG . PRO A 1 27 ? -3.699 15.408 24.511 1.00 7.79 ? 115 PRO A CG 1 ATOM 212 C CD . PRO A 1 27 ? -2.661 14.468 24.030 1.00 6.61 ? 115 PRO A CD 1 ATOM 213 N N . GLN A 1 28 ? -2.840 12.048 26.905 1.00 8.29 ? 116 GLN A N 1 ATOM 214 C CA . GLN A 1 28 ? -2.945 10.861 27.750 1.00 10.67 ? 116 GLN A CA 1 ATOM 215 C C . GLN A 1 28 ? -1.623 10.290 28.242 1.00 12.60 ? 116 GLN A C 1 ATOM 216 O O . GLN A 1 28 ? -1.625 9.301 28.998 1.00 13.56 ? 116 GLN A O 1 ATOM 217 C CB . GLN A 1 28 ? -3.655 9.755 27.000 1.00 11.47 ? 116 GLN A CB 1 ATOM 218 C CG A GLN A 1 28 ? -5.040 9.964 26.537 0.60 13.61 ? 116 GLN A CG 1 ATOM 219 C CG B GLN A 1 28 ? -5.074 10.192 26.694 0.40 12.70 ? 116 GLN A CG 1 ATOM 220 C CD A GLN A 1 28 ? -5.548 8.698 25.853 0.60 14.27 ? 116 GLN A CD 1 ATOM 221 C CD B GLN A 1 28 ? -5.991 9.068 26.302 0.40 13.70 ? 116 GLN A CD 1 ATOM 222 O OE1 A GLN A 1 28 ? -5.517 8.582 24.632 0.60 14.09 ? 116 GLN A OE1 1 ATOM 223 O OE1 B GLN A 1 28 ? -6.964 9.291 25.590 0.40 12.14 ? 116 GLN A OE1 1 ATOM 224 N NE2 A GLN A 1 28 ? -5.970 7.737 26.650 0.60 14.26 ? 116 GLN A NE2 1 ATOM 225 N NE2 B GLN A 1 28 ? -5.695 7.864 26.768 0.40 12.14 ? 116 GLN A NE2 1 ATOM 226 N N . ILE A 1 29 ? -0.505 10.892 27.853 1.00 10.88 ? 117 ILE A N 1 ATOM 227 C CA . ILE A 1 29 ? 0.836 10.390 28.206 1.00 12.63 ? 117 ILE A CA 1 ATOM 228 C C . ILE A 1 29 ? 1.461 11.485 29.064 1.00 13.60 ? 117 ILE A C 1 ATOM 229 O O . ILE A 1 29 ? 1.901 12.481 28.506 1.00 16.39 ? 117 ILE A O 1 ATOM 230 C CB . ILE A 1 29 ? 1.692 10.179 26.927 1.00 12.07 ? 117 ILE A CB 1 ATOM 231 C CG1 . ILE A 1 29 ? 1.112 9.091 26.018 1.00 13.96 ? 117 ILE A CG1 1 ATOM 232 C CG2 . ILE A 1 29 ? 3.138 9.879 27.311 1.00 11.70 ? 117 ILE A CG2 1 ATOM 233 C CD1 . ILE A 1 29 ? 1.647 9.096 24.617 1.00 15.29 ? 117 ILE A CD1 1 ATOM 234 N N . THR A 1 30 ? 1.548 11.252 30.368 1.00 14.53 ? 118 THR A N 1 ATOM 235 C CA . THR A 1 30 ? 2.142 12.178 31.338 1.00 15.85 ? 118 THR A CA 1 ATOM 236 C C . THR A 1 30 ? 3.644 12.011 31.437 1.00 14.00 ? 118 THR A C 1 ATOM 237 O O . THR A 1 30 ? 4.372 12.956 31.786 1.00 14.44 ? 118 THR A O 1 ATOM 238 C CB . THR A 1 30 ? 1.599 11.934 32.806 1.00 16.50 ? 118 THR A CB 1 ATOM 239 O OG1 . THR A 1 30 ? 1.249 10.567 33.042 1.00 20.18 ? 118 THR A OG1 1 ATOM 240 C CG2 . THR A 1 30 ? 0.301 12.673 33.010 1.00 22.03 ? 118 THR A CG2 1 ATOM 241 N N . ASP A 1 31 ? 4.092 10.789 31.201 1.00 11.47 ? 119 ASP A N 1 ATOM 242 C CA . ASP A 1 31 ? 5.475 10.473 31.378 1.00 10.58 ? 119 ASP A CA 1 ATOM 243 C C . ASP A 1 31 ? 6.331 11.393 30.505 1.00 9.35 ? 119 ASP A C 1 ATOM 244 O O . ASP A 1 31 ? 6.149 11.394 29.301 1.00 8.80 ? 119 ASP A O 1 ATOM 245 C CB . ASP A 1 31 ? 5.715 9.030 30.975 1.00 10.65 ? 119 ASP A CB 1 ATOM 246 C CG . ASP A 1 31 ? 7.162 8.682 31.068 1.00 10.15 ? 119 ASP A CG 1 ATOM 247 O OD1 . ASP A 1 31 ? 7.651 8.696 32.214 1.00 10.12 ? 119 ASP A OD1 1 ATOM 248 O OD2 . ASP A 1 31 ? 7.841 8.432 30.043 1.00 10.45 ? 119 ASP A OD2 1 ATOM 249 N N . PRO A 1 32 ? 7.295 12.126 31.084 1.00 8.11 ? 120 PRO A N 1 ATOM 250 C CA . PRO A 1 32 ? 8.102 13.075 30.305 1.00 7.98 ? 120 PRO A CA 1 ATOM 251 C C . PRO A 1 32 ? 8.852 12.510 29.117 1.00 8.49 ? 120 PRO A C 1 ATOM 252 O O . PRO A 1 32 ? 8.838 13.083 28.036 1.00 7.84 ? 120 PRO A O 1 ATOM 253 C CB . PRO A 1 32 ? 9.061 13.635 31.355 1.00 9.25 ? 120 PRO A CB 1 ATOM 254 C CG . PRO A 1 32 ? 8.324 13.554 32.549 1.00 8.12 ? 120 PRO A CG 1 ATOM 255 C CD . PRO A 1 32 ? 7.579 12.257 32.520 1.00 9.35 ? 120 PRO A CD 1 ATOM 256 N N . ALA A 1 33 ? 9.474 11.352 29.266 1.00 8.07 ? 121 ALA A N 1 ATOM 257 C CA . ALA A 1 33 ? 10.225 10.797 28.130 1.00 7.29 ? 121 ALA A CA 1 ATOM 258 C C . ALA A 1 33 ? 9.349 10.283 27.008 1.00 7.17 ? 121 ALA A C 1 ATOM 259 O O . ALA A 1 33 ? 9.681 10.481 25.846 1.00 7.07 ? 121 ALA A O 1 ATOM 260 C CB . ALA A 1 33 ? 11.167 9.701 28.637 1.00 9.05 ? 121 ALA A CB 1 ATOM 261 N N . LEU A 1 34 ? 8.228 9.630 27.352 1.00 6.36 ? 122 LEU A N 1 ATOM 262 C CA . LEU A 1 34 ? 7.287 9.143 26.375 1.00 6.19 ? 122 LEU A CA 1 ATOM 263 C C . LEU A 1 34 ? 6.627 10.316 25.683 1.00 5.49 ? 122 LEU A C 1 ATOM 264 O O . LEU A 1 34 ? 6.375 10.233 24.492 1.00 6.14 ? 122 LEU A O 1 ATOM 265 C CB . LEU A 1 34 ? 6.256 8.179 26.980 1.00 6.74 ? 122 LEU A CB 1 ATOM 266 C CG . LEU A 1 34 ? 6.833 6.803 27.344 1.00 7.83 ? 122 LEU A CG 1 ATOM 267 C CD1 . LEU A 1 34 ? 5.857 5.981 28.153 1.00 11.78 ? 122 LEU A CD1 1 ATOM 268 C CD2 . LEU A 1 34 ? 7.236 6.067 26.065 1.00 10.06 ? 122 LEU A CD2 1 ATOM 269 N N . ARG A 1 35 ? 6.361 11.386 26.427 1.00 5.74 ? 123 ARG A N 1 ATOM 270 C CA . ARG A 1 35 ? 5.721 12.578 25.808 1.00 6.71 ? 123 ARG A CA 1 ATOM 271 C C . ARG A 1 35 ? 6.645 13.198 24.766 1.00 7.49 ? 123 ARG A C 1 ATOM 272 O O . ARG A 1 35 ? 6.217 13.479 23.644 1.00 5.95 ? 123 ARG A O 1 ATOM 273 C CB . ARG A 1 35 ? 5.356 13.564 26.873 1.00 8.45 ? 123 ARG A CB 1 ATOM 274 C CG . ARG A 1 35 ? 5.009 14.905 26.379 1.00 13.04 ? 123 ARG A CG 1 ATOM 275 C CD . ARG A 1 35 ? 4.434 15.782 27.477 1.00 17.56 ? 123 ARG A CD 1 ATOM 276 N NE . ARG A 1 35 ? 3.110 15.282 27.808 1.00 16.43 ? 123 ARG A NE 1 ATOM 277 C CZ . ARG A 1 35 ? 2.098 16.021 28.214 1.00 18.87 ? 123 ARG A CZ 1 ATOM 278 N NH1 . ARG A 1 35 ? 2.266 17.327 28.428 1.00 18.88 ? 123 ARG A NH1 1 ATOM 279 N NH2 . ARG A 1 35 ? 0.924 15.440 28.448 1.00 13.24 ? 123 ARG A NH2 1 ATOM 280 N N . ALA A 1 36 ? 7.928 13.306 25.098 1.00 6.11 ? 124 ALA A N 1 ATOM 281 C CA . ALA A 1 36 ? 8.913 13.854 24.160 1.00 6.52 ? 124 ALA A CA 1 ATOM 282 C C . ALA A 1 36 ? 9.117 12.954 22.960 1.00 6.71 ? 124 ALA A C 1 ATOM 283 O O . ALA A 1 36 ? 9.205 13.439 21.795 1.00 6.24 ? 124 ALA A O 1 ATOM 284 C CB . ALA A 1 36 ? 10.220 14.106 24.849 1.00 6.78 ? 124 ALA A CB 1 ATOM 285 N N . ALA A 1 37 ? 9.086 11.640 23.196 1.00 6.65 ? 125 ALA A N 1 ATOM 286 C CA . ALA A 1 37 ? 9.215 10.661 22.131 1.00 6.78 ? 125 ALA A CA 1 ATOM 287 C C . ALA A 1 37 ? 8.020 10.701 21.186 1.00 6.63 ? 125 ALA A C 1 ATOM 288 O O . ALA A 1 37 ? 8.180 10.623 19.987 1.00 7.55 ? 125 ALA A O 1 ATOM 289 C CB . ALA A 1 37 ? 9.411 9.263 22.705 1.00 8.03 ? 125 ALA A CB 1 ATOM 290 N N . ALA A 1 38 ? 6.833 10.890 21.754 1.00 5.86 ? 126 ALA A N 1 ATOM 291 C CA . ALA A 1 38 ? 5.614 10.940 20.971 1.00 6.22 ? 126 ALA A CA 1 ATOM 292 C C . ALA A 1 38 ? 5.674 12.171 20.061 1.00 6.57 ? 126 ALA A C 1 ATOM 293 O O . ALA A 1 38 ? 5.248 12.119 18.884 1.00 7.15 ? 126 ALA A O 1 ATOM 294 C CB . ALA A 1 38 ? 4.454 11.018 21.878 1.00 6.74 ? 126 ALA A CB 1 ATOM 295 N N . SER A 1 39 ? 6.163 13.288 20.594 1.00 6.35 ? 127 SER A N 1 ATOM 296 C CA . SER A 1 39 ? 6.265 14.498 19.771 1.00 7.98 ? 127 SER A CA 1 ATOM 297 C C . SER A 1 39 ? 7.257 14.277 18.599 1.00 7.87 ? 127 SER A C 1 ATOM 298 O O . SER A 1 39 ? 7.035 14.750 17.481 1.00 7.14 ? 127 SER A O 1 ATOM 299 C CB . SER A 1 39 ? 6.623 15.688 20.646 1.00 8.67 ? 127 SER A CB 1 ATOM 300 O OG . SER A 1 39 ? 6.850 16.814 19.858 1.00 14.34 ? 127 SER A OG 1 ATOM 301 N N . ALA A 1 40 ? 8.336 13.553 18.849 1.00 7.11 ? 128 ALA A N 1 ATOM 302 C CA . ALA A 1 40 ? 9.297 13.266 17.780 1.00 7.44 ? 128 ALA A CA 1 ATOM 303 C C . ALA A 1 40 ? 8.751 12.309 16.736 1.00 7.73 ? 128 ALA A C 1 ATOM 304 O O . ALA A 1 40 ? 8.963 12.517 15.539 1.00 7.66 ? 128 ALA A O 1 ATOM 305 C CB . ALA A 1 40 ? 10.550 12.722 18.362 1.00 8.73 ? 128 ALA A CB 1 ATOM 306 N N . VAL A 1 41 ? 8.031 11.259 17.126 1.00 6.46 ? 129 VAL A N 1 ATOM 307 C CA . VAL A 1 41 ? 7.521 10.319 16.130 1.00 7.40 ? 129 VAL A CA 1 ATOM 308 C C . VAL A 1 41 ? 6.421 10.924 15.252 1.00 7.72 ? 129 VAL A C 1 ATOM 309 O O . VAL A 1 41 ? 6.236 10.519 14.127 1.00 8.13 ? 129 VAL A O 1 ATOM 310 C CB . VAL A 1 41 ? 7.054 8.984 16.764 1.00 7.95 ? 129 VAL A CB 1 ATOM 311 C CG1 . VAL A 1 41 ? 5.749 9.152 17.483 1.00 8.78 ? 129 VAL A CG1 1 ATOM 312 C CG2 . VAL A 1 41 ? 6.957 7.879 15.692 1.00 10.05 ? 129 VAL A CG2 1 ATOM 313 N N . ALA A 1 42 ? 5.759 11.951 15.767 1.00 6.78 ? 130 ALA A N 1 ATOM 314 C CA . ALA A 1 42 ? 4.724 12.667 15.040 1.00 8.16 ? 130 ALA A CA 1 ATOM 315 C C . ALA A 1 42 ? 5.296 13.272 13.770 1.00 8.74 ? 130 ALA A C 1 ATOM 316 O O . ALA A 1 42 ? 4.540 13.547 12.839 1.00 9.68 ? 130 ALA A O 1 ATOM 317 C CB . ALA A 1 42 ? 4.110 13.734 15.911 1.00 6.95 ? 130 ALA A CB 1 ATOM 318 N N . GLU A 1 43 ? 6.591 13.561 13.767 1.00 7.68 ? 131 GLU A N 1 ATOM 319 C CA . GLU A 1 43 ? 7.305 14.142 12.625 1.00 8.65 ? 131 GLU A CA 1 ATOM 320 C C . GLU A 1 43 ? 7.952 13.154 11.665 1.00 9.00 ? 131 GLU A C 1 ATOM 321 O O . GLU A 1 43 ? 8.485 13.573 10.652 1.00 9.09 ? 131 GLU A O 1 ATOM 322 C CB . GLU A 1 43 ? 8.349 15.147 13.079 1.00 9.16 ? 131 GLU A CB 1 ATOM 323 C CG . GLU A 1 43 ? 7.758 16.260 13.980 1.00 9.78 ? 131 GLU A CG 1 ATOM 324 C CD . GLU A 1 43 ? 6.569 16.978 13.338 1.00 13.16 ? 131 GLU A CD 1 ATOM 325 O OE1 . GLU A 1 43 ? 6.647 17.317 12.113 1.00 14.31 ? 131 GLU A OE1 1 ATOM 326 O OE2 . GLU A 1 43 ? 5.541 17.168 14.043 1.00 11.83 ? 131 GLU A OE2 1 ATOM 327 N N . VAL A 1 44 ? 7.840 11.845 11.924 1.00 9.12 ? 132 VAL A N 1 ATOM 328 C CA . VAL A 1 44 ? 8.380 10.863 11.008 1.00 8.37 ? 132 VAL A CA 1 ATOM 329 C C . VAL A 1 44 ? 7.383 10.745 9.844 1.00 8.35 ? 132 VAL A C 1 ATOM 330 O O . VAL A 1 44 ? 6.168 10.565 10.060 1.00 8.17 ? 132 VAL A O 1 ATOM 331 C CB . VAL A 1 44 ? 8.648 9.504 11.712 1.00 7.78 ? 132 VAL A CB 1 ATOM 332 C CG1 . VAL A 1 44 ? 9.128 8.458 10.728 1.00 7.97 ? 132 VAL A CG1 1 ATOM 333 C CG2 . VAL A 1 44 ? 9.598 9.683 12.886 1.00 8.76 ? 132 VAL A CG2 1 ATOM 334 N N . PRO A 1 45 ? 7.839 10.902 8.593 1.00 8.63 ? 133 PRO A N 1 ATOM 335 C CA . PRO A 1 45 ? 6.903 10.933 7.465 1.00 9.25 ? 133 PRO A CA 1 ATOM 336 C C . PRO A 1 45 ? 6.378 9.581 6.979 1.00 10.57 ? 133 PRO A C 1 ATOM 337 O O . PRO A 1 45 ? 7.049 8.880 6.239 1.00 12.21 ? 133 PRO A O 1 ATOM 338 C CB . PRO A 1 45 ? 7.700 11.659 6.373 1.00 9.93 ? 133 PRO A CB 1 ATOM 339 C CG . PRO A 1 45 ? 9.083 11.266 6.623 1.00 9.20 ? 133 PRO A CG 1 ATOM 340 C CD . PRO A 1 45 ? 9.240 11.139 8.155 1.00 8.81 ? 133 PRO A CD 1 ATOM 341 N N . SER A 1 46 ? 5.216 9.214 7.481 1.00 10.68 ? 134 SER A N 1 ATOM 342 C CA . SER A 1 46 ? 4.506 8.028 7.097 1.00 9.50 ? 134 SER A CA 1 ATOM 343 C C . SER A 1 46 ? 3.508 8.356 6.004 1.00 9.41 ? 134 SER A C 1 ATOM 344 O O . SER A 1 46 ? 3.088 9.507 5.843 1.00 9.42 ? 134 SER A O 1 ATOM 345 C CB . SER A 1 46 ? 3.788 7.410 8.320 1.00 9.95 ? 134 SER A CB 1 ATOM 346 O OG . SER A 1 46 ? 3.043 8.378 9.062 1.00 9.33 ? 134 SER A OG 1 ATOM 347 N N . PHE A 1 47 ? 3.076 7.328 5.280 1.00 8.56 ? 135 PHE A N 1 ATOM 348 C CA . PHE A 1 47 ? 2.067 7.468 4.236 1.00 7.12 ? 135 PHE A CA 1 ATOM 349 C C . PHE A 1 47 ? 0.709 7.908 4.781 1.00 7.80 ? 135 PHE A C 1 ATOM 350 O O . PHE A 1 47 ? 0.282 7.489 5.844 1.00 7.57 ? 135 PHE A O 1 ATOM 351 C CB . PHE A 1 47 ? 1.884 6.122 3.514 1.00 6.88 ? 135 PHE A CB 1 ATOM 352 C CG . PHE A 1 47 ? 2.900 5.841 2.423 1.00 7.32 ? 135 PHE A CG 1 ATOM 353 C CD1 . PHE A 1 47 ? 4.239 5.623 2.696 1.00 8.47 ? 135 PHE A CD1 1 ATOM 354 C CD2 . PHE A 1 47 ? 2.489 5.857 1.091 1.00 7.25 ? 135 PHE A CD2 1 ATOM 355 C CE1 . PHE A 1 47 ? 5.143 5.359 1.707 1.00 9.51 ? 135 PHE A CE1 1 ATOM 356 C CE2 . PHE A 1 47 ? 3.420 5.610 0.074 1.00 6.67 ? 135 PHE A CE2 1 ATOM 357 C CZ . PHE A 1 47 ? 4.751 5.342 0.384 1.00 5.98 ? 135 PHE A CZ 1 ATOM 358 N N . GLN A 1 48 ? 0.025 8.708 3.987 1.00 7.52 ? 136 GLN A N 1 ATOM 359 C CA . GLN A 1 48 ? -1.353 9.088 4.195 1.00 7.04 ? 136 GLN A CA 1 ATOM 360 C C . GLN A 1 48 ? -2.266 8.180 3.401 1.00 6.83 ? 136 GLN A C 1 ATOM 361 O O . GLN A 1 48 ? -1.993 7.921 2.222 1.00 8.96 ? 136 GLN A O 1 ATOM 362 C CB . GLN A 1 48 ? -1.491 10.519 3.753 1.00 7.53 ? 136 GLN A CB 1 ATOM 363 C CG . GLN A 1 48 ? -2.831 11.104 4.096 1.00 10.71 ? 136 GLN A CG 1 ATOM 364 C CD . GLN A 1 48 ? -3.008 12.478 3.453 1.00 15.12 ? 136 GLN A CD 1 ATOM 365 O OE1 . GLN A 1 48 ? -4.103 12.821 2.923 1.00 15.58 ? 136 GLN A OE1 1 ATOM 366 N NE2 . GLN A 1 48 ? -1.950 13.271 3.508 1.00 13.47 ? 136 GLN A NE2 1 ATOM 367 N N . TRP A 1 49 ? -3.354 7.706 4.001 1.00 7.17 ? 137 TRP A N 1 ATOM 368 C CA . TRP A 1 49 ? -4.170 6.689 3.376 1.00 6.79 ? 137 TRP A CA 1 ATOM 369 C C . TRP A 1 49 ? -5.462 7.291 2.873 1.00 7.98 ? 137 TRP A C 1 ATOM 370 O O . TRP A 1 49 ? -6.128 8.024 3.621 1.00 7.59 ? 137 TRP A O 1 ATOM 371 C CB . TRP A 1 49 ? -4.481 5.606 4.391 1.00 8.93 ? 137 TRP A CB 1 ATOM 372 C CG . TRP A 1 49 ? -3.325 4.733 4.737 1.00 8.69 ? 137 TRP A CG 1 ATOM 373 C CD1 . TRP A 1 49 ? -2.127 5.112 5.287 1.00 7.67 ? 137 TRP A CD1 1 ATOM 374 C CD2 . TRP A 1 49 ? -3.260 3.320 4.583 1.00 7.05 ? 137 TRP A CD2 1 ATOM 375 N NE1 . TRP A 1 49 ? -1.323 4.013 5.471 1.00 6.83 ? 137 TRP A NE1 1 ATOM 376 C CE2 . TRP A 1 49 ? -1.987 2.896 5.073 1.00 7.44 ? 137 TRP A CE2 1 ATOM 377 C CE3 . TRP A 1 49 ? -4.136 2.358 4.083 1.00 7.83 ? 137 TRP A CE3 1 ATOM 378 C CZ2 . TRP A 1 49 ? -1.593 1.549 5.078 1.00 8.48 ? 137 TRP A CZ2 1 ATOM 379 C CZ3 . TRP A 1 49 ? -3.778 1.007 4.148 1.00 8.67 ? 137 TRP A CZ3 1 ATOM 380 C CH2 . TRP A 1 49 ? -2.496 0.620 4.603 1.00 7.32 ? 137 TRP A CH2 1 ATOM 381 N N . LEU A 1 50 ? -5.848 6.955 1.643 1.00 7.39 ? 138 LEU A N 1 ATOM 382 C CA . LEU A 1 50 ? -7.161 7.316 1.101 1.00 7.18 ? 138 LEU A CA 1 ATOM 383 C C . LEU A 1 50 ? -8.090 6.145 1.306 1.00 6.82 ? 138 LEU A C 1 ATOM 384 O O . LEU A 1 50 ? -8.461 5.468 0.367 1.00 8.68 ? 138 LEU A O 1 ATOM 385 C CB . LEU A 1 50 ? -7.071 7.714 -0.380 1.00 6.97 ? 138 LEU A CB 1 ATOM 386 C CG . LEU A 1 50 ? -5.989 8.772 -0.726 1.00 7.32 ? 138 LEU A CG 1 ATOM 387 C CD1 . LEU A 1 50 ? -6.024 9.100 -2.180 1.00 8.33 ? 138 LEU A CD1 1 ATOM 388 C CD2 . LEU A 1 50 ? -6.158 10.003 0.119 1.00 9.81 ? 138 LEU A CD2 1 ATOM 389 N N . ASP A 1 51 ? -8.434 5.910 2.579 1.00 7.29 ? 139 ASP A N 1 ATOM 390 C CA . ASP A 1 51 ? -9.200 4.741 2.980 1.00 7.58 ? 139 ASP A CA 1 ATOM 391 C C . ASP A 1 51 ? -10.683 4.889 2.785 1.00 7.13 ? 139 ASP A C 1 ATOM 392 O O . ASP A 1 51 ? -11.453 3.879 2.858 1.00 7.46 ? 139 ASP A O 1 ATOM 393 C CB . ASP A 1 51 ? -8.877 4.379 4.439 1.00 8.33 ? 139 ASP A CB 1 ATOM 394 C CG . ASP A 1 51 ? -9.540 5.329 5.430 1.00 10.52 ? 139 ASP A CG 1 ATOM 395 O OD1 . ASP A 1 51 ? -9.340 6.567 5.297 1.00 11.23 ? 139 ASP A OD1 1 ATOM 396 O OD2 . ASP A 1 51 ? -10.267 4.934 6.382 1.00 13.71 ? 139 ASP A OD2 1 ATOM 397 N N . ARG A 1 52 ? -11.155 6.130 2.605 1.00 8.31 ? 140 ARG A N 1 ATOM 398 C CA . ARG A 1 52 ? -12.563 6.390 2.285 1.00 8.25 ? 140 ARG A CA 1 ATOM 399 C C . ARG A 1 52 ? -12.643 7.435 1.143 1.00 8.59 ? 140 ARG A C 1 ATOM 400 O O . ARG A 1 52 ? -11.818 8.330 1.029 1.00 7.77 ? 140 ARG A O 1 ATOM 401 C CB . ARG A 1 52 ? -13.346 6.956 3.516 1.00 8.79 ? 140 ARG A CB 1 ATOM 402 C CG . ARG A 1 52 ? -13.483 5.965 4.694 1.00 10.02 ? 140 ARG A CG 1 ATOM 403 C CD . ARG A 1 52 ? -13.540 6.630 6.069 1.00 13.18 ? 140 ARG A CD 1 ATOM 404 N NE . ARG A 1 52 ? -12.337 7.425 6.295 1.00 16.79 ? 140 ARG A NE 1 ATOM 405 C CZ . ARG A 1 52 ? -12.282 8.721 6.597 1.00 18.66 ? 140 ARG A CZ 1 ATOM 406 N NH1 . ARG A 1 52 ? -13.371 9.463 6.750 1.00 21.20 ? 140 ARG A NH1 1 ATOM 407 N NH2 . ARG A 1 52 ? -11.092 9.274 6.762 1.00 22.40 ? 140 ARG A NH2 1 ATOM 408 N N . ASN A 1 53 ? -13.721 7.386 0.386 1.00 7.72 ? 141 ASN A N 1 ATOM 409 C CA . ASN A 1 53 ? -13.839 8.269 -0.773 1.00 8.67 ? 141 ASN A CA 1 ATOM 410 C C . ASN A 1 53 ? -13.816 9.747 -0.383 1.00 8.61 ? 141 ASN A C 1 ATOM 411 O O . ASN A 1 53 ? -13.278 10.577 -1.125 1.00 8.88 ? 141 ASN A O 1 ATOM 412 C CB . ASN A 1 53 ? -15.106 7.893 -1.507 1.00 8.30 ? 141 ASN A CB 1 ATOM 413 C CG . ASN A 1 53 ? -15.336 8.731 -2.747 1.00 10.54 ? 141 ASN A CG 1 ATOM 414 O OD1 . ASN A 1 53 ? -14.481 8.786 -3.623 1.00 10.21 ? 141 ASN A OD1 1 ATOM 415 N ND2 . ASN A 1 53 ? -16.533 9.323 -2.834 1.00 9.54 ? 141 ASN A ND2 1 ATOM 416 N N . VAL A 1 54 ? -14.327 10.060 0.815 1.00 8.68 ? 142 VAL A N 1 ATOM 417 C CA . VAL A 1 54 ? -14.452 11.447 1.257 1.00 10.14 ? 142 VAL A CA 1 ATOM 418 C C . VAL A 1 54 ? -13.089 12.134 1.362 1.00 8.98 ? 142 VAL A C 1 ATOM 419 O O . VAL A 1 54 ? -13.003 13.344 1.260 1.00 8.64 ? 142 VAL A O 1 ATOM 420 C CB . VAL A 1 54 ? -15.238 11.523 2.612 1.00 11.09 ? 142 VAL A CB 1 ATOM 421 C CG1 . VAL A 1 54 ? -14.446 10.893 3.710 1.00 9.42 ? 142 VAL A CG1 1 ATOM 422 C CG2 . VAL A 1 54 ? -15.591 12.939 2.950 1.00 15.60 ? 142 VAL A CG2 1 ATOM 423 N N . THR A 1 55 ? -12.020 11.337 1.539 1.00 8.09 ? 143 THR A N 1 ATOM 424 C CA . THR A 1 55 ? -10.675 11.888 1.745 1.00 8.74 ? 143 THR A CA 1 ATOM 425 C C . THR A 1 55 ? -10.088 12.462 0.463 1.00 8.15 ? 143 THR A C 1 ATOM 426 O O . THR A 1 55 ? -9.125 13.194 0.526 1.00 8.72 ? 143 THR A O 1 ATOM 427 C CB . THR A 1 55 ? -9.666 10.851 2.288 1.00 9.50 ? 143 THR A CB 1 ATOM 428 O OG1 . THR A 1 55 ? -9.453 9.812 1.316 1.00 10.74 ? 143 THR A OG1 1 ATOM 429 C CG2 . THR A 1 55 ? -10.131 10.162 3.609 1.00 9.39 ? 143 THR A CG2 1 ATOM 430 N N . VAL A 1 56 ? -10.622 12.113 -0.676 1.00 7.79 ? 144 VAL A N 1 ATOM 431 C CA . VAL A 1 56 ? -10.038 12.491 -1.982 1.00 8.69 ? 144 VAL A CA 1 ATOM 432 C C . VAL A 1 56 ? -10.086 13.995 -2.183 1.00 9.06 ? 144 VAL A C 1 ATOM 433 O O . VAL A 1 56 ? -9.049 14.636 -2.426 1.00 9.59 ? 144 VAL A O 1 ATOM 434 C CB . VAL A 1 56 ? -10.695 11.738 -3.170 1.00 7.90 ? 144 VAL A CB 1 ATOM 435 C CG1 . VAL A 1 56 ? -10.120 12.192 -4.470 1.00 8.64 ? 144 VAL A CG1 1 ATOM 436 C CG2 . VAL A 1 56 ? -10.398 10.296 -3.016 1.00 9.10 ? 144 VAL A CG2 1 ATOM 437 N N . ASP A 1 57 ? -11.259 14.577 -2.003 1.00 9.22 ? 145 ASP A N 1 ATOM 438 C CA . ASP A 1 57 ? -11.371 16.021 -2.252 1.00 10.01 ? 145 ASP A CA 1 ATOM 439 C C . ASP A 1 57 ? -11.077 16.894 -1.055 1.00 10.94 ? 145 ASP A C 1 ATOM 440 O O . ASP A 1 57 ? -11.120 18.121 -1.174 1.00 12.16 ? 145 ASP A O 1 ATOM 441 C CB . ASP A 1 57 ? -12.716 16.327 -2.847 1.00 11.69 ? 145 ASP A CB 1 ATOM 442 C CG . ASP A 1 57 ? -12.649 16.272 -4.351 1.00 14.43 ? 145 ASP A CG 1 ATOM 443 O OD1 . ASP A 1 57 ? -11.855 17.074 -4.917 1.00 21.13 ? 145 ASP A OD1 1 ATOM 444 O OD2 . ASP A 1 57 ? -13.339 15.534 -5.044 1.00 19.27 ? 145 ASP A OD2 1 ATOM 445 N N . THR A 1 58 ? -10.784 16.257 0.083 1.00 9.86 ? 146 THR A N 1 ATOM 446 C CA . THR A 1 58 ? -10.475 16.980 1.304 1.00 9.34 ? 146 THR A CA 1 ATOM 447 C C . THR A 1 58 ? -9.029 16.793 1.710 1.00 9.65 ? 146 THR A C 1 ATOM 448 O O . THR A 1 58 ? -8.189 17.678 1.427 1.00 9.55 ? 146 THR A O 1 ATOM 449 C CB . THR A 1 58 ? -11.396 16.513 2.461 1.00 10.12 ? 146 THR A CB 1 ATOM 450 O OG1 . THR A 1 58 ? -11.287 15.086 2.649 1.00 8.34 ? 146 THR A OG1 1 ATOM 451 C CG2 . THR A 1 58 ? -12.870 16.831 2.157 1.00 12.61 ? 146 THR A CG2 1 ATOM 452 N N . LEU A 1 59 ? -8.719 15.651 2.326 1.00 8.92 ? 147 LEU A N 1 ATOM 453 C CA . LEU A 1 59 ? -7.352 15.439 2.866 1.00 9.69 ? 147 LEU A CA 1 ATOM 454 C C . LEU A 1 59 ? -6.278 15.323 1.849 1.00 9.32 ? 147 LEU A C 1 ATOM 455 O O . LEU A 1 59 ? -5.164 15.790 2.104 1.00 9.38 ? 147 LEU A O 1 ATOM 456 C CB . LEU A 1 59 ? -7.303 14.217 3.770 1.00 10.24 ? 147 LEU A CB 1 ATOM 457 C CG . LEU A 1 59 ? -8.404 14.222 4.843 1.00 11.78 ? 147 LEU A CG 1 ATOM 458 C CD1 . LEU A 1 59 ? -8.168 13.085 5.797 1.00 14.96 ? 147 LEU A CD1 1 ATOM 459 C CD2 . LEU A 1 59 ? -8.530 15.549 5.582 1.00 14.44 ? 147 LEU A CD2 1 ATOM 460 N N . LEU A 1 60 ? -6.568 14.715 0.694 1.00 8.48 ? 148 LEU A N 1 ATOM 461 C CA . LEU A 1 60 ? -5.556 14.618 -0.330 1.00 8.41 ? 148 LEU A CA 1 ATOM 462 C C . LEU A 1 60 ? -5.214 16.009 -0.874 1.00 8.74 ? 148 LEU A C 1 ATOM 463 O O . LEU A 1 60 ? -4.056 16.371 -0.948 1.00 7.86 ? 148 LEU A O 1 ATOM 464 C CB . LEU A 1 60 ? -6.019 13.722 -1.468 1.00 9.01 ? 148 LEU A CB 1 ATOM 465 C CG . LEU A 1 60 ? -5.194 13.644 -2.714 1.00 7.54 ? 148 LEU A CG 1 ATOM 466 C CD1 . LEU A 1 60 ? -3.784 13.057 -2.400 1.00 8.29 ? 148 LEU A CD1 1 ATOM 467 C CD2 . LEU A 1 60 ? -5.898 12.834 -3.789 1.00 9.50 ? 148 LEU A CD2 1 ATOM 468 N N . VAL A 1 61 ? -6.244 16.785 -1.194 1.00 7.33 ? 149 VAL A N 1 ATOM 469 C CA . VAL A 1 61 ? -6.046 18.153 -1.674 1.00 7.34 ? 149 VAL A CA 1 ATOM 470 C C . VAL A 1 61 ? -5.291 18.976 -0.620 1.00 7.84 ? 149 VAL A C 1 ATOM 471 O O . VAL A 1 61 ? -4.359 19.739 -0.971 1.00 6.97 ? 149 VAL A O 1 ATOM 472 C CB . VAL A 1 61 ? -7.388 18.770 -2.081 1.00 6.98 ? 149 VAL A CB 1 ATOM 473 C CG1 . VAL A 1 61 ? -7.243 20.223 -2.454 1.00 8.67 ? 149 VAL A CG1 1 ATOM 474 C CG2 . VAL A 1 61 ? -7.948 18.025 -3.248 1.00 7.28 ? 149 VAL A CG2 1 ATOM 475 N N . GLN A 1 62 ? -5.656 18.844 0.641 0.50 4.73 ? 150 GLN A N 1 ATOM 476 C CA . GLN A 1 62 ? -5.030 19.671 1.646 0.50 6.07 ? 150 GLN A CA 1 ATOM 477 C C . GLN A 1 62 ? -3.518 19.392 1.742 0.50 4.67 ? 150 GLN A C 1 ATOM 478 O O . GLN A 1 62 ? -2.718 20.275 1.792 0.50 2.00 ? 150 GLN A O 1 ATOM 479 C CB A GLN A 1 62 ? -5.704 19.428 2.984 0.50 8.55 ? 150 GLN A CB 1 ATOM 480 C CB B GLN A 1 62 ? -5.694 19.420 2.992 0.50 8.44 ? 150 GLN A CB 1 ATOM 481 C CG A GLN A 1 62 ? -5.031 20.117 4.155 0.50 10.38 ? 150 GLN A CG 1 ATOM 482 C CG B GLN A 1 62 ? -5.105 20.269 4.101 0.50 9.88 ? 150 GLN A CG 1 ATOM 483 C CD A GLN A 1 62 ? -5.648 19.702 5.477 0.50 13.44 ? 150 GLN A CD 1 ATOM 484 C CD B GLN A 1 62 ? -5.408 21.740 3.917 0.50 11.95 ? 150 GLN A CD 1 ATOM 485 O OE1 A GLN A 1 62 ? -6.847 19.489 5.571 0.50 18.52 ? 150 GLN A OE1 1 ATOM 486 O OE1 B GLN A 1 62 ? -6.433 22.122 3.300 0.50 15.89 ? 150 GLN A OE1 1 ATOM 487 N NE2 A GLN A 1 62 ? -4.823 19.601 6.495 0.50 16.35 ? 150 GLN A NE2 1 ATOM 488 N NE2 B GLN A 1 62 ? -4.534 22.595 4.457 0.50 13.82 ? 150 GLN A NE2 1 ATOM 489 N N . THR A 1 63 ? -3.136 18.122 1.743 1.00 6.57 ? 151 THR A N 1 ATOM 490 C CA . THR A 1 63 ? -1.720 17.755 1.818 1.00 6.96 ? 151 THR A CA 1 ATOM 491 C C . THR A 1 63 ? -0.970 18.257 0.612 1.00 6.52 ? 151 THR A C 1 ATOM 492 O O . THR A 1 63 ? 0.130 18.838 0.723 1.00 5.99 ? 151 THR A O 1 ATOM 493 C CB . THR A 1 63 ? -1.557 16.244 2.001 1.00 8.97 ? 151 THR A CB 1 ATOM 494 O OG1 . THR A 1 63 ? -1.996 15.909 3.336 1.00 9.78 ? 151 THR A OG1 1 ATOM 495 C CG2 . THR A 1 63 ? -0.065 15.801 1.894 1.00 10.03 ? 151 THR A CG2 1 ATOM 496 N N . LEU A 1 64 ? -1.528 18.061 -0.565 1.00 7.01 ? 152 LEU A N 1 ATOM 497 C CA . LEU A 1 64 ? -0.813 18.470 -1.777 1.00 8.17 ? 152 LEU A CA 1 ATOM 498 C C . LEU A 1 64 ? -0.672 19.983 -1.824 1.00 7.27 ? 152 LEU A C 1 ATOM 499 O O . LEU A 1 64 ? 0.383 20.488 -2.255 1.00 6.12 ? 152 LEU A O 1 ATOM 500 C CB . LEU A 1 64 ? -1.531 17.947 -3.022 1.00 8.43 ? 152 LEU A CB 1 ATOM 501 C CG . LEU A 1 64 ? -1.507 16.427 -3.195 1.00 10.22 ? 152 LEU A CG 1 ATOM 502 C CD1 . LEU A 1 64 ? -2.354 15.992 -4.368 1.00 9.63 ? 152 LEU A CD1 1 ATOM 503 C CD2 . LEU A 1 64 ? -0.071 15.962 -3.411 1.00 10.58 ? 152 LEU A CD2 1 ATOM 504 N N . SER A 1 65 ? -1.689 20.692 -1.292 1.00 6.97 ? 153 SER A N 1 ATOM 505 C CA . SER A 1 65 ? -1.669 22.161 -1.279 1.00 6.90 ? 153 SER A CA 1 ATOM 506 C C . SER A 1 65 ? -0.590 22.675 -0.323 1.00 7.08 ? 153 SER A C 1 ATOM 507 O O . SER A 1 65 ? 0.145 23.623 -0.647 1.00 6.39 ? 153 SER A O 1 ATOM 508 C CB A SER A 1 65 ? -3.027 22.783 -0.904 0.55 7.57 ? 153 SER A CB 1 ATOM 509 C CB B SER A 1 65 ? -3.078 22.761 -1.006 0.45 7.38 ? 153 SER A CB 1 ATOM 510 O OG A SER A 1 65 ? -4.033 22.450 -1.813 0.55 7.65 ? 153 SER A OG 1 ATOM 511 O OG B SER A 1 65 ? -3.529 22.550 0.333 0.45 8.70 ? 153 SER A OG 1 ATOM 512 N N . GLU A 1 66 ? -0.436 21.992 0.797 1.00 6.61 ? 154 GLU A N 1 ATOM 513 C CA . GLU A 1 66 ? 0.614 22.336 1.762 1.00 6.94 ? 154 GLU A CA 1 ATOM 514 C C . GLU A 1 66 ? 2.007 22.105 1.222 1.00 6.22 ? 154 GLU A C 1 ATOM 515 O O . GLU A 1 66 ? 2.921 22.959 1.415 1.00 6.10 ? 154 GLU A O 1 ATOM 516 C CB . GLU A 1 66 ? 0.428 21.552 3.051 1.00 7.71 ? 154 GLU A CB 1 ATOM 517 C CG . GLU A 1 66 ? -0.806 21.943 3.838 1.00 8.04 ? 154 GLU A CG 1 ATOM 518 C CD . GLU A 1 66 ? -1.184 20.964 4.928 1.00 10.62 ? 154 GLU A CD 1 ATOM 519 O OE1 . GLU A 1 66 ? -0.492 19.944 5.099 1.00 9.25 ? 154 GLU A OE1 1 ATOM 520 O OE2 . GLU A 1 66 ? -2.183 21.249 5.637 1.00 11.15 ? 154 GLU A OE2 1 ATOM 521 N N . ILE A 1 67 ? 2.187 20.990 0.523 1.00 6.20 ? 155 ILE A N 1 ATOM 522 C CA . ILE A 1 67 ? 3.474 20.676 -0.066 1.00 4.21 ? 155 ILE A CA 1 ATOM 523 C C . ILE A 1 67 ? 3.801 21.717 -1.127 1.00 4.50 ? 155 ILE A C 1 ATOM 524 O O . ILE A 1 67 ? 4.911 22.201 -1.182 1.00 4.84 ? 155 ILE A O 1 ATOM 525 C CB . ILE A 1 67 ? 3.533 19.257 -0.637 1.00 5.30 ? 155 ILE A CB 1 ATOM 526 C CG1 . ILE A 1 67 ? 3.488 18.206 0.487 1.00 7.22 ? 155 ILE A CG1 1 ATOM 527 C CG2 . ILE A 1 67 ? 4.780 19.103 -1.458 1.00 5.41 ? 155 ILE A CG2 1 ATOM 528 C CD1 . ILE A 1 67 ? 3.138 16.825 0.037 1.00 6.89 ? 155 ILE A CD1 1 ATOM 529 N N . ARG A 1 68 ? 2.847 22.031 -1.990 1.00 3.77 ? 156 ARG A N 1 ATOM 530 C CA . ARG A 1 68 ? 3.057 23.026 -3.021 1.00 5.03 ? 156 ARG A CA 1 ATOM 531 C C . ARG A 1 68 ? 3.531 24.339 -2.420 1.00 5.25 ? 156 ARG A C 1 ATOM 532 O O . ARG A 1 68 ? 4.471 24.974 -2.886 1.00 4.92 ? 156 ARG A O 1 ATOM 533 C CB . ARG A 1 68 ? 1.754 23.278 -3.773 1.00 4.32 ? 156 ARG A CB 1 ATOM 534 C CG . ARG A 1 68 ? 1.809 24.433 -4.743 1.00 4.92 ? 156 ARG A CG 1 ATOM 535 C CD . ARG A 1 68 ? 0.564 24.665 -5.483 1.00 6.70 ? 156 ARG A CD 1 ATOM 536 N NE . ARG A 1 68 ? 0.427 23.713 -6.602 1.00 4.62 ? 156 ARG A NE 1 ATOM 537 C CZ . ARG A 1 68 ? -0.698 23.518 -7.273 1.00 7.58 ? 156 ARG A CZ 1 ATOM 538 N NH1 . ARG A 1 68 ? -1.808 24.149 -6.942 1.00 7.88 ? 156 ARG A NH1 1 ATOM 539 N NH2 . ARG A 1 68 ? -0.716 22.699 -8.324 1.00 8.71 ? 156 ARG A NH2 1 ATOM 540 N N . GLU A 1 69 ? 2.857 24.755 -1.351 1.00 6.05 ? 157 GLU A N 1 ATOM 541 C CA . GLU A 1 69 ? 3.224 26.013 -0.711 1.00 7.21 ? 157 GLU A CA 1 ATOM 542 C C . GLU A 1 69 ? 4.660 26.000 -0.138 1.00 5.77 ? 157 GLU A C 1 ATOM 543 O O . GLU A 1 69 ? 5.414 26.979 -0.285 1.00 4.79 ? 157 GLU A O 1 ATOM 544 C CB . GLU A 1 69 ? 2.187 26.357 0.336 1.00 7.96 ? 157 GLU A CB 1 ATOM 545 C CG . GLU A 1 69 ? 2.549 27.645 1.040 1.00 14.91 ? 157 GLU A CG 1 ATOM 546 C CD . GLU A 1 69 ? 1.355 28.362 1.652 1.00 22.58 ? 157 GLU A CD 1 ATOM 547 O OE1 . GLU A 1 69 ? 0.330 27.699 1.962 1.00 23.90 ? 157 GLU A OE1 1 ATOM 548 O OE2 . GLU A 1 69 ? 1.481 29.611 1.830 1.00 26.35 ? 157 GLU A OE2 1 ATOM 549 N N . ALA A 1 70 ? 5.018 24.875 0.475 1.00 6.80 ? 158 ALA A N 1 ATOM 550 C CA . ALA A 1 70 ? 6.378 24.738 1.071 1.00 6.76 ? 158 ALA A CA 1 ATOM 551 C C . ALA A 1 70 ? 7.440 24.754 -0.017 1.00 6.38 ? 158 ALA A C 1 ATOM 552 O O . ALA A 1 70 ? 8.479 25.389 0.107 1.00 6.89 ? 158 ALA A O 1 ATOM 553 C CB . ALA A 1 70 ? 6.475 23.513 1.858 1.00 7.36 ? 158 ALA A CB 1 ATOM 554 N N . ASN A 1 71 ? 7.171 24.045 -1.101 1.00 5.82 ? 159 ASN A N 1 ATOM 555 C CA . ASN A 1 71 ? 8.106 23.999 -2.213 1.00 6.53 ? 159 ASN A CA 1 ATOM 556 C C . ASN A 1 71 ? 8.246 25.356 -2.912 1.00 6.41 ? 159 ASN A C 1 ATOM 557 O O . ASN A 1 71 ? 9.356 25.779 -3.238 1.00 6.97 ? 159 ASN A O 1 ATOM 558 C CB . ASN A 1 71 ? 7.735 22.876 -3.175 1.00 6.60 ? 159 ASN A CB 1 ATOM 559 C CG . ASN A 1 71 ? 7.905 21.507 -2.553 1.00 8.50 ? 159 ASN A CG 1 ATOM 560 O OD1 . ASN A 1 71 ? 8.582 21.365 -1.541 1.00 8.17 ? 159 ASN A OD1 1 ATOM 561 N ND2 . ASN A 1 71 ? 7.368 20.484 -3.213 1.00 6.76 ? 159 ASN A ND2 1 ATOM 562 N N . GLN A 1 72 ? 7.132 26.058 -3.122 1.00 6.65 ? 160 GLN A N 1 ATOM 563 C CA . GLN A 1 72 ? 7.179 27.423 -3.654 1.00 7.67 ? 160 GLN A CA 1 ATOM 564 C C . GLN A 1 72 ? 7.948 28.412 -2.801 1.00 8.31 ? 160 GLN A C 1 ATOM 565 O O . GLN A 1 72 ? 8.573 29.327 -3.328 1.00 8.42 ? 160 GLN A O 1 ATOM 566 C CB . GLN A 1 72 ? 5.775 27.965 -3.897 1.00 7.84 ? 160 GLN A CB 1 ATOM 567 C CG . GLN A 1 72 ? 5.075 27.327 -5.078 1.00 8.26 ? 160 GLN A CG 1 ATOM 568 C CD . GLN A 1 72 ? 3.614 27.667 -5.130 1.00 11.33 ? 160 GLN A CD 1 ATOM 569 O OE1 . GLN A 1 72 ? 2.979 27.976 -4.083 1.00 11.96 ? 160 GLN A OE1 1 ATOM 570 N NE2 . GLN A 1 72 ? 3.044 27.615 -6.339 1.00 11.23 ? 160 GLN A NE2 1 ATOM 571 N N . ALA A 1 73 ? 7.948 28.201 -1.494 1.00 9.37 ? 161 ALA A N 1 ATOM 572 C CA . ALA A 1 73 ? 8.711 29.027 -0.565 1.00 9.60 ? 161 ALA A CA 1 ATOM 573 C C . ALA A 1 73 ? 10.194 28.701 -0.518 1.00 10.26 ? 161 ALA A C 1 ATOM 574 O O . ALA A 1 73 ? 11.023 29.500 0.004 1.00 12.50 ? 161 ALA A O 1 ATOM 575 C CB . ALA A 1 73 ? 8.061 28.932 0.844 1.00 9.56 ? 161 ALA A CB 1 ATOM 576 N N . GLY A 1 74 ? 10.589 27.610 -1.161 1.00 10.09 ? 162 GLY A N 1 ATOM 577 C CA . GLY A 1 74 ? 11.991 27.259 -1.341 1.00 10.24 ? 162 GLY A CA 1 ATOM 578 C C . GLY A 1 74 ? 12.508 26.000 -0.685 1.00 10.15 ? 162 GLY A C 1 ATOM 579 O O . GLY A 1 74 ? 13.690 25.802 -0.634 1.00 10.86 ? 162 GLY A O 1 ATOM 580 N N . ALA A 1 75 ? 11.615 25.126 -0.202 1.00 11.53 ? 163 ALA A N 1 ATOM 581 C CA . ALA A 1 75 ? 12.044 23.937 0.475 1.00 11.43 ? 163 ALA A CA 1 ATOM 582 C C . ALA A 1 75 ? 13.125 23.193 -0.368 1.00 12.43 ? 163 ALA A C 1 ATOM 583 O O . ALA A 1 75 ? 12.964 22.945 -1.580 1.00 12.78 ? 163 ALA A O 1 ATOM 584 C CB . ALA A 1 75 ? 10.862 23.068 0.725 1.00 11.20 ? 163 ALA A CB 1 ATOM 585 N N . ASN A 1 76 ? 14.235 22.869 0.279 1.00 13.08 ? 164 ASN A N 1 ATOM 586 C CA . ASN A 1 76 ? 15.340 22.248 -0.420 1.00 14.03 ? 164 ASN A CA 1 ATOM 587 C C . ASN A 1 76 ? 15.938 21.177 0.481 1.00 15.04 ? 164 ASN A C 1 ATOM 588 O O . ASN A 1 76 ? 16.429 21.505 1.567 1.00 16.17 ? 164 ASN A O 1 ATOM 589 C CB . ASN A 1 76 ? 16.370 23.326 -0.789 1.00 14.70 ? 164 ASN A CB 1 ATOM 590 C CG . ASN A 1 76 ? 17.345 22.851 -1.838 1.00 15.74 ? 164 ASN A CG 1 ATOM 591 O OD1 . ASN A 1 76 ? 17.431 21.656 -2.115 1.00 19.85 ? 164 ASN A OD1 1 ATOM 592 N ND2 . ASN A 1 76 ? 18.128 23.788 -2.415 1.00 17.95 ? 164 ASN A ND2 1 ATOM 593 N N . PRO A 1 77 ? 15.844 19.894 0.118 1.00 13.63 ? 165 PRO A N 1 ATOM 594 C CA . PRO A 1 77 ? 15.145 19.395 -1.079 1.00 12.63 ? 165 PRO A CA 1 ATOM 595 C C . PRO A 1 77 ? 13.640 19.663 -1.057 1.00 11.18 ? 165 PRO A C 1 ATOM 596 O O . PRO A 1 77 ? 13.049 19.851 0.031 1.00 10.96 ? 165 PRO A O 1 ATOM 597 C CB . PRO A 1 77 ? 15.363 17.868 -1.020 1.00 13.49 ? 165 PRO A CB 1 ATOM 598 C CG . PRO A 1 77 ? 16.507 17.644 -0.041 1.00 13.62 ? 165 PRO A CG 1 ATOM 599 C CD . PRO A 1 77 ? 16.498 18.819 0.888 1.00 14.31 ? 165 PRO A CD 1 ATOM 600 N N . GLN A 1 78 ? 13.027 19.659 -2.246 1.00 9.34 ? 166 GLN A N 1 ATOM 601 C CA . GLN A 1 78 ? 11.569 19.759 -2.361 1.00 9.36 ? 166 GLN A CA 1 ATOM 602 C C . GLN A 1 78 ? 10.928 18.617 -1.582 1.00 7.70 ? 166 GLN A C 1 ATOM 603 O O . GLN A 1 78 ? 11.492 17.511 -1.506 1.00 7.77 ? 166 GLN A O 1 ATOM 604 C CB . GLN A 1 78 ? 11.137 19.687 -3.832 1.00 10.22 ? 166 GLN A CB 1 ATOM 605 C CG . GLN A 1 78 ? 11.300 18.248 -4.502 1.00 16.42 ? 166 GLN A CG 1 ATOM 606 C CD . GLN A 1 78 ? 11.023 18.188 -6.029 1.00 22.41 ? 166 GLN A CD 1 ATOM 607 O OE1 . GLN A 1 78 ? 11.941 17.911 -6.830 1.00 25.63 ? 166 GLN A OE1 1 ATOM 608 N NE2 . GLN A 1 78 ? 9.772 18.441 -6.423 1.00 23.41 ? 166 GLN A NE2 1 ATOM 609 N N . TYR A 1 79 ? 9.709 18.867 -1.071 1.00 6.77 ? 167 TYR A N 1 ATOM 610 C CA . TYR A 1 79 ? 8.907 17.814 -0.426 1.00 6.17 ? 167 TYR A CA 1 ATOM 611 C C . TYR A 1 79 ? 8.123 16.993 -1.446 1.00 6.71 ? 167 TYR A C 1 ATOM 612 O O . TYR A 1 79 ? 7.710 17.512 -2.455 1.00 6.06 ? 167 TYR A O 1 ATOM 613 C CB . TYR A 1 79 ? 7.928 18.413 0.569 1.00 6.11 ? 167 TYR A CB 1 ATOM 614 C CG . TYR A 1 79 ? 8.576 18.926 1.814 1.00 7.64 ? 167 TYR A CG 1 ATOM 615 C CD1 . TYR A 1 79 ? 8.940 18.037 2.848 1.00 8.76 ? 167 TYR A CD1 1 ATOM 616 C CD2 . TYR A 1 79 ? 8.841 20.306 1.987 1.00 9.45 ? 167 TYR A CD2 1 ATOM 617 C CE1 . TYR A 1 79 ? 9.558 18.517 4.003 1.00 9.49 ? 167 TYR A CE1 1 ATOM 618 C CE2 . TYR A 1 79 ? 9.448 20.786 3.143 1.00 9.39 ? 167 TYR A CE2 1 ATOM 619 C CZ . TYR A 1 79 ? 9.799 19.872 4.154 1.00 11.01 ? 167 TYR A CZ 1 ATOM 620 O OH . TYR A 1 79 ? 10.432 20.303 5.332 1.00 10.31 ? 167 TYR A OH 1 ATOM 621 N N . ALA A 1 80 ? 7.972 15.700 -1.155 1.00 7.14 ? 168 ALA A N 1 ATOM 622 C CA . ALA A 1 80 ? 7.170 14.764 -1.942 1.00 6.53 ? 168 ALA A CA 1 ATOM 623 C C . ALA A 1 80 ? 6.087 14.165 -1.052 1.00 6.87 ? 168 ALA A C 1 ATOM 624 O O . ALA A 1 80 ? 6.251 14.003 0.166 1.00 6.81 ? 168 ALA A O 1 ATOM 625 C CB . ALA A 1 80 ? 8.060 13.663 -2.495 1.00 7.54 ? 168 ALA A CB 1 ATOM 626 N N . ALA A 1 81 ? 4.991 13.790 -1.674 1.00 6.87 ? 169 ALA A N 1 ATOM 627 C CA . ALA A 1 81 ? 3.878 13.159 -0.992 1.00 6.83 ? 169 ALA A CA 1 ATOM 628 C C . ALA A 1 81 ? 3.935 11.643 -1.101 1.00 7.44 ? 169 ALA A C 1 ATOM 629 O O . ALA A 1 81 ? 4.416 11.083 -2.097 1.00 7.98 ? 169 ALA A O 1 ATOM 630 C CB . ALA A 1 81 ? 2.606 13.662 -1.606 1.00 7.01 ? 169 ALA A CB 1 ATOM 631 N N . GLN A 1 82 ? 3.419 10.981 -0.068 1.00 7.24 ? 170 GLN A N 1 ATOM 632 C CA . GLN A 1 82 ? 3.338 9.537 0.040 1.00 6.98 ? 170 GLN A CA 1 ATOM 633 C C . GLN A 1 82 ? 1.877 9.190 0.355 1.00 6.69 ? 170 GLN A C 1 ATOM 634 O O . GLN A 1 82 ? 1.378 9.545 1.412 1.00 6.42 ? 170 GLN A O 1 ATOM 635 C CB . GLN A 1 82 ? 4.205 9.061 1.200 1.00 7.76 ? 170 GLN A CB 1 ATOM 636 C CG . GLN A 1 82 ? 5.668 9.191 0.960 1.00 7.58 ? 170 GLN A CG 1 ATOM 637 C CD . GLN A 1 82 ? 6.473 8.792 2.149 1.00 10.77 ? 170 GLN A CD 1 ATOM 638 O OE1 . GLN A 1 82 ? 7.094 7.734 2.160 1.00 9.04 ? 170 GLN A OE1 1 ATOM 639 N NE2 . GLN A 1 82 ? 6.418 9.607 3.184 1.00 9.38 ? 170 GLN A NE2 1 ATOM 640 N N . ILE A 1 83 ? 1.210 8.525 -0.568 1.00 5.95 ? 171 ILE A N 1 ATOM 641 C CA . ILE A 1 83 ? -0.238 8.290 -0.508 1.00 7.26 ? 171 ILE A CA 1 ATOM 642 C C . ILE A 1 83 ? -0.532 6.806 -0.740 1.00 6.99 ? 171 ILE A C 1 ATOM 643 O O . ILE A 1 83 ? 0.018 6.180 -1.650 1.00 6.47 ? 171 ILE A O 1 ATOM 644 C CB . ILE A 1 83 ? -0.977 9.149 -1.585 1.00 7.23 ? 171 ILE A CB 1 ATOM 645 C CG1 . ILE A 1 83 ? -0.651 10.634 -1.454 1.00 10.83 ? 171 ILE A CG1 1 ATOM 646 C CG2 . ILE A 1 83 ? -2.455 8.948 -1.563 1.00 10.88 ? 171 ILE A CG2 1 ATOM 647 C CD1 . ILE A 1 83 ? -1.113 11.354 -0.196 1.00 14.96 ? 171 ILE A CD1 1 ATOM 648 N N . VAL A 1 84 ? -1.468 6.268 0.035 1.00 6.29 ? 172 VAL A N 1 ATOM 649 C CA . VAL A 1 84 ? -1.962 4.923 -0.201 1.00 6.70 ? 172 VAL A CA 1 ATOM 650 C C . VAL A 1 84 ? -3.344 4.979 -0.804 1.00 7.22 ? 172 VAL A C 1 ATOM 651 O O . VAL A 1 84 ? -4.234 5.601 -0.255 1.00 7.33 ? 172 VAL A O 1 ATOM 652 C CB . VAL A 1 84 ? -2.054 4.062 1.083 1.00 6.43 ? 172 VAL A CB 1 ATOM 653 C CG1 . VAL A 1 84 ? -2.399 2.598 0.710 1.00 7.29 ? 172 VAL A CG1 1 ATOM 654 C CG2 . VAL A 1 84 ? -0.764 4.103 1.839 1.00 8.77 ? 172 VAL A CG2 1 ATOM 655 N N . VAL A 1 85 ? -3.548 4.249 -1.902 1.00 7.26 ? 173 VAL A N 1 ATOM 656 C CA . VAL A 1 85 ? -4.876 4.073 -2.481 1.00 7.51 ? 173 VAL A CA 1 ATOM 657 C C . VAL A 1 85 ? -5.492 2.799 -1.867 1.00 7.89 ? 173 VAL A C 1 ATOM 658 O O . VAL A 1 85 ? -4.920 1.719 -2.017 1.00 7.33 ? 173 VAL A O 1 ATOM 659 C CB . VAL A 1 85 ? -4.784 3.969 -4.024 1.00 7.54 ? 173 VAL A CB 1 ATOM 660 C CG1 . VAL A 1 85 ? -6.168 3.772 -4.683 1.00 7.87 ? 173 VAL A CG1 1 ATOM 661 C CG2 . VAL A 1 85 ? -4.110 5.181 -4.590 1.00 6.96 ? 173 VAL A CG2 1 ATOM 662 N N . TYR A 1 86 ? -6.612 2.924 -1.163 1.00 6.86 ? 174 TYR A N 1 ATOM 663 C CA . TYR A 1 86 ? -7.113 1.806 -0.363 1.00 7.21 ? 174 TYR A CA 1 ATOM 664 C C . TYR A 1 86 ? -8.625 1.856 -0.210 1.00 7.92 ? 174 TYR A C 1 ATOM 665 O O . TYR A 1 86 ? -9.136 2.121 0.894 1.00 7.76 ? 174 TYR A O 1 ATOM 666 C CB . TYR A 1 86 ? -6.456 1.805 1.031 1.00 8.33 ? 174 TYR A CB 1 ATOM 667 C CG . TYR A 1 86 ? -6.777 0.596 1.878 1.00 7.67 ? 174 TYR A CG 1 ATOM 668 C CD1 . TYR A 1 86 ? -6.456 -0.683 1.445 1.00 9.05 ? 174 TYR A CD1 1 ATOM 669 C CD2 . TYR A 1 86 ? -7.400 0.735 3.127 1.00 8.94 ? 174 TYR A CD2 1 ATOM 670 C CE1 . TYR A 1 86 ? -6.733 -1.815 2.250 1.00 7.61 ? 174 TYR A CE1 1 ATOM 671 C CE2 . TYR A 1 86 ? -7.707 -0.367 3.917 1.00 7.78 ? 174 TYR A CE2 1 ATOM 672 C CZ . TYR A 1 86 ? -7.372 -1.639 3.483 1.00 8.23 ? 174 TYR A CZ 1 ATOM 673 O OH . TYR A 1 86 ? -7.661 -2.732 4.289 1.00 9.79 ? 174 TYR A OH 1 ATOM 674 N N . ASP A 1 87 ? -9.342 1.623 -1.291 1.00 8.09 ? 175 ASP A N 1 ATOM 675 C CA . ASP A 1 87 ? -10.796 1.621 -1.209 1.00 7.46 ? 175 ASP A CA 1 ATOM 676 C C . ASP A 1 87 ? -11.458 0.716 -2.254 1.00 8.01 ? 175 ASP A C 1 ATOM 677 O O . ASP A 1 87 ? -12.571 0.952 -2.668 1.00 7.57 ? 175 ASP A O 1 ATOM 678 C CB . ASP A 1 87 ? -11.319 3.068 -1.295 1.00 7.18 ? 175 ASP A CB 1 ATOM 679 C CG . ASP A 1 87 ? -12.659 3.259 -0.665 1.00 10.09 ? 175 ASP A CG 1 ATOM 680 O OD1 . ASP A 1 87 ? -13.145 2.378 0.108 1.00 6.22 ? 175 ASP A OD1 1 ATOM 681 O OD2 . ASP A 1 87 ? -13.317 4.313 -0.914 1.00 8.37 ? 175 ASP A OD2 1 ATOM 682 N N . LEU A 1 88 ? -10.818 -0.400 -2.572 1.00 8.00 ? 176 LEU A N 1 ATOM 683 C CA . LEU A 1 88 ? -11.500 -1.387 -3.390 1.00 7.85 ? 176 LEU A CA 1 ATOM 684 C C . LEU A 1 88 ? -12.812 -1.834 -2.795 1.00 8.43 ? 176 LEU A C 1 ATOM 685 O O . LEU A 1 88 ? -12.948 -1.935 -1.595 1.00 7.61 ? 176 LEU A O 1 ATOM 686 C CB . LEU A 1 88 ? -10.650 -2.632 -3.635 1.00 7.83 ? 176 LEU A CB 1 ATOM 687 C CG . LEU A 1 88 ? -9.532 -2.455 -4.656 1.00 6.46 ? 176 LEU A CG 1 ATOM 688 C CD1 . LEU A 1 88 ? -8.481 -3.603 -4.478 1.00 7.78 ? 176 LEU A CD1 1 ATOM 689 C CD2 . LEU A 1 88 ? -10.043 -2.440 -6.066 1.00 9.32 ? 176 LEU A CD2 1 ATOM 690 N N . PRO A 1 89 ? -13.789 -2.089 -3.649 1.00 8.12 ? 177 PRO A N 1 ATOM 691 C CA . PRO A 1 89 ? -15.042 -2.705 -3.189 1.00 8.09 ? 177 PRO A CA 1 ATOM 692 C C . PRO A 1 89 ? -14.722 -4.122 -2.725 1.00 8.45 ? 177 PRO A C 1 ATOM 693 O O . PRO A 1 89 ? -13.763 -4.724 -3.216 1.00 9.16 ? 177 PRO A O 1 ATOM 694 C CB . PRO A 1 89 ? -15.883 -2.757 -4.448 1.00 7.81 ? 177 PRO A CB 1 ATOM 695 C CG . PRO A 1 89 ? -14.897 -2.781 -5.551 1.00 8.73 ? 177 PRO A CG 1 ATOM 696 C CD . PRO A 1 89 ? -13.763 -1.941 -5.110 1.00 8.96 ? 177 PRO A CD 1 ATOM 697 N N . ASP A 1 90 ? -15.488 -4.642 -1.765 1.00 8.42 ? 178 ASP A N 1 ATOM 698 C CA . ASP A 1 90 ? -15.155 -5.928 -1.142 1.00 8.23 ? 178 ASP A CA 1 ATOM 699 C C . ASP A 1 90 ? -13.654 -5.948 -0.729 1.00 8.49 ? 178 ASP A C 1 ATOM 700 O O . ASP A 1 90 ? -12.927 -6.903 -0.944 1.00 6.57 ? 178 ASP A O 1 ATOM 701 C CB . ASP A 1 90 ? -15.537 -7.120 -2.052 1.00 9.54 ? 178 ASP A CB 1 ATOM 702 C CG . ASP A 1 90 ? -17.057 -7.301 -2.230 1.00 11.23 ? 178 ASP A CG 1 ATOM 703 O OD1 . ASP A 1 90 ? -17.866 -6.377 -1.993 1.00 12.05 ? 178 ASP A OD1 1 ATOM 704 O OD2 . ASP A 1 90 ? -17.568 -8.372 -2.622 1.00 18.37 ? 178 ASP A OD2 1 ATOM 705 N N . ARG A 1 91 ? -13.247 -4.881 -0.059 1.00 7.23 ? 179 ARG A N 1 ATOM 706 C CA . ARG A 1 91 ? -11.904 -4.711 0.472 1.00 7.52 ? 179 ARG A CA 1 ATOM 707 C C . ARG A 1 91 ? -11.590 -5.725 1.551 1.00 7.06 ? 179 ARG A C 1 ATOM 708 O O . ARG A 1 91 ? -12.492 -6.231 2.244 1.00 7.97 ? 179 ARG A O 1 ATOM 709 C CB . ARG A 1 91 ? -11.787 -3.298 1.064 1.00 7.12 ? 179 ARG A CB 1 ATOM 710 C CG . ARG A 1 91 ? -10.399 -2.799 1.212 1.00 7.91 ? 179 ARG A CG 1 ATOM 711 C CD . ARG A 1 91 ? -10.360 -1.316 1.626 1.00 7.24 ? 179 ARG A CD 1 ATOM 712 N NE . ARG A 1 91 ? -10.765 -1.141 2.999 1.00 6.98 ? 179 ARG A NE 1 ATOM 713 C CZ . ARG A 1 91 ? -10.986 0.014 3.593 1.00 9.07 ? 179 ARG A CZ 1 ATOM 714 N NH1 . ARG A 1 91 ? -10.861 1.139 2.940 1.00 9.25 ? 179 ARG A NH1 1 ATOM 715 N NH2 . ARG A 1 91 ? -11.387 0.052 4.862 1.00 9.48 ? 179 ARG A NH2 1 ATOM 716 N N . ASP A 1 92 ? -10.310 -6.047 1.688 1.00 7.69 ? 180 ASP A N 1 ATOM 717 C CA . ASP A 1 92 ? -9.844 -6.889 2.797 1.00 8.28 ? 180 ASP A CA 1 ATOM 718 C C . ASP A 1 92 ? -10.562 -8.221 2.782 1.00 9.10 ? 180 ASP A C 1 ATOM 719 O O . ASP A 1 92 ? -11.143 -8.659 3.763 1.00 9.72 ? 180 ASP A O 1 ATOM 720 C CB . ASP A 1 92 ? -10.081 -6.172 4.122 1.00 8.69 ? 180 ASP A CB 1 ATOM 721 C CG . ASP A 1 92 ? -9.235 -6.712 5.249 1.00 11.38 ? 180 ASP A CG 1 ATOM 722 O OD1 . ASP A 1 92 ? -8.092 -7.189 5.018 1.00 9.95 ? 180 ASP A OD1 1 ATOM 723 O OD2 . ASP A 1 92 ? -9.665 -6.638 6.428 1.00 13.30 ? 180 ASP A OD2 1 ATOM 724 N N . CYS A 1 93 ? -10.571 -8.867 1.631 1.00 9.35 ? 181 CYS A N 1 ATOM 725 C CA . CYS A 1 93 ? -11.499 -9.950 1.390 1.00 8.88 ? 181 CYS A CA 1 ATOM 726 C C . CYS A 1 93 ? -11.297 -11.180 2.277 1.00 9.28 ? 181 CYS A C 1 ATOM 727 O O . CYS A 1 93 ? -12.220 -11.949 2.470 1.00 9.36 ? 181 CYS A O 1 ATOM 728 C CB . CYS A 1 93 ? -11.525 -10.349 -0.094 1.00 9.97 ? 181 CYS A CB 1 ATOM 729 S SG . CYS A 1 93 ? -9.928 -10.957 -0.727 1.00 12.04 ? 181 CYS A SG 1 ATOM 730 N N . ALA A 1 94 ? -10.109 -11.365 2.820 1.00 8.85 ? 182 ALA A N 1 ATOM 731 C CA . ALA A 1 94 ? -9.836 -12.542 3.642 1.00 9.23 ? 182 ALA A CA 1 ATOM 732 C C . ALA A 1 94 ? -9.964 -12.263 5.140 1.00 10.01 ? 182 ALA A C 1 ATOM 733 O O . ALA A 1 94 ? -9.652 -13.135 5.969 1.00 11.23 ? 182 ALA A O 1 ATOM 734 C CB . ALA A 1 94 ? -8.415 -13.113 3.319 1.00 9.36 ? 182 ALA A CB 1 ATOM 735 N N . ALA A 1 95 ? -10.431 -11.082 5.503 1.00 9.05 ? 183 ALA A N 1 ATOM 736 C CA . ALA A 1 95 ? -10.557 -10.744 6.913 1.00 9.12 ? 183 ALA A CA 1 ATOM 737 C C . ALA A 1 95 ? -11.799 -9.887 7.128 1.00 10.02 ? 183 ALA A C 1 ATOM 738 O O . ALA A 1 95 ? -12.539 -9.573 6.166 1.00 8.79 ? 183 ALA A O 1 ATOM 739 C CB . ALA A 1 95 ? -9.327 -10.067 7.368 1.00 9.88 ? 183 ALA A CB 1 ATOM 740 N N . ALA A 1 96 ? -12.098 -9.594 8.389 1.00 7.66 ? 184 ALA A N 1 ATOM 741 C CA . ALA A 1 96 ? -13.243 -8.777 8.715 1.00 8.84 ? 184 ALA A CA 1 ATOM 742 C C . ALA A 1 96 ? -12.891 -7.351 9.146 1.00 8.16 ? 184 ALA A C 1 ATOM 743 O O . ALA A 1 96 ? -13.762 -6.466 9.043 1.00 8.51 ? 184 ALA A O 1 ATOM 744 C CB . ALA A 1 96 ? -14.063 -9.437 9.818 1.00 9.43 ? 184 ALA A CB 1 ATOM 745 N N . ALA A 1 97 ? -11.657 -7.143 9.610 1.00 7.60 ? 185 ALA A N 1 ATOM 746 C CA . ALA A 1 97 ? -11.331 -5.949 10.403 1.00 7.54 ? 185 ALA A CA 1 ATOM 747 C C . ALA A 1 97 ? -11.347 -4.652 9.612 1.00 7.06 ? 185 ALA A C 1 ATOM 748 O O . ALA A 1 97 ? -11.686 -3.629 10.153 1.00 6.68 ? 185 ALA A O 1 ATOM 749 C CB . ALA A 1 97 ? -9.978 -6.096 11.076 1.00 8.88 ? 185 ALA A CB 1 ATOM 750 N N . SER A 1 98 ? -10.939 -4.723 8.333 1.00 6.87 ? 186 SER A N 1 ATOM 751 C CA . SER A 1 98 ? -10.821 -3.530 7.511 1.00 7.49 ? 186 SER A CA 1 ATOM 752 C C . SER A 1 98 ? -11.745 -3.584 6.280 1.00 7.99 ? 186 SER A C 1 ATOM 753 O O . SER A 1 98 ? -11.478 -2.915 5.280 1.00 7.66 ? 186 SER A O 1 ATOM 754 C CB . SER A 1 98 ? -9.382 -3.301 7.119 1.00 7.56 ? 186 SER A CB 1 ATOM 755 O OG . SER A 1 98 ? -8.651 -2.717 8.214 1.00 10.73 ? 186 SER A OG 1 ATOM 756 N N . ASN A 1 99 ? -12.865 -4.285 6.415 1.00 8.40 ? 187 ASN A N 1 ATOM 757 C CA . ASN A 1 99 ? -13.930 -4.186 5.410 1.00 8.19 ? 187 ASN A CA 1 ATOM 758 C C . ASN A 1 99 ? -14.181 -2.691 5.138 1.00 9.33 ? 187 ASN A C 1 ATOM 759 O O . ASN A 1 99 ? -14.188 -1.862 6.053 1.00 10.30 ? 187 ASN A O 1 ATOM 760 C CB . ASN A 1 99 ? -15.226 -4.842 5.863 1.00 9.87 ? 187 ASN A CB 1 ATOM 761 C CG . ASN A 1 99 ? -16.256 -4.961 4.709 1.00 12.13 ? 187 ASN A CG 1 ATOM 762 O OD1 . ASN A 1 99 ? -15.874 -4.995 3.519 1.00 12.94 ? 187 ASN A OD1 1 ATOM 763 N ND2 . ASN A 1 99 ? -17.550 -5.048 5.049 1.00 14.71 ? 187 ASN A ND2 1 ATOM 764 N N . GLY A 1 100 ? -14.393 -2.342 3.879 1.00 10.10 ? 188 GLY A N 1 ATOM 765 C CA . GLY A 1 100 ? -14.587 -0.965 3.479 1.00 8.77 ? 188 GLY A CA 1 ATOM 766 C C . GLY A 1 100 ? -16.013 -0.558 3.188 1.00 8.92 ? 188 GLY A C 1 ATOM 767 O O . GLY A 1 100 ? -16.974 -1.317 3.360 1.00 7.34 ? 188 GLY A O 1 ATOM 768 N N . GLU A 1 101 ? -16.140 0.672 2.707 1.00 8.11 ? 189 GLU A N 1 ATOM 769 C CA . GLU A 1 101 ? -17.419 1.319 2.513 1.00 7.90 ? 189 GLU A CA 1 ATOM 770 C C . GLU A 1 101 ? -18.227 0.839 1.309 1.00 8.54 ? 189 GLU A C 1 ATOM 771 O O . GLU A 1 101 ? -19.472 0.936 1.309 1.00 7.26 ? 189 GLU A O 1 ATOM 772 C CB . GLU A 1 101 ? -17.223 2.841 2.458 1.00 7.54 ? 189 GLU A CB 1 ATOM 773 C CG . GLU A 1 101 ? -16.559 3.294 1.175 1.00 9.40 ? 189 GLU A CG 1 ATOM 774 C CD . GLU A 1 101 ? -16.197 4.765 1.187 1.00 11.26 ? 189 GLU A CD 1 ATOM 775 O OE1 . GLU A 1 101 ? -16.829 5.524 1.972 1.00 10.59 ? 189 GLU A OE1 1 ATOM 776 O OE2 . GLU A 1 101 ? -15.262 5.136 0.425 1.00 8.40 ? 189 GLU A OE2 1 ATOM 777 N N . TRP A 1 102 ? -17.536 0.261 0.334 1.00 8.70 ? 190 TRP A N 1 ATOM 778 C CA . TRP A 1 102 ? -18.144 -0.154 -0.926 1.00 8.93 ? 190 TRP A CA 1 ATOM 779 C C . TRP A 1 102 ? -18.158 -1.678 -1.133 1.00 9.22 ? 190 TRP A C 1 ATOM 780 O O . TRP A 1 102 ? -17.244 -2.400 -0.744 1.00 8.52 ? 190 TRP A O 1 ATOM 781 C CB . TRP A 1 102 ? -17.409 0.496 -2.097 1.00 8.89 ? 190 TRP A CB 1 ATOM 782 C CG . TRP A 1 102 ? -17.643 1.980 -2.176 1.00 7.23 ? 190 TRP A CG 1 ATOM 783 C CD1 . TRP A 1 102 ? -18.707 2.669 -1.692 1.00 11.61 ? 190 TRP A CD1 1 ATOM 784 C CD2 . TRP A 1 102 ? -16.783 2.923 -2.761 1.00 7.05 ? 190 TRP A CD2 1 ATOM 785 N NE1 . TRP A 1 102 ? -18.554 4.004 -1.930 1.00 10.08 ? 190 TRP A NE1 1 ATOM 786 C CE2 . TRP A 1 102 ? -17.385 4.189 -2.613 1.00 8.93 ? 190 TRP A CE2 1 ATOM 787 C CE3 . TRP A 1 102 ? -15.549 2.837 -3.388 1.00 6.78 ? 190 TRP A CE3 1 ATOM 788 C CZ2 . TRP A 1 102 ? -16.797 5.364 -3.088 1.00 8.14 ? 190 TRP A CZ2 1 ATOM 789 C CZ3 . TRP A 1 102 ? -14.966 3.994 -3.893 1.00 7.62 ? 190 TRP A CZ3 1 ATOM 790 C CH2 . TRP A 1 102 ? -15.601 5.248 -3.736 1.00 7.28 ? 190 TRP A CH2 1 ATOM 791 N N . ALA A 1 103 ? -19.206 -2.134 -1.779 1.00 8.84 ? 191 ALA A N 1 ATOM 792 C CA . ALA A 1 103 ? -19.428 -3.528 -2.076 1.00 8.53 ? 191 ALA A CA 1 ATOM 793 C C . ALA A 1 103 ? -19.669 -3.701 -3.544 1.00 9.29 ? 191 ALA A C 1 ATOM 794 O O . ALA A 1 103 ? -20.374 -2.890 -4.169 1.00 8.55 ? 191 ALA A O 1 ATOM 795 C CB . ALA A 1 103 ? -20.656 -4.042 -1.312 1.00 9.40 ? 191 ALA A CB 1 ATOM 796 N N . ILE A 1 104 ? -19.107 -4.756 -4.110 1.00 8.98 ? 192 ILE A N 1 ATOM 797 C CA . ILE A 1 104 ? -19.304 -5.062 -5.514 1.00 9.59 ? 192 ILE A CA 1 ATOM 798 C C . ILE A 1 104 ? -20.832 -5.147 -5.810 1.00 9.47 ? 192 ILE A C 1 ATOM 799 O O . ILE A 1 104 ? -21.315 -4.651 -6.807 1.00 10.78 ? 192 ILE A O 1 ATOM 800 C CB . ILE A 1 104 ? -18.553 -6.376 -5.879 1.00 8.98 ? 192 ILE A CB 1 ATOM 801 C CG1 . ILE A 1 104 ? -17.027 -6.175 -5.719 1.00 11.57 ? 192 ILE A CG1 1 ATOM 802 C CG2 . ILE A 1 104 ? -18.884 -6.819 -7.293 1.00 10.83 ? 192 ILE A CG2 1 ATOM 803 C CD1 . ILE A 1 104 ? -16.221 -7.437 -5.865 1.00 12.51 ? 192 ILE A CD1 1 ATOM 804 N N . ALA A 1 105 ? -21.595 -5.734 -4.899 1.00 9.74 ? 193 ALA A N 1 ATOM 805 C CA . ALA A 1 105 ? -23.027 -5.931 -5.122 1.00 10.15 ? 193 ALA A CA 1 ATOM 806 C C . ALA A 1 105 ? -23.849 -4.652 -5.003 1.00 9.62 ? 193 ALA A C 1 ATOM 807 O O . ALA A 1 105 ? -25.054 -4.682 -5.257 1.00 8.85 ? 193 ALA A O 1 ATOM 808 C CB . ALA A 1 105 ? -23.565 -6.985 -4.149 1.00 11.19 ? 193 ALA A CB 1 ATOM 809 N N . ASN A 1 106 ? -23.234 -3.543 -4.586 1.00 8.76 ? 194 ASN A N 1 ATOM 810 C CA . ASN A 1 106 ? -23.927 -2.248 -4.537 1.00 9.17 ? 194 ASN A CA 1 ATOM 811 C C . ASN A 1 106 ? -23.138 -1.155 -5.261 1.00 9.05 ? 194 ASN A C 1 ATOM 812 O O . ASN A 1 106 ? -22.786 -0.133 -4.673 1.00 9.58 ? 194 ASN A O 1 ATOM 813 C CB . ASN A 1 106 ? -24.238 -1.844 -3.115 1.00 9.33 ? 194 ASN A CB 1 ATOM 814 C CG . ASN A 1 106 ? -25.266 -0.731 -3.039 1.00 9.89 ? 194 ASN A CG 1 ATOM 815 O OD1 . ASN A 1 106 ? -26.189 -0.645 -3.870 1.00 11.73 ? 194 ASN A OD1 1 ATOM 816 N ND2 . ASN A 1 106 ? -25.130 0.121 -2.010 1.00 12.77 ? 194 ASN A ND2 1 ATOM 817 N N . ASN A 1 107 ? -22.881 -1.428 -6.535 1.00 9.00 ? 195 ASN A N 1 ATOM 818 C CA . ASN A 1 107 ? -22.292 -0.481 -7.479 1.00 9.44 ? 195 ASN A CA 1 ATOM 819 C C . ASN A 1 107 ? -20.866 -0.147 -7.154 1.00 8.90 ? 195 ASN A C 1 ATOM 820 O O . ASN A 1 107 ? -20.362 0.912 -7.547 1.00 9.37 ? 195 ASN A O 1 ATOM 821 C CB . ASN A 1 107 ? -23.119 0.818 -7.573 1.00 9.98 ? 195 ASN A CB 1 ATOM 822 C CG . ASN A 1 107 ? -22.978 1.498 -8.908 1.00 10.98 ? 195 ASN A CG 1 ATOM 823 O OD1 . ASN A 1 107 ? -22.841 0.836 -9.945 1.00 14.31 ? 195 ASN A OD1 1 ATOM 824 N ND2 . ASN A 1 107 ? -23.014 2.834 -8.898 1.00 15.94 ? 195 ASN A ND2 1 ATOM 825 N N . GLY A 1 108 ? -20.200 -1.052 -6.441 1.00 8.34 ? 196 GLY A N 1 ATOM 826 C CA . GLY A 1 108 ? -18.821 -0.808 -6.038 1.00 8.54 ? 196 GLY A CA 1 ATOM 827 C C . GLY A 1 108 ? -17.813 -0.563 -7.159 1.00 9.01 ? 196 GLY A C 1 ATOM 828 O O . GLY A 1 108 ? -16.909 0.282 -7.017 1.00 9.12 ? 196 GLY A O 1 ATOM 829 N N . VAL A 1 109 ? -17.932 -1.304 -8.252 1.00 10.14 ? 197 VAL A N 1 ATOM 830 C CA . VAL A 1 109 ? -17.004 -1.168 -9.392 1.00 10.65 ? 197 VAL A CA 1 ATOM 831 C C . VAL A 1 109 ? -17.076 0.256 -9.974 1.00 9.62 ? 197 VAL A C 1 ATOM 832 O O . VAL A 1 109 ? -16.065 0.952 -10.051 1.00 9.84 ? 197 VAL A O 1 ATOM 833 C CB . VAL A 1 109 ? -17.266 -2.211 -10.518 1.00 10.38 ? 197 VAL A CB 1 ATOM 834 C CG1 . VAL A 1 109 ? -16.548 -1.855 -11.776 1.00 12.30 ? 197 VAL A CG1 1 ATOM 835 C CG2 . VAL A 1 109 ? -16.855 -3.616 -10.084 1.00 14.42 ? 197 VAL A CG2 1 ATOM 836 N N . ASN A 1 110 ? -18.271 0.699 -10.323 1.00 9.19 ? 198 ASN A N 1 ATOM 837 C CA . ASN A 1 110 ? -18.445 2.083 -10.756 1.00 8.69 ? 198 ASN A CA 1 ATOM 838 C C . ASN A 1 110 ? -17.952 3.108 -9.735 1.00 8.36 ? 198 ASN A C 1 ATOM 839 O O . ASN A 1 110 ? -17.319 4.113 -10.126 1.00 7.42 ? 198 ASN A O 1 ATOM 840 C CB . ASN A 1 110 ? -19.895 2.380 -11.100 1.00 9.33 ? 198 ASN A CB 1 ATOM 841 C CG . ASN A 1 110 ? -20.333 1.734 -12.395 1.00 10.77 ? 198 ASN A CG 1 ATOM 842 O OD1 . ASN A 1 110 ? -19.485 1.413 -13.231 1.00 14.24 ? 198 ASN A OD1 1 ATOM 843 N ND2 . ASN A 1 110 ? -21.651 1.475 -12.545 1.00 14.25 ? 198 ASN A ND2 1 ATOM 844 N N . ASN A 1 111 ? -18.254 2.897 -8.455 1.00 6.93 ? 199 ASN A N 1 ATOM 845 C CA . ASN A 1 111 ? -17.829 3.839 -7.411 1.00 6.95 ? 199 ASN A CA 1 ATOM 846 C C . ASN A 1 111 ? -16.288 3.962 -7.415 1.00 6.14 ? 199 ASN A C 1 ATOM 847 O O . ASN A 1 111 ? -15.714 5.068 -7.294 1.00 7.54 ? 199 ASN A O 1 ATOM 848 C CB . ASN A 1 111 ? -18.251 3.374 -6.012 1.00 6.05 ? 199 ASN A CB 1 ATOM 849 C CG . ASN A 1 111 ? -19.740 3.460 -5.770 1.00 6.64 ? 199 ASN A CG 1 ATOM 850 O OD1 . ASN A 1 111 ? -20.475 3.991 -6.577 1.00 8.01 ? 199 ASN A OD1 1 ATOM 851 N ND2 . ASN A 1 111 ? -20.184 2.869 -4.648 1.00 7.62 ? 199 ASN A ND2 1 ATOM 852 N N . TYR A 1 112 ? -15.629 2.826 -7.555 1.00 5.94 ? 200 TYR A N 1 ATOM 853 C CA . TYR A 1 112 ? -14.142 2.776 -7.503 1.00 5.96 ? 200 TYR A CA 1 ATOM 854 C C . TYR A 1 112 ? -13.534 3.440 -8.720 1.00 5.86 ? 200 TYR A C 1 ATOM 855 O O . TYR A 1 112 ? -12.588 4.225 -8.617 1.00 5.38 ? 200 TYR A O 1 ATOM 856 C CB . TYR A 1 112 ? -13.633 1.337 -7.358 1.00 6.07 ? 200 TYR A CB 1 ATOM 857 C CG . TYR A 1 112 ? -12.157 1.252 -7.058 1.00 6.49 ? 200 TYR A CG 1 ATOM 858 C CD1 . TYR A 1 112 ? -11.677 1.424 -5.747 1.00 6.43 ? 200 TYR A CD1 1 ATOM 859 C CD2 . TYR A 1 112 ? -11.227 1.060 -8.077 1.00 6.06 ? 200 TYR A CD2 1 ATOM 860 C CE1 . TYR A 1 112 ? -10.327 1.386 -5.443 1.00 6.95 ? 200 TYR A CE1 1 ATOM 861 C CE2 . TYR A 1 112 ? -9.842 1.006 -7.776 1.00 7.79 ? 200 TYR A CE2 1 ATOM 862 C CZ . TYR A 1 112 ? -9.415 1.156 -6.469 1.00 7.24 ? 200 TYR A CZ 1 ATOM 863 O OH . TYR A 1 112 ? -8.076 1.073 -6.170 1.00 7.11 ? 200 TYR A OH 1 ATOM 864 N N . LYS A 1 113 ? -14.059 3.144 -9.900 1.00 5.76 ? 201 LYS A N 1 ATOM 865 C CA . LYS A 1 113 ? -13.541 3.823 -11.112 1.00 5.44 ? 201 LYS A CA 1 ATOM 866 C C . LYS A 1 113 ? -13.661 5.340 -10.982 1.00 5.89 ? 201 LYS A C 1 ATOM 867 O O . LYS A 1 113 ? -12.753 6.077 -11.378 1.00 6.03 ? 201 LYS A O 1 ATOM 868 C CB . LYS A 1 113 ? -14.248 3.323 -12.355 1.00 5.97 ? 201 LYS A CB 1 ATOM 869 C CG . LYS A 1 113 ? -13.852 1.898 -12.726 1.00 6.83 ? 201 LYS A CG 1 ATOM 870 C CD . LYS A 1 113 ? -14.623 1.384 -13.953 1.00 10.04 ? 201 LYS A CD 1 ATOM 871 C CE . LYS A 1 113 ? -14.078 0.067 -14.466 1.00 14.09 ? 201 LYS A CE 1 ATOM 872 N NZ . LYS A 1 113 ? -14.768 -0.411 -15.710 1.00 15.19 ? 201 LYS A NZ 1 ATOM 873 N N . ALA A 1 114 ? -14.778 5.829 -10.447 1.00 5.97 ? 202 ALA A N 1 ATOM 874 C CA . ALA A 1 114 ? -14.931 7.271 -10.235 1.00 6.01 ? 202 ALA A CA 1 ATOM 875 C C . ALA A 1 114 ? -13.912 7.868 -9.249 1.00 4.79 ? 202 ALA A C 1 ATOM 876 O O . ALA A 1 114 ? -13.397 8.976 -9.452 1.00 4.68 ? 202 ALA A O 1 ATOM 877 C CB . ALA A 1 114 ? -16.394 7.592 -9.816 1.00 6.37 ? 202 ALA A CB 1 ATOM 878 N N . TYR A 1 115 ? -13.705 7.157 -8.132 1.00 6.44 ? 203 TYR A N 1 ATOM 879 C CA . TYR A 1 115 ? -12.668 7.464 -7.135 1.00 6.67 ? 203 TYR A CA 1 ATOM 880 C C . TYR A 1 115 ? -11.287 7.552 -7.791 1.00 6.74 ? 203 TYR A C 1 ATOM 881 O O . TYR A 1 115 ? -10.565 8.519 -7.608 1.00 5.81 ? 203 TYR A O 1 ATOM 882 C CB . TYR A 1 115 ? -12.730 6.369 -6.107 1.00 7.80 ? 203 TYR A CB 1 ATOM 883 C CG . TYR A 1 115 ? -11.574 6.152 -5.141 1.00 7.20 ? 203 TYR A CG 1 ATOM 884 C CD1 . TYR A 1 115 ? -11.505 6.858 -3.958 1.00 9.57 ? 203 TYR A CD1 1 ATOM 885 C CD2 . TYR A 1 115 ? -10.657 5.139 -5.361 1.00 7.97 ? 203 TYR A CD2 1 ATOM 886 C CE1 . TYR A 1 115 ? -10.520 6.572 -3.003 1.00 10.12 ? 203 TYR A CE1 1 ATOM 887 C CE2 . TYR A 1 115 ? -9.712 4.834 -4.422 1.00 9.13 ? 203 TYR A CE2 1 ATOM 888 C CZ . TYR A 1 115 ? -9.629 5.570 -3.256 1.00 9.71 ? 203 TYR A CZ 1 ATOM 889 O OH . TYR A 1 115 ? -8.625 5.243 -2.364 1.00 8.72 ? 203 TYR A OH 1 ATOM 890 N N . ILE A 1 116 ? -10.929 6.560 -8.604 1.00 6.60 ? 204 ILE A N 1 ATOM 891 C CA . ILE A 1 116 ? -9.631 6.599 -9.282 1.00 5.82 ? 204 ILE A CA 1 ATOM 892 C C . ILE A 1 116 ? -9.599 7.797 -10.252 1.00 5.09 ? 204 ILE A C 1 ATOM 893 O O . ILE A 1 116 ? -8.565 8.508 -10.327 1.00 6.58 ? 204 ILE A O 1 ATOM 894 C CB . ILE A 1 116 ? -9.379 5.288 -10.086 1.00 6.09 ? 204 ILE A CB 1 ATOM 895 C CG1 . ILE A 1 116 ? -9.190 4.075 -9.166 1.00 7.79 ? 204 ILE A CG1 1 ATOM 896 C CG2 . ILE A 1 116 ? -8.251 5.460 -11.068 1.00 7.84 ? 204 ILE A CG2 1 ATOM 897 C CD1 . ILE A 1 116 ? -8.039 4.187 -8.228 1.00 8.39 ? 204 ILE A CD1 1 ATOM 898 N N . ASN A 1 117 ? -10.673 8.031 -11.002 1.00 5.48 ? 205 ASN A N 1 ATOM 899 C CA . ASN A 1 117 ? -10.708 9.157 -11.928 1.00 5.31 ? 205 ASN A CA 1 ATOM 900 C C . ASN A 1 117 ? -10.495 10.478 -11.198 1.00 5.88 ? 205 ASN A C 1 ATOM 901 O O . ASN A 1 117 ? -9.819 11.369 -11.704 1.00 5.72 ? 205 ASN A O 1 ATOM 902 C CB . ASN A 1 117 ? -12.038 9.217 -12.693 1.00 5.77 ? 205 ASN A CB 1 ATOM 903 C CG . ASN A 1 117 ? -12.259 8.011 -13.600 1.00 7.62 ? 205 ASN A CG 1 ATOM 904 O OD1 . ASN A 1 117 ? -11.319 7.298 -13.962 1.00 9.90 ? 205 ASN A OD1 1 ATOM 905 N ND2 . ASN A 1 117 ? -13.518 7.786 -13.983 1.00 6.68 ? 205 ASN A ND2 1 ATOM 906 N N . ARG A 1 118 ? -11.088 10.614 -10.021 1.00 4.90 ? 206 ARG A N 1 ATOM 907 C CA . ARG A 1 118 ? -10.976 11.859 -9.287 1.00 5.50 ? 206 ARG A CA 1 ATOM 908 C C . ARG A 1 118 ? -9.577 12.036 -8.727 1.00 5.97 ? 206 ARG A C 1 ATOM 909 O O . ARG A 1 118 ? -9.014 13.139 -8.787 1.00 5.87 ? 206 ARG A O 1 ATOM 910 C CB . ARG A 1 118 ? -12.009 11.953 -8.182 1.00 7.21 ? 206 ARG A CB 1 ATOM 911 C CG . ARG A 1 118 ? -12.015 13.323 -7.523 1.00 8.21 ? 206 ARG A CG 1 ATOM 912 C CD . ARG A 1 118 ? -12.378 14.486 -8.435 1.00 13.22 ? 206 ARG A CD 1 ATOM 913 N NE . ARG A 1 118 ? -12.171 15.714 -7.675 1.00 14.88 ? 206 ARG A NE 1 ATOM 914 C CZ . ARG A 1 118 ? -11.765 16.876 -8.182 1.00 19.08 ? 206 ARG A CZ 1 ATOM 915 N NH1 . ARG A 1 118 ? -11.551 17.031 -9.479 1.00 22.93 ? 206 ARG A NH1 1 ATOM 916 N NH2 . ARG A 1 118 ? -11.618 17.907 -7.385 1.00 23.12 ? 206 ARG A NH2 1 ATOM 917 N N . ILE A 1 119 ? -8.983 10.959 -8.264 1.00 6.04 ? 207 ILE A N 1 ATOM 918 C CA . ILE A 1 119 ? -7.611 11.017 -7.788 1.00 6.03 ? 207 ILE A CA 1 ATOM 919 C C . ILE A 1 119 ? -6.714 11.468 -8.952 1.00 6.71 ? 207 ILE A C 1 ATOM 920 O O . ILE A 1 119 ? -5.880 12.370 -8.793 1.00 5.89 ? 207 ILE A O 1 ATOM 921 C CB . ILE A 1 119 ? -7.149 9.674 -7.241 1.00 6.37 ? 207 ILE A CB 1 ATOM 922 C CG1 . ILE A 1 119 ? -7.912 9.370 -5.935 1.00 8.10 ? 207 ILE A CG1 1 ATOM 923 C CG2 . ILE A 1 119 ? -5.667 9.705 -6.980 1.00 8.96 ? 207 ILE A CG2 1 ATOM 924 C CD1 . ILE A 1 119 ? -7.766 7.936 -5.505 1.00 8.11 ? 207 ILE A CD1 1 ATOM 925 N N . ARG A 1 120 ? -6.926 10.901 -10.133 1.00 5.73 ? 208 ARG A N 1 ATOM 926 C CA . ARG A 1 120 ? -6.155 11.295 -11.305 1.00 6.37 ? 208 ARG A CA 1 ATOM 927 C C . ARG A 1 120 ? -6.266 12.798 -11.554 1.00 6.53 ? 208 ARG A C 1 ATOM 928 O O . ARG A 1 120 ? -5.276 13.470 -11.795 1.00 5.29 ? 208 ARG A O 1 ATOM 929 C CB . ARG A 1 120 ? -6.577 10.484 -12.546 1.00 6.50 ? 208 ARG A CB 1 ATOM 930 C CG . ARG A 1 120 ? -6.010 10.987 -13.837 1.00 7.10 ? 208 ARG A CG 1 ATOM 931 C CD . ARG A 1 120 ? -6.614 10.333 -15.050 1.00 6.95 ? 208 ARG A CD 1 ATOM 932 N NE . ARG A 1 120 ? -6.141 10.929 -16.283 1.00 8.17 ? 208 ARG A NE 1 ATOM 933 C CZ . ARG A 1 120 ? -5.065 10.541 -16.947 1.00 10.56 ? 208 ARG A CZ 1 ATOM 934 N NH1 . ARG A 1 120 ? -4.349 9.528 -16.532 1.00 10.57 ? 208 ARG A NH1 1 ATOM 935 N NH2 . ARG A 1 120 ? -4.718 11.158 -18.078 1.00 11.67 ? 208 ARG A NH2 1 ATOM 936 N N . GLU A 1 121 ? -7.492 13.320 -11.569 1.00 6.17 ? 209 GLU A N 1 ATOM 937 C CA . GLU A 1 121 ? -7.687 14.746 -11.800 1.00 7.01 ? 209 GLU A CA 1 ATOM 938 C C . GLU A 1 121 ? -6.957 15.621 -10.786 1.00 6.11 ? 209 GLU A C 1 ATOM 939 O O . GLU A 1 121 ? -6.400 16.638 -11.167 1.00 7.26 ? 209 GLU A O 1 ATOM 940 C CB . GLU A 1 121 ? -9.167 15.086 -11.868 1.00 8.09 ? 209 GLU A CB 1 ATOM 941 C CG . GLU A 1 121 ? -9.799 14.531 -13.170 1.00 13.50 ? 209 GLU A CG 1 ATOM 942 C CD . GLU A 1 121 ? -8.971 14.758 -14.495 1.00 20.53 ? 209 GLU A CD 1 ATOM 943 O OE1 . GLU A 1 121 ? -8.572 15.947 -14.829 1.00 22.16 ? 209 GLU A OE1 1 ATOM 944 O OE2 . GLU A 1 121 ? -8.709 13.764 -15.271 1.00 23.53 ? 209 GLU A OE2 1 ATOM 945 N N . ILE A 1 122 ? -6.965 15.193 -9.530 1.00 6.34 ? 210 ILE A N 1 ATOM 946 C CA . ILE A 1 122 ? -6.315 15.932 -8.446 1.00 6.26 ? 210 ILE A CA 1 ATOM 947 C C . ILE A 1 122 ? -4.797 15.865 -8.624 1.00 6.26 ? 210 ILE A C 1 ATOM 948 O O . ILE A 1 122 ? -4.113 16.904 -8.539 1.00 6.72 ? 210 ILE A O 1 ATOM 949 C CB . ILE A 1 122 ? -6.762 15.443 -7.099 1.00 6.00 ? 210 ILE A CB 1 ATOM 950 C CG1 . ILE A 1 122 ? -8.215 15.927 -6.831 1.00 7.90 ? 210 ILE A CG1 1 ATOM 951 C CG2 . ILE A 1 122 ? -5.878 16.008 -6.020 1.00 9.01 ? 210 ILE A CG2 1 ATOM 952 C CD1 . ILE A 1 122 ? -8.876 15.164 -5.795 1.00 8.44 ? 210 ILE A CD1 1 ATOM 953 N N . LEU A 1 123 ? -4.292 14.678 -8.957 1.00 5.65 ? 211 LEU A N 1 ATOM 954 C CA . LEU A 1 123 ? -2.837 14.544 -9.189 1.00 5.94 ? 211 LEU A CA 1 ATOM 955 C C . LEU A 1 123 ? -2.407 15.321 -10.426 1.00 6.67 ? 211 LEU A C 1 ATOM 956 O O . LEU A 1 123 ? -1.305 15.890 -10.421 1.00 7.20 ? 211 LEU A O 1 ATOM 957 C CB . LEU A 1 123 ? -2.410 13.084 -9.279 1.00 5.73 ? 211 LEU A CB 1 ATOM 958 C CG . LEU A 1 123 ? -2.674 12.193 -8.052 1.00 6.09 ? 211 LEU A CG 1 ATOM 959 C CD1 . LEU A 1 123 ? -2.240 10.769 -8.262 1.00 10.20 ? 211 LEU A CD1 1 ATOM 960 C CD2 . LEU A 1 123 ? -1.996 12.756 -6.818 1.00 7.94 ? 211 LEU A CD2 1 ATOM 961 N N . ILE A 1 124 ? -3.235 15.372 -11.464 1.00 6.56 ? 212 ILE A N 1 ATOM 962 C CA . ILE A 1 124 ? -2.899 16.231 -12.614 1.00 6.66 ? 212 ILE A CA 1 ATOM 963 C C . ILE A 1 124 ? -2.802 17.701 -12.190 1.00 7.32 ? 212 ILE A C 1 ATOM 964 O O . ILE A 1 124 ? -1.851 18.417 -12.607 1.00 7.55 ? 212 ILE A O 1 ATOM 965 C CB . ILE A 1 124 ? -3.816 16.011 -13.811 1.00 7.51 ? 212 ILE A CB 1 ATOM 966 C CG1 . ILE A 1 124 ? -3.516 14.646 -14.461 1.00 6.08 ? 212 ILE A CG1 1 ATOM 967 C CG2 . ILE A 1 124 ? -3.614 17.105 -14.858 1.00 7.02 ? 212 ILE A CG2 1 ATOM 968 C CD1 . ILE A 1 124 ? -4.656 14.110 -15.278 1.00 7.73 ? 212 ILE A CD1 1 ATOM 969 N N . SER A 1 125 ? -3.731 18.143 -11.352 1.00 7.52 ? 213 SER A N 1 ATOM 970 C CA . SER A 1 125 ? -3.773 19.556 -10.931 1.00 8.58 ? 213 SER A CA 1 ATOM 971 C C . SER A 1 125 ? -2.563 19.888 -10.079 1.00 7.71 ? 213 SER A C 1 ATOM 972 O O . SER A 1 125 ? -2.070 21.030 -10.145 1.00 8.37 ? 213 SER A O 1 ATOM 973 C CB A SER A 1 125 ? -5.069 19.949 -10.212 0.55 8.83 ? 213 SER A CB 1 ATOM 974 C CB B SER A 1 125 ? -5.039 19.854 -10.123 0.45 8.62 ? 213 SER A CB 1 ATOM 975 O OG A SER A 1 125 ? -5.139 19.420 -8.923 0.55 12.70 ? 213 SER A OG 1 ATOM 976 O OG B SER A 1 125 ? -6.194 19.444 -10.842 0.45 12.53 ? 213 SER A OG 1 ATOM 977 N N . PHE A 1 126 ? -2.046 18.875 -9.399 1.00 7.00 ? 214 PHE A N 1 ATOM 978 C CA . PHE A 1 126 ? -0.845 18.990 -8.556 1.00 7.08 ? 214 PHE A CA 1 ATOM 979 C C . PHE A 1 126 ? 0.337 18.251 -9.178 1.00 7.11 ? 214 PHE A C 1 ATOM 980 O O . PHE A 1 126 ? 1.177 17.666 -8.469 1.00 7.07 ? 214 PHE A O 1 ATOM 981 C CB . PHE A 1 126 ? -1.126 18.492 -7.154 1.00 6.74 ? 214 PHE A CB 1 ATOM 982 C CG . PHE A 1 126 ? -1.981 19.414 -6.363 1.00 6.49 ? 214 PHE A CG 1 ATOM 983 C CD1 . PHE A 1 126 ? -1.417 20.508 -5.712 1.00 6.60 ? 214 PHE A CD1 1 ATOM 984 C CD2 . PHE A 1 126 ? -3.334 19.171 -6.238 1.00 8.27 ? 214 PHE A CD2 1 ATOM 985 C CE1 . PHE A 1 126 ? -2.227 21.389 -4.997 1.00 8.82 ? 214 PHE A CE1 1 ATOM 986 C CE2 . PHE A 1 126 ? -4.163 20.046 -5.512 1.00 10.41 ? 214 PHE A CE2 1 ATOM 987 C CZ . PHE A 1 126 ? -3.588 21.149 -4.868 1.00 10.66 ? 214 PHE A CZ 1 ATOM 988 N N . SER A 1 127 ? 0.466 18.350 -10.493 1.00 7.31 ? 215 SER A N 1 ATOM 989 C CA . SER A 1 127 ? 1.613 17.735 -11.212 1.00 8.15 ? 215 SER A CA 1 ATOM 990 C C . SER A 1 127 ? 2.965 18.316 -10.818 1.00 7.91 ? 215 SER A C 1 ATOM 991 O O . SER A 1 127 ? 3.983 17.709 -11.077 1.00 7.84 ? 215 SER A O 1 ATOM 992 C CB A SER A 1 127 ? 1.477 17.953 -12.732 0.55 8.53 ? 215 SER A CB 1 ATOM 993 C CB B SER A 1 127 ? 1.444 17.706 -12.757 0.45 8.33 ? 215 SER A CB 1 ATOM 994 O OG A SER A 1 127 ? 0.580 17.049 -13.287 0.55 9.68 ? 215 SER A OG 1 ATOM 995 O OG B SER A 1 127 ? 0.658 18.763 -13.246 0.45 9.99 ? 215 SER A OG 1 ATOM 996 N N . ASP A 1 128 ? 2.966 19.499 -10.199 1.00 6.88 ? 216 ASP A N 1 ATOM 997 C CA . ASP A 1 128 ? 4.190 20.073 -9.637 1.00 7.21 ? 216 ASP A CA 1 ATOM 998 C C . ASP A 1 128 ? 4.683 19.426 -8.333 1.00 6.76 ? 216 ASP A C 1 ATOM 999 O O . ASP A 1 128 ? 5.741 19.793 -7.842 1.00 6.84 ? 216 ASP A O 1 ATOM 1000 C CB . ASP A 1 128 ? 4.034 21.579 -9.439 1.00 6.72 ? 216 ASP A CB 1 ATOM 1001 C CG . ASP A 1 128 ? 2.826 21.946 -8.584 1.00 10.69 ? 216 ASP A CG 1 ATOM 1002 O OD1 . ASP A 1 128 ? 1.764 21.285 -8.735 1.00 9.29 ? 216 ASP A OD1 1 ATOM 1003 O OD2 . ASP A 1 128 ? 2.842 22.913 -7.764 1.00 10.40 ? 216 ASP A OD2 1 ATOM 1004 N N . VAL A 1 129 ? 3.915 18.519 -7.752 1.00 6.21 ? 217 VAL A N 1 ATOM 1005 C CA . VAL A 1 129 ? 4.270 17.856 -6.518 1.00 6.23 ? 217 VAL A CA 1 ATOM 1006 C C . VAL A 1 129 ? 4.564 16.388 -6.797 1.00 7.17 ? 217 VAL A C 1 ATOM 1007 O O . VAL A 1 129 ? 3.664 15.629 -7.179 1.00 8.32 ? 217 VAL A O 1 ATOM 1008 C CB . VAL A 1 129 ? 3.130 17.925 -5.478 1.00 6.29 ? 217 VAL A CB 1 ATOM 1009 C CG1 . VAL A 1 129 ? 3.491 17.104 -4.234 1.00 6.07 ? 217 VAL A CG1 1 ATOM 1010 C CG2 . VAL A 1 129 ? 2.801 19.380 -5.118 1.00 7.08 ? 217 VAL A CG2 1 ATOM 1011 N N . ARG A 1 130 ? 5.821 15.990 -6.594 1.00 6.09 ? 218 ARG A N 1 ATOM 1012 C CA . ARG A 1 130 ? 6.186 14.589 -6.728 1.00 7.12 ? 218 ARG A CA 1 ATOM 1013 C C . ARG A 1 130 ? 5.376 13.729 -5.778 1.00 7.14 ? 218 ARG A C 1 ATOM 1014 O O . ARG A 1 130 ? 5.331 14.003 -4.583 1.00 6.46 ? 218 ARG A O 1 ATOM 1015 C CB . ARG A 1 130 ? 7.679 14.368 -6.485 1.00 6.62 ? 218 ARG A CB 1 ATOM 1016 C CG . ARG A 1 130 ? 8.018 12.909 -6.845 1.00 12.40 ? 218 ARG A CG 1 ATOM 1017 C CD . ARG A 1 130 ? 9.474 12.448 -6.640 1.00 11.84 ? 218 ARG A CD 1 ATOM 1018 N NE . ARG A 1 130 ? 10.400 13.398 -7.265 1.00 12.73 ? 218 ARG A NE 1 ATOM 1019 C CZ . ARG A 1 130 ? 11.717 13.280 -7.236 1.00 11.86 ? 218 ARG A CZ 1 ATOM 1020 N NH1 . ARG A 1 130 ? 12.269 12.285 -6.606 1.00 12.12 ? 218 ARG A NH1 1 ATOM 1021 N NH2 . ARG A 1 130 ? 12.484 14.176 -7.801 1.00 13.21 ? 218 ARG A NH2 1 ATOM 1022 N N . THR A 1 131 ? 4.736 12.697 -6.312 1.00 6.75 ? 219 THR A N 1 ATOM 1023 C CA . THR A 1 131 ? 3.812 11.892 -5.579 1.00 7.03 ? 219 THR A CA 1 ATOM 1024 C C . THR A 1 131 ? 4.167 10.408 -5.717 1.00 7.00 ? 219 THR A C 1 ATOM 1025 O O . THR A 1 131 ? 4.228 9.857 -6.819 1.00 7.85 ? 219 THR A O 1 ATOM 1026 C CB . THR A 1 131 ? 2.393 12.154 -6.056 1.00 8.44 ? 219 THR A CB 1 ATOM 1027 O OG1 . THR A 1 131 ? 2.075 13.529 -5.833 1.00 9.84 ? 219 THR A OG1 1 ATOM 1028 C CG2 . THR A 1 131 ? 1.411 11.363 -5.223 1.00 10.06 ? 219 THR A CG2 1 ATOM 1029 N N . ILE A 1 132 ? 4.288 9.760 -4.581 1.00 6.62 ? 220 ILE A N 1 ATOM 1030 C CA . ILE A 1 132 ? 4.557 8.342 -4.498 1.00 7.91 ? 220 ILE A CA 1 ATOM 1031 C C . ILE A 1 132 ? 3.299 7.628 -3.981 1.00 7.38 ? 220 ILE A C 1 ATOM 1032 O O . ILE A 1 132 ? 2.748 8.006 -2.943 1.00 7.21 ? 220 ILE A O 1 ATOM 1033 C CB . ILE A 1 132 ? 5.736 8.111 -3.559 1.00 8.99 ? 220 ILE A CB 1 ATOM 1034 C CG1 . ILE A 1 132 ? 6.973 8.837 -4.098 1.00 9.90 ? 220 ILE A CG1 1 ATOM 1035 C CG2 . ILE A 1 132 ? 6.000 6.596 -3.372 1.00 11.51 ? 220 ILE A CG2 1 ATOM 1036 C CD1 . ILE A 1 132 ? 8.107 9.155 -3.122 1.00 9.96 ? 220 ILE A CD1 1 ATOM 1037 N N . LEU A 1 133 ? 2.857 6.606 -4.693 1.00 6.81 ? 221 LEU A N 1 ATOM 1038 C CA . LEU A 1 133 ? 1.635 5.889 -4.341 1.00 6.80 ? 221 LEU A CA 1 ATOM 1039 C C . LEU A 1 133 ? 1.868 4.400 -4.044 1.00 7.61 ? 221 LEU A C 1 ATOM 1040 O O . LEU A 1 133 ? 2.665 3.755 -4.741 1.00 7.59 ? 221 LEU A O 1 ATOM 1041 C CB . LEU A 1 133 ? 0.671 5.926 -5.503 1.00 8.11 ? 221 LEU A CB 1 ATOM 1042 C CG . LEU A 1 133 ? 0.271 7.256 -6.108 1.00 8.17 ? 221 LEU A CG 1 ATOM 1043 C CD1 . LEU A 1 133 ? -0.735 7.032 -7.170 1.00 8.19 ? 221 LEU A CD1 1 ATOM 1044 C CD2 . LEU A 1 133 ? -0.388 8.105 -5.056 1.00 10.76 ? 221 LEU A CD2 1 ATOM 1045 N N . VAL A 1 134 ? 1.215 3.901 -2.994 1.00 7.30 ? 222 VAL A N 1 ATOM 1046 C CA . VAL A 1 134 ? 1.081 2.458 -2.771 1.00 6.59 ? 222 VAL A CA 1 ATOM 1047 C C . VAL A 1 134 ? -0.340 2.093 -3.180 1.00 7.40 ? 222 VAL A C 1 ATOM 1048 O O . VAL A 1 134 ? -1.289 2.702 -2.731 1.00 6.73 ? 222 VAL A O 1 ATOM 1049 C CB . VAL A 1 134 ? 1.427 2.036 -1.340 1.00 7.24 ? 222 VAL A CB 1 ATOM 1050 C CG1 . VAL A 1 134 ? 1.004 0.602 -1.117 1.00 7.62 ? 222 VAL A CG1 1 ATOM 1051 C CG2 . VAL A 1 134 ? 2.901 2.182 -1.148 1.00 7.84 ? 222 VAL A CG2 1 ATOM 1052 N N . ILE A 1 135 ? -0.446 1.098 -4.063 1.00 7.38 ? 223 ILE A N 1 ATOM 1053 C CA . ILE A 1 135 ? -1.728 0.680 -4.603 1.00 7.52 ? 223 ILE A CA 1 ATOM 1054 C C . ILE A 1 135 ? -2.257 -0.551 -3.853 1.00 8.28 ? 223 ILE A C 1 ATOM 1055 O O . ILE A 1 135 ? -1.680 -1.628 -3.927 1.00 8.95 ? 223 ILE A O 1 ATOM 1056 C CB . ILE A 1 135 ? -1.676 0.394 -6.116 1.00 6.82 ? 223 ILE A CB 1 ATOM 1057 C CG1 . ILE A 1 135 ? -1.055 1.564 -6.910 1.00 7.62 ? 223 ILE A CG1 1 ATOM 1058 C CG2 . ILE A 1 135 ? -3.083 0.063 -6.613 1.00 8.87 ? 223 ILE A CG2 1 ATOM 1059 C CD1 . ILE A 1 135 ? -1.740 2.926 -6.693 1.00 10.48 ? 223 ILE A CD1 1 ATOM 1060 N N . GLU A 1 136 ? -3.337 -0.322 -3.139 1.00 8.15 ? 224 GLU A N 1 ATOM 1061 C CA . GLU A 1 136 ? -4.221 -1.347 -2.559 1.00 8.20 ? 224 GLU A CA 1 ATOM 1062 C C . GLU A 1 136 ? -3.550 -2.480 -1.807 1.00 8.46 ? 224 GLU A C 1 ATOM 1063 O O . GLU A 1 136 ? -3.549 -3.643 -2.231 1.00 8.47 ? 224 GLU A O 1 ATOM 1064 C CB . GLU A 1 136 ? -5.199 -1.849 -3.599 1.00 8.23 ? 224 GLU A CB 1 ATOM 1065 C CG . GLU A 1 136 ? -6.093 -0.781 -4.193 1.00 9.04 ? 224 GLU A CG 1 ATOM 1066 C CD . GLU A 1 136 ? -7.194 -0.318 -3.256 1.00 9.84 ? 224 GLU A CD 1 ATOM 1067 O OE1 . GLU A 1 136 ? -7.503 -0.997 -2.230 1.00 7.17 ? 224 GLU A OE1 1 ATOM 1068 O OE2 . GLU A 1 136 ? -7.769 0.737 -3.562 1.00 10.16 ? 224 GLU A OE2 1 ATOM 1069 N N . PRO A 1 137 ? -3.063 -2.161 -0.629 1.00 7.19 ? 225 PRO A N 1 ATOM 1070 C CA . PRO A 1 137 ? -2.553 -3.197 0.264 1.00 8.98 ? 225 PRO A CA 1 ATOM 1071 C C . PRO A 1 137 ? -3.456 -4.399 0.373 1.00 7.84 ? 225 PRO A C 1 ATOM 1072 O O . PRO A 1 137 ? -4.657 -4.247 0.534 1.00 9.68 ? 225 PRO A O 1 ATOM 1073 C CB . PRO A 1 137 ? -2.405 -2.468 1.605 1.00 9.50 ? 225 PRO A CB 1 ATOM 1074 C CG . PRO A 1 137 ? -2.081 -1.050 1.181 1.00 9.70 ? 225 PRO A CG 1 ATOM 1075 C CD . PRO A 1 137 ? -2.921 -0.828 -0.014 1.00 8.35 ? 225 PRO A CD 1 ATOM 1076 N N . ASP A 1 138 ? -2.825 -5.578 0.281 1.00 9.33 ? 226 ASP A N 1 ATOM 1077 C CA . ASP A 1 138 ? -3.421 -6.913 0.517 1.00 8.30 ? 226 ASP A CA 1 ATOM 1078 C C . ASP A 1 138 ? -4.169 -7.487 -0.685 1.00 8.95 ? 226 ASP A C 1 ATOM 1079 O O . ASP A 1 138 ? -4.263 -8.700 -0.777 1.00 9.21 ? 226 ASP A O 1 ATOM 1080 C CB . ASP A 1 138 ? -4.361 -6.965 1.701 1.00 9.20 ? 226 ASP A CB 1 ATOM 1081 C CG . ASP A 1 138 ? -3.748 -6.525 2.995 1.00 8.48 ? 226 ASP A CG 1 ATOM 1082 O OD1 . ASP A 1 138 ? -2.524 -6.690 3.222 1.00 11.94 ? 226 ASP A OD1 1 ATOM 1083 O OD2 . ASP A 1 138 ? -4.478 -5.999 3.886 1.00 11.11 ? 226 ASP A OD2 1 ATOM 1084 N N . SER A 1 139 ? -4.630 -6.640 -1.619 1.00 9.17 ? 227 SER A N 1 ATOM 1085 C CA . SER A 1 139 ? -5.526 -7.073 -2.684 1.00 8.55 ? 227 SER A CA 1 ATOM 1086 C C . SER A 1 139 ? -4.964 -8.220 -3.503 1.00 8.49 ? 227 SER A C 1 ATOM 1087 O O . SER A 1 139 ? -5.533 -9.293 -3.579 1.00 9.11 ? 227 SER A O 1 ATOM 1088 C CB . SER A 1 139 ? -5.948 -5.894 -3.598 1.00 9.03 ? 227 SER A CB 1 ATOM 1089 O OG . SER A 1 139 ? -4.861 -5.176 -4.141 1.00 9.50 ? 227 SER A OG 1 ATOM 1090 N N . LEU A 1 140 ? -3.872 -7.985 -4.166 1.00 8.07 ? 228 LEU A N 1 ATOM 1091 C CA . LEU A 1 140 ? -3.287 -9.019 -5.020 1.00 9.09 ? 228 LEU A CA 1 ATOM 1092 C C . LEU A 1 140 ? -2.710 -10.169 -4.273 1.00 8.12 ? 228 LEU A C 1 ATOM 1093 O O . LEU A 1 140 ? -2.733 -11.287 -4.786 1.00 8.17 ? 228 LEU A O 1 ATOM 1094 C CB . LEU A 1 140 ? -2.251 -8.426 -5.995 1.00 8.96 ? 228 LEU A CB 1 ATOM 1095 C CG . LEU A 1 140 ? -2.860 -7.388 -6.949 1.00 13.18 ? 228 LEU A CG 1 ATOM 1096 C CD1 . LEU A 1 140 ? -1.790 -6.800 -7.835 1.00 16.02 ? 228 LEU A CD1 1 ATOM 1097 C CD2 . LEU A 1 140 ? -3.992 -7.931 -7.809 1.00 15.48 ? 228 LEU A CD2 1 ATOM 1098 N N . ALA A 1 141 ? -2.143 -9.912 -3.088 1.00 7.48 ? 229 ALA A N 1 ATOM 1099 C CA . ALA A 1 141 ? -1.681 -10.997 -2.253 1.00 7.06 ? 229 ALA A CA 1 ATOM 1100 C C . ALA A 1 141 ? -2.821 -11.960 -1.921 1.00 5.75 ? 229 ALA A C 1 ATOM 1101 O O . ALA A 1 141 ? -2.644 -13.158 -1.932 1.00 5.72 ? 229 ALA A O 1 ATOM 1102 C CB . ALA A 1 141 ? -0.990 -10.459 -1.038 1.00 7.21 ? 229 ALA A CB 1 ATOM 1103 N N . ASN A 1 142 ? -3.996 -11.431 -1.606 1.00 6.17 ? 230 ASN A N 1 ATOM 1104 C CA . ASN A 1 142 ? -5.171 -12.284 -1.438 1.00 6.85 ? 230 ASN A CA 1 ATOM 1105 C C . ASN A 1 142 ? -5.532 -13.089 -2.690 1.00 7.16 ? 230 ASN A C 1 ATOM 1106 O O . ASN A 1 142 ? -6.020 -14.231 -2.599 1.00 7.79 ? 230 ASN A O 1 ATOM 1107 C CB . ASN A 1 142 ? -6.344 -11.436 -0.954 1.00 6.43 ? 230 ASN A CB 1 ATOM 1108 C CG . ASN A 1 142 ? -6.331 -11.223 0.561 1.00 7.70 ? 230 ASN A CG 1 ATOM 1109 O OD1 . ASN A 1 142 ? -5.883 -12.093 1.304 1.00 8.30 ? 230 ASN A OD1 1 ATOM 1110 N ND2 . ASN A 1 142 ? -6.843 -10.060 1.030 1.00 6.91 ? 230 ASN A ND2 1 ATOM 1111 N N . MET A 1 143 ? -5.309 -12.505 -3.871 1.00 7.37 ? 231 MET A N 1 ATOM 1112 C CA . MET A 1 143 ? -5.593 -13.228 -5.111 1.00 7.95 ? 231 MET A CA 1 ATOM 1113 C C . MET A 1 143 ? -4.616 -14.386 -5.314 1.00 8.11 ? 231 MET A C 1 ATOM 1114 O O . MET A 1 143 ? -4.968 -15.401 -5.949 1.00 8.88 ? 231 MET A O 1 ATOM 1115 C CB . MET A 1 143 ? -5.547 -12.275 -6.322 1.00 8.31 ? 231 MET A CB 1 ATOM 1116 C CG . MET A 1 143 ? -6.543 -11.110 -6.245 1.00 9.44 ? 231 MET A CG 1 ATOM 1117 S SD . MET A 1 143 ? -8.222 -11.614 -6.160 1.00 17.17 ? 231 MET A SD 1 ATOM 1118 C CE . MET A 1 143 ? -8.600 -11.665 -4.351 1.00 15.75 ? 231 MET A CE 1 ATOM 1119 N N . VAL A 1 144 ? -3.412 -14.281 -4.754 1.00 7.70 ? 232 VAL A N 1 ATOM 1120 C CA . VAL A 1 144 ? -2.465 -15.395 -4.785 1.00 7.37 ? 232 VAL A CA 1 ATOM 1121 C C . VAL A 1 144 ? -2.875 -16.556 -3.882 1.00 7.46 ? 232 VAL A C 1 ATOM 1122 O O . VAL A 1 144 ? -2.975 -17.710 -4.351 1.00 7.90 ? 232 VAL A O 1 ATOM 1123 C CB . VAL A 1 144 ? -0.991 -14.956 -4.476 1.00 7.67 ? 232 VAL A CB 1 ATOM 1124 C CG1 . VAL A 1 144 ? -0.078 -16.150 -4.497 1.00 8.76 ? 232 VAL A CG1 1 ATOM 1125 C CG2 . VAL A 1 144 ? -0.532 -13.920 -5.470 1.00 8.43 ? 232 VAL A CG2 1 ATOM 1126 N N . THR A 1 145 ? -3.154 -16.284 -2.605 1.00 8.11 ? 233 THR A N 1 ATOM 1127 C CA . THR A 1 145 ? -3.293 -17.341 -1.619 1.00 8.01 ? 233 THR A CA 1 ATOM 1128 C C . THR A 1 145 ? -4.688 -17.611 -1.112 1.00 8.23 ? 233 THR A C 1 ATOM 1129 O O . THR A 1 145 ? -4.887 -18.633 -0.466 1.00 7.63 ? 233 THR A O 1 ATOM 1130 C CB . THR A 1 145 ? -2.418 -17.089 -0.377 1.00 9.15 ? 233 THR A CB 1 ATOM 1131 O OG1 . THR A 1 145 ? -2.922 -15.976 0.353 1.00 8.81 ? 233 THR A OG1 1 ATOM 1132 C CG2 . THR A 1 145 ? -0.982 -16.708 -0.757 1.00 9.14 ? 233 THR A CG2 1 ATOM 1133 N N . ASN A 1 146 ? -5.649 -16.733 -1.402 1.00 9.20 ? 234 ASN A N 1 ATOM 1134 C CA . ASN A 1 146 ? -6.988 -16.850 -0.807 1.00 9.48 ? 234 ASN A CA 1 ATOM 1135 C C . ASN A 1 146 ? -8.178 -17.019 -1.744 1.00 9.97 ? 234 ASN A C 1 ATOM 1136 O O . ASN A 1 146 ? -9.319 -16.661 -1.387 1.00 10.16 ? 234 ASN A O 1 ATOM 1137 C CB . ASN A 1 146 ? -7.248 -15.705 0.182 1.00 9.58 ? 234 ASN A CB 1 ATOM 1138 C CG . ASN A 1 146 ? -6.512 -15.882 1.492 1.00 10.29 ? 234 ASN A CG 1 ATOM 1139 O OD1 . ASN A 1 146 ? -6.454 -16.980 2.051 1.00 10.88 ? 234 ASN A OD1 1 ATOM 1140 N ND2 . ASN A 1 146 ? -5.965 -14.793 2.004 1.00 9.23 ? 234 ASN A ND2 1 ATOM 1141 N N . MET A 1 147 ? -7.954 -17.655 -2.884 1.00 9.93 ? 235 MET A N 1 ATOM 1142 C CA . MET A 1 147 ? -9.062 -18.012 -3.795 1.00 10.95 ? 235 MET A CA 1 ATOM 1143 C C . MET A 1 147 ? -10.063 -19.015 -3.169 1.00 12.00 ? 235 MET A C 1 ATOM 1144 O O . MET A 1 147 ? -11.182 -19.161 -3.653 1.00 12.07 ? 235 MET A O 1 ATOM 1145 C CB . MET A 1 147 ? -8.515 -18.549 -5.129 1.00 10.94 ? 235 MET A CB 1 ATOM 1146 C CG . MET A 1 147 ? -7.817 -17.484 -5.985 1.00 12.14 ? 235 MET A CG 1 ATOM 1147 S SD . MET A 1 147 ? -8.919 -16.052 -6.332 1.00 16.11 ? 235 MET A SD 1 ATOM 1148 C CE . MET A 1 147 ? -9.933 -16.750 -7.493 1.00 16.95 ? 235 MET A CE 1 ATOM 1149 N N . ASN A 1 148 ? -9.662 -19.684 -2.092 1.00 12.44 ? 236 ASN A N 1 ATOM 1150 C CA . ASN A 1 148 ? -10.554 -20.578 -1.348 1.00 13.52 ? 236 ASN A CA 1 ATOM 1151 C C . ASN A 1 148 ? -11.561 -19.824 -0.433 1.00 13.21 ? 236 ASN A C 1 ATOM 1152 O O . ASN A 1 148 ? -12.500 -20.441 0.088 1.00 12.76 ? 236 ASN A O 1 ATOM 1153 C CB . ASN A 1 148 ? -9.711 -21.544 -0.511 1.00 14.63 ? 236 ASN A CB 1 ATOM 1154 C CG . ASN A 1 148 ? -8.610 -20.815 0.313 1.00 17.51 ? 236 ASN A CG 1 ATOM 1155 O OD1 . ASN A 1 148 ? -7.649 -20.214 -0.237 1.00 19.72 ? 236 ASN A OD1 1 ATOM 1156 N ND2 . ASN A 1 148 ? -8.754 -20.854 1.645 1.00 25.45 ? 236 ASN A ND2 1 ATOM 1157 N N . VAL A 1 149 ? -11.356 -18.519 -0.240 1.00 11.65 ? 237 VAL A N 1 ATOM 1158 C CA . VAL A 1 149 ? -12.243 -17.666 0.554 1.00 11.59 ? 237 VAL A CA 1 ATOM 1159 C C . VAL A 1 149 ? -13.337 -17.099 -0.358 1.00 12.15 ? 237 VAL A C 1 ATOM 1160 O O . VAL A 1 149 ? -12.997 -16.396 -1.316 1.00 13.51 ? 237 VAL A O 1 ATOM 1161 C CB . VAL A 1 149 ? -11.431 -16.521 1.206 1.00 11.89 ? 237 VAL A CB 1 ATOM 1162 C CG1 . VAL A 1 149 ? -12.317 -15.616 2.060 1.00 11.60 ? 237 VAL A CG1 1 ATOM 1163 C CG2 . VAL A 1 149 ? -10.272 -17.068 2.026 1.00 12.27 ? 237 VAL A CG2 1 ATOM 1164 N N . PRO A 1 150 ? -14.617 -17.393 -0.105 1.00 11.48 ? 238 PRO A N 1 ATOM 1165 C CA . PRO A 1 150 ? -15.690 -16.921 -0.994 1.00 11.47 ? 238 PRO A CA 1 ATOM 1166 C C . PRO A 1 150 ? -15.623 -15.411 -1.328 1.00 11.06 ? 238 PRO A C 1 ATOM 1167 O O . PRO A 1 150 ? -15.768 -15.063 -2.496 1.00 10.60 ? 238 PRO A O 1 ATOM 1168 C CB . PRO A 1 150 ? -16.962 -17.339 -0.256 1.00 11.82 ? 238 PRO A CB 1 ATOM 1169 C CG . PRO A 1 150 ? -16.538 -18.579 0.460 1.00 12.48 ? 238 PRO A CG 1 ATOM 1170 C CD . PRO A 1 150 ? -15.151 -18.236 0.986 1.00 11.57 ? 238 PRO A CD 1 ATOM 1171 N N . LYS A 1 151 ? -15.360 -14.537 -0.363 1.00 10.48 ? 239 LYS A N 1 ATOM 1172 C CA . LYS A 1 151 ? -15.317 -13.110 -0.679 1.00 10.40 ? 239 LYS A CA 1 ATOM 1173 C C . LYS A 1 151 ? -14.172 -12.786 -1.666 1.00 10.53 ? 239 LYS A C 1 ATOM 1174 O O . LYS A 1 151 ? -14.304 -11.900 -2.545 1.00 10.83 ? 239 LYS A O 1 ATOM 1175 C CB . LYS A 1 151 ? -15.176 -12.268 0.582 1.00 10.71 ? 239 LYS A CB 1 ATOM 1176 C CG . LYS A 1 151 ? -15.291 -10.746 0.397 1.00 8.73 ? 239 LYS A CG 1 ATOM 1177 C CD . LYS A 1 151 ? -15.515 -10.027 1.708 1.00 12.09 ? 239 LYS A CD 1 ATOM 1178 C CE . LYS A 1 151 ? -15.470 -8.528 1.579 1.00 14.69 ? 239 LYS A CE 1 ATOM 1179 N NZ . LYS A 1 151 ? -15.957 -7.881 2.865 1.00 18.47 ? 239 LYS A NZ 1 ATOM 1180 N N . CYS A 1 152 ? -13.050 -13.476 -1.520 1.00 10.15 ? 240 CYS A N 1 ATOM 1181 C CA . CYS A 1 152 ? -11.889 -13.202 -2.377 1.00 10.13 ? 240 CYS A CA 1 ATOM 1182 C C . CYS A 1 152 ? -12.122 -13.784 -3.782 1.00 10.53 ? 240 CYS A C 1 ATOM 1183 O O . CYS A 1 152 ? -11.904 -13.111 -4.782 1.00 10.77 ? 240 CYS A O 1 ATOM 1184 C CB . CYS A 1 152 ? -10.639 -13.813 -1.767 1.00 10.21 ? 240 CYS A CB 1 ATOM 1185 S SG . CYS A 1 152 ? -10.090 -12.991 -0.213 1.00 11.88 ? 240 CYS A SG 1 ATOM 1186 N N . SER A 1 153 ? -12.552 -15.033 -3.858 1.00 9.88 ? 241 SER A N 1 ATOM 1187 C CA . SER A 1 153 ? -12.818 -15.620 -5.184 1.00 10.42 ? 241 SER A CA 1 ATOM 1188 C C . SER A 1 153 ? -13.869 -14.817 -5.910 1.00 9.67 ? 241 SER A C 1 ATOM 1189 O O . SER A 1 153 ? -13.773 -14.643 -7.131 1.00 10.00 ? 241 SER A O 1 ATOM 1190 C CB . SER A 1 153 ? -13.183 -17.112 -5.118 1.00 11.44 ? 241 SER A CB 1 ATOM 1191 O OG . SER A 1 153 ? -14.362 -17.346 -4.375 1.00 14.95 ? 241 SER A OG 1 ATOM 1192 N N . GLY A 1 154 ? -14.859 -14.305 -5.172 1.00 9.88 ? 242 GLY A N 1 ATOM 1193 C CA . GLY A 1 154 ? -15.956 -13.519 -5.737 1.00 10.15 ? 242 GLY A CA 1 ATOM 1194 C C . GLY A 1 154 ? -15.523 -12.149 -6.248 1.00 10.68 ? 242 GLY A C 1 ATOM 1195 O O . GLY A 1 154 ? -16.137 -11.604 -7.172 1.00 10.43 ? 242 GLY A O 1 ATOM 1196 N N . ALA A 1 155 ? -14.466 -11.614 -5.640 1.00 10.53 ? 243 ALA A N 1 ATOM 1197 C CA . ALA A 1 155 ? -13.883 -10.304 -5.978 1.00 11.30 ? 243 ALA A CA 1 ATOM 1198 C C . ALA A 1 155 ? -12.724 -10.375 -6.975 1.00 10.57 ? 243 ALA A C 1 ATOM 1199 O O . ALA A 1 155 ? -12.236 -9.338 -7.411 1.00 10.29 ? 243 ALA A O 1 ATOM 1200 C CB . ALA A 1 155 ? -13.388 -9.616 -4.722 1.00 11.22 ? 243 ALA A CB 1 ATOM 1201 N N . ALA A 1 156 ? -12.249 -11.564 -7.313 1.00 10.96 ? 244 ALA A N 1 ATOM 1202 C CA . ALA A 1 156 ? -10.970 -11.687 -8.044 1.00 11.23 ? 244 ALA A CA 1 ATOM 1203 C C . ALA A 1 156 ? -10.981 -10.973 -9.399 1.00 11.67 ? 244 ALA A C 1 ATOM 1204 O O . ALA A 1 156 ? -10.048 -10.259 -9.747 1.00 10.75 ? 244 ALA A O 1 ATOM 1205 C CB . ALA A 1 156 ? -10.626 -13.163 -8.263 1.00 12.24 ? 244 ALA A CB 1 ATOM 1206 N N . SER A 1 157 ? -12.030 -11.200 -10.162 1.00 12.09 ? 245 SER A N 1 ATOM 1207 C CA . SER A 1 157 ? -12.110 -10.616 -11.488 1.00 11.59 ? 245 SER A CA 1 ATOM 1208 C C . SER A 1 157 ? -12.190 -9.100 -11.366 1.00 10.75 ? 245 SER A C 1 ATOM 1209 O O . SER A 1 157 ? -11.594 -8.388 -12.196 1.00 10.08 ? 245 SER A O 1 ATOM 1210 C CB . SER A 1 157 ? -13.243 -11.233 -12.344 1.00 12.73 ? 245 SER A CB 1 ATOM 1211 O OG . SER A 1 157 ? -14.558 -10.952 -11.881 1.00 13.99 ? 245 SER A OG 1 ATOM 1212 N N . THR A 1 158 ? -12.921 -8.621 -10.348 1.00 9.67 ? 246 THR A N 1 ATOM 1213 C CA . THR A 1 158 ? -13.073 -7.196 -10.073 1.00 10.38 ? 246 THR A CA 1 ATOM 1214 C C . THR A 1 158 ? -11.745 -6.596 -9.652 1.00 10.50 ? 246 THR A C 1 ATOM 1215 O O . THR A 1 158 ? -11.342 -5.553 -10.192 1.00 9.98 ? 246 THR A O 1 ATOM 1216 C CB . THR A 1 158 ? -14.176 -6.958 -9.002 1.00 9.96 ? 246 THR A CB 1 ATOM 1217 O OG1 . THR A 1 158 ? -15.453 -7.320 -9.546 1.00 9.42 ? 246 THR A OG1 1 ATOM 1218 C CG2 . THR A 1 158 ? -14.282 -5.513 -8.656 1.00 10.98 ? 246 THR A CG2 1 ATOM 1219 N N . TYR A 1 159 ? -11.029 -7.266 -8.722 1.00 9.72 ? 247 TYR A N 1 ATOM 1220 C CA . TYR A 1 159 ? -9.715 -6.791 -8.318 1.00 9.58 ? 247 TYR A CA 1 ATOM 1221 C C . TYR A 1 159 ? -8.771 -6.646 -9.506 1.00 10.31 ? 247 TYR A C 1 ATOM 1222 O O . TYR A 1 159 ? -8.051 -5.645 -9.655 1.00 9.94 ? 247 TYR A O 1 ATOM 1223 C CB . TYR A 1 159 ? -9.057 -7.728 -7.318 1.00 9.01 ? 247 TYR A CB 1 ATOM 1224 C CG . TYR A 1 159 ? -9.503 -7.594 -5.868 1.00 8.37 ? 247 TYR A CG 1 ATOM 1225 C CD1 . TYR A 1 159 ? -10.638 -6.874 -5.494 1.00 7.65 ? 247 TYR A CD1 1 ATOM 1226 C CD2 . TYR A 1 159 ? -8.753 -8.160 -4.876 1.00 10.04 ? 247 TYR A CD2 1 ATOM 1227 C CE1 . TYR A 1 159 ? -11.024 -6.789 -4.161 1.00 9.59 ? 247 TYR A CE1 1 ATOM 1228 C CE2 . TYR A 1 159 ? -9.147 -8.095 -3.536 1.00 9.38 ? 247 TYR A CE2 1 ATOM 1229 C CZ . TYR A 1 159 ? -10.259 -7.396 -3.188 1.00 11.73 ? 247 TYR A CZ 1 ATOM 1230 O OH . TYR A 1 159 ? -10.612 -7.359 -1.834 1.00 12.33 ? 247 TYR A OH 1 ATOM 1231 N N . ARG A 1 160 ? -8.787 -7.645 -10.365 1.00 11.68 ? 248 ARG A N 1 ATOM 1232 C CA . ARG A 1 160 ? -7.921 -7.609 -11.526 1.00 11.21 ? 248 ARG A CA 1 ATOM 1233 C C . ARG A 1 160 ? -8.282 -6.415 -12.447 1.00 10.82 ? 248 ARG A C 1 ATOM 1234 O O . ARG A 1 160 ? -7.411 -5.586 -12.778 1.00 9.24 ? 248 ARG A O 1 ATOM 1235 C CB . ARG A 1 160 ? -8.040 -8.902 -12.294 1.00 12.22 ? 248 ARG A CB 1 ATOM 1236 C CG . ARG A 1 160 ? -7.340 -8.835 -13.591 1.00 15.79 ? 248 ARG A CG 1 ATOM 1237 C CD . ARG A 1 160 ? -7.356 -10.112 -14.452 1.00 18.31 ? 248 ARG A CD 1 ATOM 1238 N NE . ARG A 1 160 ? -6.119 -10.010 -15.236 1.00 24.57 ? 248 ARG A NE 1 ATOM 1239 C CZ . ARG A 1 160 ? -4.924 -10.438 -14.809 1.00 22.76 ? 248 ARG A CZ 1 ATOM 1240 N NH1 . ARG A 1 160 ? -4.825 -11.136 -13.679 1.00 23.67 ? 248 ARG A NH1 1 ATOM 1241 N NH2 . ARG A 1 160 ? -3.838 -10.211 -15.543 1.00 20.14 ? 248 ARG A NH2 1 ATOM 1242 N N . GLU A 1 161 ? -9.554 -6.269 -12.774 1.00 9.92 ? 249 GLU A N 1 ATOM 1243 C CA . GLU A 1 161 ? -9.996 -5.201 -13.670 1.00 9.90 ? 249 GLU A CA 1 ATOM 1244 C C . GLU A 1 161 ? -9.656 -3.813 -13.070 1.00 9.31 ? 249 GLU A C 1 ATOM 1245 O O . GLU A 1 161 ? -9.162 -2.907 -13.783 1.00 8.62 ? 249 GLU A O 1 ATOM 1246 C CB . GLU A 1 161 ? -11.518 -5.298 -13.968 1.00 10.28 ? 249 GLU A CB 1 ATOM 1247 C CG . GLU A 1 161 ? -12.133 -4.085 -14.684 1.00 15.42 ? 249 GLU A CG 1 ATOM 1248 C CD . GLU A 1 161 ? -13.694 -4.048 -14.687 1.00 21.35 ? 249 GLU A CD 1 ATOM 1249 O OE1 . GLU A 1 161 ? -14.355 -4.925 -14.068 1.00 28.30 ? 249 GLU A OE1 1 ATOM 1250 O OE2 . GLU A 1 161 ? -14.281 -3.118 -15.290 1.00 22.83 ? 249 GLU A OE2 1 ATOM 1251 N N . LEU A 1 162 ? -9.918 -3.654 -11.770 1.00 7.62 ? 250 LEU A N 1 ATOM 1252 C CA . LEU A 1 162 ? -9.766 -2.350 -11.101 1.00 7.29 ? 250 LEU A CA 1 ATOM 1253 C C . LEU A 1 162 ? -8.303 -2.002 -10.842 1.00 7.17 ? 250 LEU A C 1 ATOM 1254 O O . LEU A 1 162 ? -7.961 -0.814 -10.823 1.00 8.35 ? 250 LEU A O 1 ATOM 1255 C CB . LEU A 1 162 ? -10.568 -2.288 -9.803 1.00 7.00 ? 250 LEU A CB 1 ATOM 1256 C CG . LEU A 1 162 ? -12.081 -2.333 -9.986 1.00 7.22 ? 250 LEU A CG 1 ATOM 1257 C CD1 . LEU A 1 162 ? -12.739 -2.292 -8.613 1.00 6.04 ? 250 LEU A CD1 1 ATOM 1258 C CD2 . LEU A 1 162 ? -12.609 -1.241 -10.931 1.00 8.07 ? 250 LEU A CD2 1 ATOM 1259 N N . THR A 1 163 ? -7.448 -3.016 -10.660 1.00 7.38 ? 251 THR A N 1 ATOM 1260 C CA . THR A 1 163 ? -6.020 -2.788 -10.513 1.00 7.61 ? 251 THR A CA 1 ATOM 1261 C C . THR A 1 163 ? -5.415 -2.261 -11.819 1.00 7.28 ? 251 THR A C 1 ATOM 1262 O O . THR A 1 163 ? -4.653 -1.276 -11.832 1.00 7.26 ? 251 THR A O 1 ATOM 1263 C CB . THR A 1 163 ? -5.324 -4.060 -10.115 1.00 8.13 ? 251 THR A CB 1 ATOM 1264 O OG1 . THR A 1 163 ? -5.739 -4.490 -8.801 1.00 8.90 ? 251 THR A OG1 1 ATOM 1265 C CG2 . THR A 1 163 ? -3.869 -3.817 -9.945 1.00 9.10 ? 251 THR A CG2 1 ATOM 1266 N N . ILE A 1 164 ? -5.693 -2.953 -12.904 1.00 6.80 ? 252 ILE A N 1 ATOM 1267 C CA . ILE A 1 164 ? -5.271 -2.473 -14.224 1.00 7.16 ? 252 ILE A CA 1 ATOM 1268 C C . ILE A 1 164 ? -5.827 -1.057 -14.504 1.00 7.75 ? 252 ILE A C 1 ATOM 1269 O O . ILE A 1 164 ? -5.085 -0.203 -14.998 1.00 7.61 ? 252 ILE A O 1 ATOM 1270 C CB . ILE A 1 164 ? -5.687 -3.480 -15.303 1.00 7.39 ? 252 ILE A CB 1 ATOM 1271 C CG1 . ILE A 1 164 ? -4.920 -4.798 -15.118 1.00 8.57 ? 252 ILE A CG1 1 ATOM 1272 C CG2 . ILE A 1 164 ? -5.500 -2.898 -16.713 1.00 7.63 ? 252 ILE A CG2 1 ATOM 1273 C CD1 . ILE A 1 164 ? -5.509 -5.912 -15.945 1.00 11.96 ? 252 ILE A CD1 1 ATOM 1274 N N . TYR A 1 165 ? -7.121 -0.820 -14.188 1.00 7.63 ? 253 TYR A N 1 ATOM 1275 C CA . TYR A 1 165 ? -7.718 0.499 -14.356 1.00 8.15 ? 253 TYR A CA 1 ATOM 1276 C C . TYR A 1 165 ? -6.888 1.575 -13.603 1.00 8.39 ? 253 TYR A C 1 ATOM 1277 O O . TYR A 1 165 ? -6.569 2.624 -14.159 1.00 7.94 ? 253 TYR A O 1 ATOM 1278 C CB . TYR A 1 165 ? -9.160 0.491 -13.851 1.00 8.66 ? 253 TYR A CB 1 ATOM 1279 C CG . TYR A 1 165 ? -9.953 1.713 -14.235 1.00 8.25 ? 253 TYR A CG 1 ATOM 1280 C CD1 . TYR A 1 165 ? -10.501 1.838 -15.492 1.00 9.63 ? 253 TYR A CD1 1 ATOM 1281 C CD2 . TYR A 1 165 ? -10.130 2.763 -13.333 1.00 9.24 ? 253 TYR A CD2 1 ATOM 1282 C CE1 . TYR A 1 165 ? -11.228 2.952 -15.847 1.00 9.86 ? 253 TYR A CE1 1 ATOM 1283 C CE2 . TYR A 1 165 ? -10.859 3.873 -13.679 1.00 7.67 ? 253 TYR A CE2 1 ATOM 1284 C CZ . TYR A 1 165 ? -11.410 3.973 -14.933 1.00 10.65 ? 253 TYR A CZ 1 ATOM 1285 O OH . TYR A 1 165 ? -12.146 5.065 -15.309 1.00 9.71 ? 253 TYR A OH 1 ATOM 1286 N N . ALA A 1 166 ? -6.573 1.307 -12.345 1.00 8.26 ? 254 ALA A N 1 ATOM 1287 C CA . ALA A 1 166 ? -5.788 2.224 -11.502 1.00 7.38 ? 254 ALA A CA 1 ATOM 1288 C C . ALA A 1 166 ? -4.367 2.442 -12.013 1.00 6.82 ? 254 ALA A C 1 ATOM 1289 O O . ALA A 1 166 ? -3.906 3.581 -12.062 1.00 4.86 ? 254 ALA A O 1 ATOM 1290 C CB . ALA A 1 166 ? -5.750 1.750 -10.084 1.00 9.30 ? 254 ALA A CB 1 ATOM 1291 N N . LEU A 1 167 ? -3.694 1.374 -12.425 1.00 6.77 ? 255 LEU A N 1 ATOM 1292 C CA . LEU A 1 167 ? -2.340 1.526 -12.938 1.00 7.24 ? 255 LEU A CA 1 ATOM 1293 C C . LEU A 1 167 ? -2.276 2.406 -14.190 1.00 7.74 ? 255 LEU A C 1 ATOM 1294 O O . LEU A 1 167 ? -1.347 3.192 -14.331 1.00 6.96 ? 255 LEU A O 1 ATOM 1295 C CB . LEU A 1 167 ? -1.708 0.163 -13.228 1.00 8.03 ? 255 LEU A CB 1 ATOM 1296 C CG . LEU A 1 167 ? -1.579 -0.799 -12.029 1.00 8.82 ? 255 LEU A CG 1 ATOM 1297 C CD1 . LEU A 1 167 ? -0.949 -2.096 -12.473 1.00 9.87 ? 255 LEU A CD1 1 ATOM 1298 C CD2 . LEU A 1 167 ? -0.833 -0.238 -10.878 1.00 8.93 ? 255 LEU A CD2 1 ATOM 1299 N N . LYS A 1 168 ? -3.254 2.285 -15.096 1.00 7.43 ? 256 LYS A N 1 ATOM 1300 C CA . LYS A 1 168 ? -3.297 3.116 -16.302 1.00 8.03 ? 256 LYS A CA 1 ATOM 1301 C C . LYS A 1 168 ? -3.721 4.542 -16.009 1.00 7.84 ? 256 LYS A C 1 ATOM 1302 O O . LYS A 1 168 ? -3.190 5.485 -16.568 1.00 7.47 ? 256 LYS A O 1 ATOM 1303 C CB . LYS A 1 168 ? -4.220 2.486 -17.332 1.00 8.54 ? 256 LYS A CB 1 ATOM 1304 C CG . LYS A 1 168 ? -3.656 1.170 -17.853 1.00 12.26 ? 256 LYS A CG 1 ATOM 1305 C CD . LYS A 1 168 ? -4.629 0.423 -18.789 1.00 16.05 ? 256 LYS A CD 1 ATOM 1306 C CE . LYS A 1 168 ? -4.250 0.543 -20.206 1.00 21.01 ? 256 LYS A CE 1 ATOM 1307 N NZ . LYS A 1 168 ? -4.786 -0.598 -21.031 1.00 20.50 ? 256 LYS A NZ 1 ATOM 1308 N N . GLN A 1 169 ? -4.676 4.713 -15.108 1.00 6.57 ? 257 GLN A N 1 ATOM 1309 C CA . GLN A 1 169 ? -5.226 6.036 -14.888 1.00 6.83 ? 257 GLN A CA 1 ATOM 1310 C C . GLN A 1 169 ? -4.281 6.898 -14.067 1.00 7.08 ? 257 GLN A C 1 ATOM 1311 O O . GLN A 1 169 ? -4.274 8.147 -14.195 1.00 7.10 ? 257 GLN A O 1 ATOM 1312 C CB . GLN A 1 169 ? -6.567 5.881 -14.171 1.00 7.54 ? 257 GLN A CB 1 ATOM 1313 C CG . GLN A 1 169 ? -7.721 5.516 -15.073 1.00 8.41 ? 257 GLN A CG 1 ATOM 1314 C CD . GLN A 1 169 ? -8.046 6.644 -16.066 1.00 14.85 ? 257 GLN A CD 1 ATOM 1315 O OE1 . GLN A 1 169 ? -7.472 6.700 -17.138 1.00 20.75 ? 257 GLN A OE1 1 ATOM 1316 N NE2 . GLN A 1 169 ? -8.889 7.567 -15.659 1.00 17.47 ? 257 GLN A NE2 1 ATOM 1317 N N . LEU A 1 170 ? -3.501 6.259 -13.204 1.00 5.51 ? 258 LEU A N 1 ATOM 1318 C CA . LEU A 1 170 ? -2.593 7.010 -12.329 1.00 6.03 ? 258 LEU A CA 1 ATOM 1319 C C . LEU A 1 170 ? -1.174 7.030 -12.914 1.00 6.21 ? 258 LEU A C 1 ATOM 1320 O O . LEU A 1 170 ? -0.267 7.513 -12.282 1.00 6.50 ? 258 LEU A O 1 ATOM 1321 C CB . LEU A 1 170 ? -2.635 6.499 -10.903 1.00 6.12 ? 258 LEU A CB 1 ATOM 1322 C CG . LEU A 1 170 ? -4.033 6.505 -10.293 1.00 7.77 ? 258 LEU A CG 1 ATOM 1323 C CD1 . LEU A 1 170 ? -4.031 5.900 -8.918 1.00 9.63 ? 258 LEU A CD1 1 ATOM 1324 C CD2 . LEU A 1 170 ? -4.627 7.898 -10.293 1.00 9.47 ? 258 LEU A CD2 1 ATOM 1325 N N . ASP A 1 171 ? -1.027 6.629 -14.176 1.00 6.78 ? 259 ASP A N 1 ATOM 1326 C CA . ASP A 1 171 ? 0.275 6.632 -14.873 1.00 6.35 ? 259 ASP A CA 1 ATOM 1327 C C . ASP A 1 171 ? 0.572 8.034 -15.420 1.00 6.93 ? 259 ASP A C 1 ATOM 1328 O O . ASP A 1 171 ? 0.211 8.412 -16.566 1.00 5.82 ? 259 ASP A O 1 ATOM 1329 C CB . ASP A 1 171 ? 0.201 5.620 -16.036 1.00 6.77 ? 259 ASP A CB 1 ATOM 1330 C CG . ASP A 1 171 ? 1.431 5.599 -16.890 1.00 8.56 ? 259 ASP A CG 1 ATOM 1331 O OD1 . ASP A 1 171 ? 2.550 5.928 -16.392 1.00 7.62 ? 259 ASP A OD1 1 ATOM 1332 O OD2 . ASP A 1 171 ? 1.315 5.239 -18.086 1.00 8.13 ? 259 ASP A OD2 1 ATOM 1333 N N . LEU A 1 172 ? 1.138 8.845 -14.535 1.00 5.99 ? 260 LEU A N 1 ATOM 1334 C CA . LEU A 1 172 ? 1.265 10.286 -14.769 1.00 6.70 ? 260 LEU A CA 1 ATOM 1335 C C . LEU A 1 172 ? 2.731 10.610 -14.598 1.00 6.61 ? 260 LEU A C 1 ATOM 1336 O O . LEU A 1 172 ? 3.427 9.961 -13.834 1.00 6.38 ? 260 LEU A O 1 ATOM 1337 C CB . LEU A 1 172 ? 0.422 11.078 -13.787 1.00 7.14 ? 260 LEU A CB 1 ATOM 1338 C CG . LEU A 1 172 ? -1.103 10.887 -13.824 1.00 5.94 ? 260 LEU A CG 1 ATOM 1339 C CD1 . LEU A 1 172 ? -1.754 11.535 -12.600 1.00 9.37 ? 260 LEU A CD1 1 ATOM 1340 C CD2 . LEU A 1 172 ? -1.644 11.468 -15.097 1.00 8.25 ? 260 LEU A CD2 1 ATOM 1341 N N . PRO A 1 173 ? 3.198 11.648 -15.289 1.00 8.28 ? 261 PRO A N 1 ATOM 1342 C CA . PRO A 1 173 ? 4.641 11.941 -15.319 1.00 8.40 ? 261 PRO A CA 1 ATOM 1343 C C . PRO A 1 173 ? 5.340 12.189 -13.986 1.00 8.69 ? 261 PRO A C 1 ATOM 1344 O O . PRO A 1 173 ? 6.528 11.848 -13.909 1.00 8.81 ? 261 PRO A O 1 ATOM 1345 C CB . PRO A 1 173 ? 4.742 13.175 -16.258 1.00 8.54 ? 261 PRO A CB 1 ATOM 1346 C CG . PRO A 1 173 ? 3.434 13.271 -16.954 1.00 11.29 ? 261 PRO A CG 1 ATOM 1347 C CD . PRO A 1 173 ? 2.420 12.557 -16.139 1.00 8.13 ? 261 PRO A CD 1 ATOM 1348 N N . HIS A 1 174 ? 4.627 12.649 -12.949 1.00 7.04 ? 262 HIS A N 1 ATOM 1349 C CA . HIS A 1 174 ? 5.219 12.969 -11.653 1.00 7.57 ? 262 HIS A CA 1 ATOM 1350 C C . HIS A 1 174 ? 4.891 11.980 -10.559 1.00 8.48 ? 262 HIS A C 1 ATOM 1351 O O . HIS A 1 174 ? 5.205 12.213 -9.393 1.00 8.69 ? 262 HIS A O 1 ATOM 1352 C CB . HIS A 1 174 ? 4.691 14.318 -11.211 1.00 7.91 ? 262 HIS A CB 1 ATOM 1353 C CG . HIS A 1 174 ? 3.212 14.292 -10.931 1.00 10.04 ? 262 HIS A CG 1 ATOM 1354 N ND1 . HIS A 1 174 ? 2.253 14.172 -11.926 1.00 11.38 ? 262 HIS A ND1 1 ATOM 1355 C CD2 . HIS A 1 174 ? 2.537 14.362 -9.755 1.00 11.65 ? 262 HIS A CD2 1 ATOM 1356 C CE1 . HIS A 1 174 ? 1.054 14.208 -11.361 1.00 8.66 ? 262 HIS A CE1 1 ATOM 1357 N NE2 . HIS A 1 174 ? 1.200 14.325 -10.053 1.00 10.07 ? 262 HIS A NE2 1 ATOM 1358 N N . VAL A 1 175 ? 4.331 10.835 -10.963 1.00 6.79 ? 263 VAL A N 1 ATOM 1359 C CA . VAL A 1 175 ? 3.893 9.801 -10.058 1.00 8.26 ? 263 VAL A CA 1 ATOM 1360 C C . VAL A 1 175 ? 4.799 8.583 -10.146 1.00 8.23 ? 263 VAL A C 1 ATOM 1361 O O . VAL A 1 175 ? 5.293 8.207 -11.246 1.00 8.74 ? 263 VAL A O 1 ATOM 1362 C CB . VAL A 1 175 ? 2.456 9.414 -10.378 1.00 7.79 ? 263 VAL A CB 1 ATOM 1363 C CG1 . VAL A 1 175 ? 2.048 8.070 -9.698 1.00 9.34 ? 263 VAL A CG1 1 ATOM 1364 C CG2 . VAL A 1 175 ? 1.527 10.538 -10.038 1.00 9.27 ? 263 VAL A CG2 1 ATOM 1365 N N . ALA A 1 176 ? 5.080 7.998 -8.983 1.00 8.62 ? 264 ALA A N 1 ATOM 1366 C CA . ALA A 1 176 ? 5.658 6.672 -8.926 1.00 7.81 ? 264 ALA A CA 1 ATOM 1367 C C . ALA A 1 176 ? 4.663 5.780 -8.195 1.00 8.11 ? 264 ALA A C 1 ATOM 1368 O O . ALA A 1 176 ? 4.207 6.125 -7.095 1.00 8.72 ? 264 ALA A O 1 ATOM 1369 C CB . ALA A 1 176 ? 6.993 6.695 -8.206 1.00 7.90 ? 264 ALA A CB 1 ATOM 1370 N N . MET A 1 177 ? 4.371 4.613 -8.750 1.00 6.51 ? 265 MET A N 1 ATOM 1371 C CA . MET A 1 177 ? 3.473 3.669 -8.109 1.00 7.13 ? 265 MET A CA 1 ATOM 1372 C C . MET A 1 177 ? 4.210 2.414 -7.698 1.00 7.46 ? 265 MET A C 1 ATOM 1373 O O . MET A 1 177 ? 4.972 1.874 -8.465 1.00 7.83 ? 265 MET A O 1 ATOM 1374 C CB . MET A 1 177 ? 2.368 3.243 -9.062 1.00 8.54 ? 265 MET A CB 1 ATOM 1375 C CG . MET A 1 177 ? 1.230 4.202 -9.167 1.00 10.76 ? 265 MET A CG 1 ATOM 1376 S SD . MET A 1 177 ? 0.001 3.695 -10.341 1.00 10.23 ? 265 MET A SD 1 ATOM 1377 C CE . MET A 1 177 ? 0.741 4.190 -11.851 1.00 9.49 ? 265 MET A CE 1 ATOM 1378 N N . TYR A 1 178 ? 3.847 1.896 -6.535 1.00 6.77 ? 266 TYR A N 1 ATOM 1379 C CA . TYR A 1 178 ? 4.259 0.590 -6.047 1.00 6.81 ? 266 TYR A CA 1 ATOM 1380 C C . TYR A 1 178 ? 3.027 -0.241 -5.729 1.00 7.67 ? 266 TYR A C 1 ATOM 1381 O O . TYR A 1 178 ? 2.214 0.154 -4.914 1.00 7.62 ? 266 TYR A O 1 ATOM 1382 C CB . TYR A 1 178 ? 5.112 0.707 -4.802 1.00 7.16 ? 266 TYR A CB 1 ATOM 1383 C CG . TYR A 1 178 ? 6.406 1.495 -5.016 1.00 8.14 ? 266 TYR A CG 1 ATOM 1384 C CD1 . TYR A 1 178 ? 6.432 2.886 -4.947 1.00 7.11 ? 266 TYR A CD1 1 ATOM 1385 C CD2 . TYR A 1 178 ? 7.600 0.838 -5.271 1.00 8.32 ? 266 TYR A CD2 1 ATOM 1386 C CE1 . TYR A 1 178 ? 7.604 3.619 -5.161 1.00 4.96 ? 266 TYR A CE1 1 ATOM 1387 C CE2 . TYR A 1 178 ? 8.789 1.561 -5.462 1.00 7.08 ? 266 TYR A CE2 1 ATOM 1388 C CZ . TYR A 1 178 ? 8.775 2.959 -5.377 1.00 6.66 ? 266 TYR A CZ 1 ATOM 1389 O OH . TYR A 1 178 ? 9.909 3.648 -5.554 1.00 7.19 ? 266 TYR A OH 1 ATOM 1390 N N . MET A 1 179 ? 2.839 -1.364 -6.434 1.00 8.01 ? 267 MET A N 1 ATOM 1391 C CA . MET A 1 179 ? 1.747 -2.273 -6.105 1.00 8.51 ? 267 MET A CA 1 ATOM 1392 C C . MET A 1 179 ? 2.092 -2.992 -4.801 1.00 8.08 ? 267 MET A C 1 ATOM 1393 O O . MET A 1 179 ? 3.191 -3.430 -4.607 1.00 7.12 ? 267 MET A O 1 ATOM 1394 C CB . MET A 1 179 ? 1.521 -3.292 -7.250 1.00 8.60 ? 267 MET A CB 1 ATOM 1395 C CG . MET A 1 179 ? 0.635 -2.774 -8.375 1.00 11.74 ? 267 MET A CG 1 ATOM 1396 S SD . MET A 1 179 ? 0.373 -4.076 -9.589 1.00 15.51 ? 267 MET A SD 1 ATOM 1397 C CE . MET A 1 179 ? 1.997 -3.909 -10.247 1.00 6.52 ? 267 MET A CE 1 ATOM 1398 N N . ASP A 1 180 ? 1.109 -3.169 -3.923 1.00 10.00 ? 268 ASP A N 1 ATOM 1399 C CA . ASP A 1 180 ? 1.341 -3.958 -2.702 1.00 9.45 ? 268 ASP A CA 1 ATOM 1400 C C . ASP A 1 180 ? 1.632 -5.402 -3.036 1.00 9.88 ? 268 ASP A C 1 ATOM 1401 O O . ASP A 1 180 ? 0.960 -5.993 -3.866 1.00 9.17 ? 268 ASP A O 1 ATOM 1402 C CB . ASP A 1 180 ? 0.149 -3.880 -1.768 1.00 9.91 ? 268 ASP A CB 1 ATOM 1403 C CG . ASP A 1 180 ? 0.414 -4.559 -0.458 1.00 12.43 ? 268 ASP A CG 1 ATOM 1404 O OD1 . ASP A 1 180 ? 1.023 -3.877 0.394 1.00 13.73 ? 268 ASP A OD1 1 ATOM 1405 O OD2 . ASP A 1 180 ? 0.105 -5.758 -0.236 1.00 11.95 ? 268 ASP A OD2 1 ATOM 1406 N N . ALA A 1 181 ? 2.635 -5.985 -2.369 1.00 8.81 ? 269 ALA A N 1 ATOM 1407 C CA . ALA A 1 181 ? 3.019 -7.375 -2.645 1.00 8.11 ? 269 ALA A CA 1 ATOM 1408 C C . ALA A 1 181 ? 3.229 -8.185 -1.364 1.00 7.77 ? 269 ALA A C 1 ATOM 1409 O O . ALA A 1 181 ? 4.175 -8.959 -1.262 1.00 6.73 ? 269 ALA A O 1 ATOM 1410 C CB . ALA A 1 181 ? 4.250 -7.408 -3.502 1.00 9.05 ? 269 ALA A CB 1 ATOM 1411 N N . GLY A 1 182 ? 2.295 -8.034 -0.414 1.00 6.88 ? 270 GLY A N 1 ATOM 1412 C CA . GLY A 1 182 ? 2.330 -8.862 0.786 1.00 6.13 ? 270 GLY A CA 1 ATOM 1413 C C . GLY A 1 182 ? 3.624 -8.683 1.559 1.00 5.90 ? 270 GLY A C 1 ATOM 1414 O O . GLY A 1 182 ? 4.071 -7.564 1.713 1.00 7.32 ? 270 GLY A O 1 ATOM 1415 N N . HIS A 1 183 ? 4.218 -9.777 2.019 1.00 6.23 ? 271 HIS A N 1 ATOM 1416 C CA . HIS A 1 183 ? 5.472 -9.714 2.811 1.00 5.22 ? 271 HIS A CA 1 ATOM 1417 C C . HIS A 1 183 ? 6.134 -11.099 2.840 1.00 5.86 ? 271 HIS A C 1 ATOM 1418 O O . HIS A 1 183 ? 5.580 -12.076 2.292 1.00 5.80 ? 271 HIS A O 1 ATOM 1419 C CB . HIS A 1 183 ? 5.137 -9.169 4.229 1.00 5.95 ? 271 HIS A CB 1 ATOM 1420 C CG . HIS A 1 183 ? 4.240 -10.051 5.013 1.00 5.94 ? 271 HIS A CG 1 ATOM 1421 N ND1 . HIS A 1 183 ? 4.699 -11.162 5.690 1.00 5.57 ? 271 HIS A ND1 1 ATOM 1422 C CD2 . HIS A 1 183 ? 2.904 -9.983 5.249 1.00 5.18 ? 271 HIS A CD2 1 ATOM 1423 C CE1 . HIS A 1 183 ? 3.687 -11.753 6.292 1.00 5.94 ? 271 HIS A CE1 1 ATOM 1424 N NE2 . HIS A 1 183 ? 2.594 -11.037 6.079 1.00 6.35 ? 271 HIS A NE2 1 ATOM 1425 N N . ALA A 1 184 ? 7.316 -11.208 3.424 1.00 5.95 ? 272 ALA A N 1 ATOM 1426 C CA . ALA A 1 184 ? 8.059 -12.465 3.440 1.00 6.48 ? 272 ALA A CA 1 ATOM 1427 C C . ALA A 1 184 ? 7.280 -13.644 3.955 1.00 6.33 ? 272 ALA A C 1 ATOM 1428 O O . ALA A 1 184 ? 7.443 -14.731 3.436 1.00 6.69 ? 272 ALA A O 1 ATOM 1429 C CB . ALA A 1 184 ? 9.309 -12.335 4.275 1.00 6.41 ? 272 ALA A CB 1 ATOM 1430 N N . GLY A 1 185 ? 6.451 -13.438 4.980 1.00 6.66 ? 273 GLY A N 1 ATOM 1431 C CA . GLY A 1 185 ? 5.656 -14.518 5.561 1.00 7.03 ? 273 GLY A CA 1 ATOM 1432 C C . GLY A 1 185 ? 4.297 -14.782 4.942 1.00 8.36 ? 273 GLY A C 1 ATOM 1433 O O . GLY A 1 185 ? 3.454 -15.502 5.515 1.00 8.78 ? 273 GLY A O 1 ATOM 1434 N N . TRP A 1 186 ? 4.055 -14.154 3.802 1.00 6.53 ? 274 TRP A N 1 ATOM 1435 C CA . TRP A 1 186 ? 2.808 -14.313 3.072 1.00 6.53 ? 274 TRP A CA 1 ATOM 1436 C C . TRP A 1 186 ? 3.196 -14.881 1.724 1.00 5.93 ? 274 TRP A C 1 ATOM 1437 O O . TRP A 1 186 ? 3.017 -16.091 1.524 1.00 6.65 ? 274 TRP A O 1 ATOM 1438 C CB . TRP A 1 186 ? 2.093 -12.988 2.935 1.00 5.58 ? 274 TRP A CB 1 ATOM 1439 C CG . TRP A 1 186 ? 0.699 -13.113 2.431 1.00 5.25 ? 274 TRP A CG 1 ATOM 1440 C CD1 . TRP A 1 186 ? 0.116 -14.217 1.849 1.00 5.38 ? 274 TRP A CD1 1 ATOM 1441 C CD2 . TRP A 1 186 ? -0.287 -12.095 2.425 1.00 4.58 ? 274 TRP A CD2 1 ATOM 1442 N NE1 . TRP A 1 186 ? -1.181 -13.937 1.509 1.00 7.46 ? 274 TRP A NE1 1 ATOM 1443 C CE2 . TRP A 1 186 ? -1.458 -12.647 1.848 1.00 3.33 ? 274 TRP A CE2 1 ATOM 1444 C CE3 . TRP A 1 186 ? -0.317 -10.757 2.869 1.00 6.13 ? 274 TRP A CE3 1 ATOM 1445 C CZ2 . TRP A 1 186 ? -2.640 -11.914 1.709 1.00 8.78 ? 274 TRP A CZ2 1 ATOM 1446 C CZ3 . TRP A 1 186 ? -1.496 -10.070 2.754 1.00 7.29 ? 274 TRP A CZ3 1 ATOM 1447 C CH2 . TRP A 1 186 ? -2.607 -10.631 2.149 1.00 6.30 ? 274 TRP A CH2 1 ATOM 1448 N N . LEU A 1 187 ? 3.772 -14.042 0.845 1.00 6.12 ? 275 LEU A N 1 ATOM 1449 C CA . LEU A 1 187 ? 4.100 -14.468 -0.527 1.00 6.34 ? 275 LEU A CA 1 ATOM 1450 C C . LEU A 1 187 ? 5.510 -15.042 -0.639 1.00 7.11 ? 275 LEU A C 1 ATOM 1451 O O . LEU A 1 187 ? 5.837 -15.687 -1.608 1.00 8.33 ? 275 LEU A O 1 ATOM 1452 C CB . LEU A 1 187 ? 3.878 -13.334 -1.541 1.00 6.38 ? 275 LEU A CB 1 ATOM 1453 C CG . LEU A 1 187 ? 2.464 -12.724 -1.571 1.00 6.63 ? 275 LEU A CG 1 ATOM 1454 C CD1 . LEU A 1 187 ? 2.390 -11.626 -2.633 1.00 11.09 ? 275 LEU A CD1 1 ATOM 1455 C CD2 . LEU A 1 187 ? 1.360 -13.782 -1.751 1.00 6.19 ? 275 LEU A CD2 1 ATOM 1456 N N . GLY A 1 188 ? 6.324 -14.873 0.382 1.00 7.00 ? 276 GLY A N 1 ATOM 1457 C CA . GLY A 1 188 ? 7.718 -15.301 0.310 1.00 6.56 ? 276 GLY A CA 1 ATOM 1458 C C . GLY A 1 188 ? 7.915 -16.767 0.594 1.00 6.28 ? 276 GLY A C 1 ATOM 1459 O O . GLY A 1 188 ? 8.974 -17.324 0.299 1.00 7.23 ? 276 GLY A O 1 ATOM 1460 N N . TRP A 1 189 ? 6.881 -17.431 1.121 1.00 7.03 ? 277 TRP A N 1 ATOM 1461 C CA . TRP A 1 189 ? 6.921 -18.870 1.277 1.00 8.44 ? 277 TRP A CA 1 ATOM 1462 C C . TRP A 1 189 ? 7.209 -19.495 -0.094 1.00 8.50 ? 277 TRP A C 1 ATOM 1463 O O . TRP A 1 189 ? 6.648 -19.061 -1.121 1.00 9.51 ? 277 TRP A O 1 ATOM 1464 C CB . TRP A 1 189 ? 5.591 -19.386 1.842 1.00 8.05 ? 277 TRP A CB 1 ATOM 1465 C CG . TRP A 1 189 ? 5.407 -19.131 3.300 1.00 6.88 ? 277 TRP A CG 1 ATOM 1466 C CD1 . TRP A 1 189 ? 4.789 -18.076 3.876 1.00 9.22 ? 277 TRP A CD1 1 ATOM 1467 C CD2 . TRP A 1 189 ? 5.902 -19.931 4.370 1.00 6.68 ? 277 TRP A CD2 1 ATOM 1468 N NE1 . TRP A 1 189 ? 4.850 -18.184 5.246 1.00 8.71 ? 277 TRP A NE1 1 ATOM 1469 C CE2 . TRP A 1 189 ? 5.530 -19.317 5.565 1.00 7.16 ? 277 TRP A CE2 1 ATOM 1470 C CE3 . TRP A 1 189 ? 6.619 -21.120 4.430 1.00 4.64 ? 277 TRP A CE3 1 ATOM 1471 C CZ2 . TRP A 1 189 ? 5.846 -19.851 6.820 1.00 9.19 ? 277 TRP A CZ2 1 ATOM 1472 C CZ3 . TRP A 1 189 ? 6.954 -21.644 5.673 1.00 8.27 ? 277 TRP A CZ3 1 ATOM 1473 C CH2 . TRP A 1 189 ? 6.559 -21.019 6.841 1.00 8.38 ? 277 TRP A CH2 1 ATOM 1474 N N . PRO A 1 190 ? 8.128 -20.451 -0.144 1.00 9.38 ? 278 PRO A N 1 ATOM 1475 C CA . PRO A 1 190 ? 8.471 -21.156 -1.391 1.00 9.33 ? 278 PRO A CA 1 ATOM 1476 C C . PRO A 1 190 ? 7.286 -21.587 -2.269 1.00 8.72 ? 278 PRO A C 1 ATOM 1477 O O . PRO A 1 190 ? 7.392 -21.501 -3.493 1.00 9.48 ? 278 PRO A O 1 ATOM 1478 C CB . PRO A 1 190 ? 9.243 -22.364 -0.873 1.00 9.20 ? 278 PRO A CB 1 ATOM 1479 C CG . PRO A 1 190 ? 9.986 -21.757 0.346 1.00 10.78 ? 278 PRO A CG 1 ATOM 1480 C CD . PRO A 1 190 ? 8.981 -20.908 0.976 1.00 9.04 ? 278 PRO A CD 1 ATOM 1481 N N . ALA A 1 191 ? 6.186 -21.998 -1.652 1.00 9.02 ? 279 ALA A N 1 ATOM 1482 C CA . ALA A 1 191 ? 5.017 -22.490 -2.372 1.00 9.08 ? 279 ALA A CA 1 ATOM 1483 C C . ALA A 1 191 ? 4.169 -21.364 -2.992 1.00 9.21 ? 279 ALA A C 1 ATOM 1484 O O . ALA A 1 191 ? 3.323 -21.624 -3.868 1.00 8.69 ? 279 ALA A O 1 ATOM 1485 C CB . ALA A 1 191 ? 4.166 -23.288 -1.420 1.00 9.92 ? 279 ALA A CB 1 ATOM 1486 N N . ASN A 1 192 ? 4.325 -20.145 -2.467 1.00 7.66 ? 280 ASN A N 1 ATOM 1487 C CA . ASN A 1 192 ? 3.574 -18.963 -2.924 1.00 6.98 ? 280 ASN A CA 1 ATOM 1488 C C . ASN A 1 192 ? 4.345 -18.028 -3.823 1.00 7.27 ? 280 ASN A C 1 ATOM 1489 O O . ASN A 1 192 ? 3.775 -17.250 -4.594 1.00 6.56 ? 280 ASN A O 1 ATOM 1490 C CB . ASN A 1 192 ? 3.094 -18.149 -1.708 1.00 6.89 ? 280 ASN A CB 1 ATOM 1491 C CG . ASN A 1 192 ? 2.134 -18.933 -0.830 1.00 8.53 ? 280 ASN A CG 1 ATOM 1492 O OD1 . ASN A 1 192 ? 1.524 -19.940 -1.268 1.00 10.91 ? 280 ASN A OD1 1 ATOM 1493 N ND2 . ASN A 1 192 ? 2.014 -18.503 0.440 1.00 8.14 ? 280 ASN A ND2 1 ATOM 1494 N N . ILE A 1 193 ? 5.663 -18.075 -3.769 1.00 6.44 ? 281 ILE A N 1 ATOM 1495 C CA . ILE A 1 193 ? 6.424 -17.030 -4.415 1.00 6.67 ? 281 ILE A CA 1 ATOM 1496 C C . ILE A 1 193 ? 6.410 -17.030 -5.955 1.00 6.07 ? 281 ILE A C 1 ATOM 1497 O O . ILE A 1 193 ? 6.424 -15.951 -6.553 1.00 5.82 ? 281 ILE A O 1 ATOM 1498 C CB . ILE A 1 193 ? 7.863 -17.002 -3.872 1.00 6.20 ? 281 ILE A CB 1 ATOM 1499 C CG1 . ILE A 1 193 ? 8.504 -15.676 -4.187 1.00 8.70 ? 281 ILE A CG1 1 ATOM 1500 C CG2 . ILE A 1 193 ? 8.694 -18.181 -4.410 1.00 7.76 ? 281 ILE A CG2 1 ATOM 1501 C CD1 . ILE A 1 193 ? 9.809 -15.483 -3.469 1.00 8.76 ? 281 ILE A CD1 1 ATOM 1502 N N . GLN A 1 194 ? 6.376 -18.196 -6.590 1.00 5.41 ? 282 GLN A N 1 ATOM 1503 C CA . GLN A 1 194 ? 6.313 -18.276 -8.054 1.00 6.36 ? 282 GLN A CA 1 ATOM 1504 C C . GLN A 1 194 ? 4.933 -17.872 -8.567 1.00 6.67 ? 282 GLN A C 1 ATOM 1505 O O . GLN A 1 194 ? 4.848 -17.066 -9.499 1.00 6.85 ? 282 GLN A O 1 ATOM 1506 C CB . GLN A 1 194 ? 6.692 -19.646 -8.590 1.00 6.79 ? 282 GLN A CB 1 ATOM 1507 C CG . GLN A 1 194 ? 8.146 -20.020 -8.371 1.00 9.97 ? 282 GLN A CG 1 ATOM 1508 C CD . GLN A 1 194 ? 8.382 -21.561 -8.412 1.00 13.64 ? 282 GLN A CD 1 ATOM 1509 O OE1 . GLN A 1 194 ? 8.165 -22.265 -7.421 1.00 16.48 ? 282 GLN A OE1 1 ATOM 1510 N NE2 . GLN A 1 194 ? 8.781 -22.070 -9.575 1.00 19.35 ? 282 GLN A NE2 1 ATOM 1511 N N . PRO A 1 195 ? 3.848 -18.392 -8.005 1.00 6.65 ? 283 PRO A N 1 ATOM 1512 C CA . PRO A 1 195 ? 2.541 -17.927 -8.483 1.00 7.57 ? 283 PRO A CA 1 ATOM 1513 C C . PRO A 1 195 ? 2.320 -16.419 -8.195 1.00 7.33 ? 283 PRO A C 1 ATOM 1514 O O . PRO A 1 195 ? 1.685 -15.749 -9.033 1.00 7.44 ? 283 PRO A O 1 ATOM 1515 C CB . PRO A 1 195 ? 1.530 -18.840 -7.771 1.00 8.34 ? 283 PRO A CB 1 ATOM 1516 C CG . PRO A 1 195 ? 2.256 -19.450 -6.629 1.00 8.05 ? 283 PRO A CG 1 ATOM 1517 C CD . PRO A 1 195 ? 3.719 -19.466 -7.010 1.00 6.87 ? 283 PRO A CD 1 ATOM 1518 N N . ALA A 1 196 ? 2.913 -15.887 -7.122 1.00 6.98 ? 284 ALA A N 1 ATOM 1519 C CA . ALA A 1 196 ? 2.918 -14.452 -6.886 1.00 6.81 ? 284 ALA A CA 1 ATOM 1520 C C . ALA A 1 196 ? 3.599 -13.716 -8.023 1.00 7.30 ? 284 ALA A C 1 ATOM 1521 O O . ALA A 1 196 ? 3.065 -12.766 -8.584 1.00 6.08 ? 284 ALA A O 1 ATOM 1522 C CB . ALA A 1 196 ? 3.623 -14.128 -5.575 1.00 6.15 ? 284 ALA A CB 1 ATOM 1523 N N . ALA A 1 197 ? 4.807 -14.164 -8.391 1.00 7.60 ? 285 ALA A N 1 ATOM 1524 C CA . ALA A 1 197 ? 5.531 -13.508 -9.463 1.00 7.85 ? 285 ALA A CA 1 ATOM 1525 C C . ALA A 1 197 ? 4.775 -13.550 -10.791 1.00 8.35 ? 285 ALA A C 1 ATOM 1526 O O . ALA A 1 197 ? 4.783 -12.564 -11.554 1.00 8.56 ? 285 ALA A O 1 ATOM 1527 C CB . ALA A 1 197 ? 6.893 -14.145 -9.636 1.00 7.86 ? 285 ALA A CB 1 ATOM 1528 N N . GLU A 1 198 ? 4.102 -14.667 -11.041 1.00 8.40 ? 286 GLU A N 1 ATOM 1529 C CA . GLU A 1 198 ? 3.297 -14.823 -12.245 1.00 9.23 ? 286 GLU A CA 1 ATOM 1530 C C . GLU A 1 198 ? 2.172 -13.794 -12.292 1.00 8.90 ? 286 GLU A C 1 ATOM 1531 O O . GLU A 1 198 ? 1.954 -13.152 -13.332 1.00 8.17 ? 286 GLU A O 1 ATOM 1532 C CB . GLU A 1 198 ? 2.701 -16.211 -12.310 1.00 10.37 ? 286 GLU A CB 1 ATOM 1533 C CG . GLU A 1 198 ? 3.694 -17.286 -12.699 1.00 14.19 ? 286 GLU A CG 1 ATOM 1534 C CD . GLU A 1 198 ? 3.047 -18.671 -12.805 1.00 21.61 ? 286 GLU A CD 1 ATOM 1535 O OE1 . GLU A 1 198 ? 1.885 -18.882 -12.346 1.00 25.03 ? 286 GLU A OE1 1 ATOM 1536 O OE2 . GLU A 1 198 ? 3.705 -19.564 -13.365 1.00 23.28 ? 286 GLU A OE2 1 ATOM 1537 N N . LEU A 1 199 ? 1.493 -13.625 -11.159 1.00 8.70 ? 287 LEU A N 1 ATOM 1538 C CA . LEU A 1 199 ? 0.346 -12.738 -11.086 1.00 9.26 ? 287 LEU A CA 1 ATOM 1539 C C . LEU A 1 199 ? 0.790 -11.285 -11.256 1.00 8.71 ? 287 LEU A C 1 ATOM 1540 O O . LEU A 1 199 ? 0.230 -10.566 -12.069 1.00 9.78 ? 287 LEU A O 1 ATOM 1541 C CB . LEU A 1 199 ? -0.434 -12.906 -9.800 1.00 9.52 ? 287 LEU A CB 1 ATOM 1542 C CG . LEU A 1 199 ? -1.587 -11.906 -9.651 1.00 13.81 ? 287 LEU A CG 1 ATOM 1543 C CD1 . LEU A 1 199 ? -2.611 -12.088 -10.770 1.00 15.74 ? 287 LEU A CD1 1 ATOM 1544 C CD2 . LEU A 1 199 ? -2.218 -12.060 -8.301 1.00 18.61 ? 287 LEU A CD2 1 ATOM 1545 N N . PHE A 1 200 ? 1.786 -10.838 -10.502 1.00 8.55 ? 288 PHE A N 1 ATOM 1546 C CA . PHE A 1 200 ? 2.187 -9.438 -10.575 1.00 8.77 ? 288 PHE A CA 1 ATOM 1547 C C . PHE A 1 200 ? 2.727 -9.080 -11.946 1.00 8.67 ? 288 PHE A C 1 ATOM 1548 O O . PHE A 1 200 ? 2.384 -8.029 -12.512 1.00 8.86 ? 288 PHE A O 1 ATOM 1549 C CB . PHE A 1 200 ? 3.181 -9.112 -9.463 1.00 10.74 ? 288 PHE A CB 1 ATOM 1550 C CG . PHE A 1 200 ? 2.537 -8.979 -8.111 1.00 8.98 ? 288 PHE A CG 1 ATOM 1551 C CD1 . PHE A 1 200 ? 1.940 -7.791 -7.728 1.00 11.58 ? 288 PHE A CD1 1 ATOM 1552 C CD2 . PHE A 1 200 ? 2.479 -10.060 -7.235 1.00 10.92 ? 288 PHE A CD2 1 ATOM 1553 C CE1 . PHE A 1 200 ? 1.343 -7.698 -6.491 1.00 12.50 ? 288 PHE A CE1 1 ATOM 1554 C CE2 . PHE A 1 200 ? 1.858 -9.957 -5.991 1.00 10.59 ? 288 PHE A CE2 1 ATOM 1555 C CZ . PHE A 1 200 ? 1.283 -8.791 -5.637 1.00 9.62 ? 288 PHE A CZ 1 ATOM 1556 N N . ALA A 1 201 ? 3.527 -9.965 -12.529 1.00 7.76 ? 289 ALA A N 1 ATOM 1557 C CA . ALA A 1 201 ? 4.070 -9.689 -13.846 1.00 7.74 ? 289 ALA A CA 1 ATOM 1558 C C . ALA A 1 201 ? 2.978 -9.680 -14.911 1.00 8.31 ? 289 ALA A C 1 ATOM 1559 O O . ALA A 1 201 ? 3.041 -8.875 -15.826 1.00 8.59 ? 289 ALA A O 1 ATOM 1560 C CB . ALA A 1 201 ? 5.125 -10.658 -14.198 1.00 8.90 ? 289 ALA A CB 1 ATOM 1561 N N . LYS A 1 202 ? 1.974 -10.528 -14.766 1.00 8.23 ? 290 LYS A N 1 ATOM 1562 C CA . LYS A 1 202 ? 0.894 -10.544 -15.761 1.00 9.02 ? 290 LYS A CA 1 ATOM 1563 C C . LYS A 1 202 ? 0.067 -9.271 -15.653 1.00 8.74 ? 290 LYS A C 1 ATOM 1564 O O . LYS A 1 202 ? -0.326 -8.710 -16.679 1.00 8.45 ? 290 LYS A O 1 ATOM 1565 C CB . LYS A 1 202 ? 0.013 -11.797 -15.660 1.00 10.01 ? 290 LYS A CB 1 ATOM 1566 C CG . LYS A 1 202 ? -0.961 -11.904 -16.821 1.00 14.65 ? 290 LYS A CG 1 ATOM 1567 C CD . LYS A 1 202 ? -1.736 -13.219 -16.890 1.00 22.30 ? 290 LYS A CD 1 ATOM 1568 C CE . LYS A 1 202 ? -2.902 -13.185 -17.939 1.00 24.25 ? 290 LYS A CE 1 ATOM 1569 N NZ . LYS A 1 202 ? -2.630 -12.326 -19.160 1.00 27.13 ? 290 LYS A NZ 1 ATOM 1570 N N . ILE A 1 203 ? -0.205 -8.811 -14.425 1.00 8.88 ? 291 ILE A N 1 ATOM 1571 C CA . ILE A 1 203 ? -0.973 -7.572 -14.226 1.00 9.79 ? 291 ILE A CA 1 ATOM 1572 C C . ILE A 1 203 ? -0.170 -6.430 -14.880 1.00 9.29 ? 291 ILE A C 1 ATOM 1573 O O . ILE A 1 203 ? -0.706 -5.608 -15.624 1.00 9.26 ? 291 ILE A O 1 ATOM 1574 C CB . ILE A 1 203 ? -1.212 -7.285 -12.756 1.00 10.22 ? 291 ILE A CB 1 ATOM 1575 C CG1 . ILE A 1 203 ? -2.234 -8.225 -12.132 1.00 14.23 ? 291 ILE A CG1 1 ATOM 1576 C CG2 . ILE A 1 203 ? -1.619 -5.782 -12.500 1.00 12.11 ? 291 ILE A CG2 1 ATOM 1577 C CD1 . ILE A 1 203 ? -3.582 -8.041 -12.661 1.00 19.58 ? 291 ILE A CD1 1 ATOM 1578 N N . TYR A 1 204 ? 1.120 -6.418 -14.635 1.00 8.85 ? 292 TYR A N 1 ATOM 1579 C CA . TYR A 1 204 ? 1.998 -5.381 -15.181 1.00 8.18 ? 292 TYR A CA 1 ATOM 1580 C C . TYR A 1 204 ? 1.941 -5.371 -16.698 1.00 8.54 ? 292 TYR A C 1 ATOM 1581 O O . TYR A 1 204 ? 1.763 -4.329 -17.302 1.00 6.89 ? 292 TYR A O 1 ATOM 1582 C CB . TYR A 1 204 ? 3.417 -5.617 -14.673 1.00 8.11 ? 292 TYR A CB 1 ATOM 1583 C CG . TYR A 1 204 ? 4.442 -4.622 -15.117 1.00 8.69 ? 292 TYR A CG 1 ATOM 1584 C CD1 . TYR A 1 204 ? 4.367 -3.296 -14.716 1.00 10.18 ? 292 TYR A CD1 1 ATOM 1585 C CD2 . TYR A 1 204 ? 5.534 -5.008 -15.897 1.00 9.89 ? 292 TYR A CD2 1 ATOM 1586 C CE1 . TYR A 1 204 ? 5.343 -2.368 -15.129 1.00 9.14 ? 292 TYR A CE1 1 ATOM 1587 C CE2 . TYR A 1 204 ? 6.512 -4.111 -16.279 1.00 9.52 ? 292 TYR A CE2 1 ATOM 1588 C CZ . TYR A 1 204 ? 6.411 -2.783 -15.908 1.00 9.42 ? 292 TYR A CZ 1 ATOM 1589 O OH . TYR A 1 204 ? 7.444 -1.918 -16.303 1.00 6.83 ? 292 TYR A OH 1 ATOM 1590 N N . GLU A 1 205 ? 2.080 -6.534 -17.330 1.00 8.52 ? 293 GLU A N 1 ATOM 1591 C CA . GLU A 1 205 ? 2.003 -6.621 -18.774 1.00 8.36 ? 293 GLU A CA 1 ATOM 1592 C C . GLU A 1 205 ? 0.615 -6.211 -19.272 1.00 8.10 ? 293 GLU A C 1 ATOM 1593 O O . GLU A 1 205 ? 0.490 -5.484 -20.260 1.00 6.97 ? 293 GLU A O 1 ATOM 1594 C CB . GLU A 1 205 ? 2.429 -8.049 -19.250 1.00 9.61 ? 293 GLU A CB 1 ATOM 1595 C CG . GLU A 1 205 ? 1.773 -8.609 -20.472 1.00 13.67 ? 293 GLU A CG 1 ATOM 1596 C CD . GLU A 1 205 ? 2.250 -10.026 -20.752 1.00 18.77 ? 293 GLU A CD 1 ATOM 1597 O OE1 . GLU A 1 205 ? 3.350 -10.435 -20.237 1.00 20.06 ? 293 GLU A OE1 1 ATOM 1598 O OE2 . GLU A 1 205 ? 1.491 -10.723 -21.448 1.00 20.92 ? 293 GLU A OE2 1 ATOM 1599 N N . ASP A 1 206 ? -0.435 -6.647 -18.595 1.00 7.64 ? 294 ASP A N 1 ATOM 1600 C CA . ASP A 1 206 ? -1.790 -6.394 -19.086 1.00 8.85 ? 294 ASP A CA 1 ATOM 1601 C C . ASP A 1 206 ? -2.147 -4.929 -18.936 1.00 9.16 ? 294 ASP A C 1 ATOM 1602 O O . ASP A 1 206 ? -3.037 -4.446 -19.633 1.00 9.85 ? 294 ASP A O 1 ATOM 1603 C CB . ASP A 1 206 ? -2.827 -7.256 -18.353 1.00 8.97 ? 294 ASP A CB 1 ATOM 1604 C CG . ASP A 1 206 ? -2.812 -8.700 -18.788 1.00 11.41 ? 294 ASP A CG 1 ATOM 1605 O OD1 . ASP A 1 206 ? -2.259 -9.035 -19.859 1.00 15.40 ? 294 ASP A OD1 1 ATOM 1606 O OD2 . ASP A 1 206 ? -3.366 -9.591 -18.116 1.00 17.91 ? 294 ASP A OD2 1 ATOM 1607 N N . ALA A 1 207 ? -1.451 -4.215 -18.050 1.00 8.99 ? 295 ALA A N 1 ATOM 1608 C CA . ALA A 1 207 ? -1.644 -2.778 -17.855 1.00 8.64 ? 295 ALA A CA 1 ATOM 1609 C C . ALA A 1 207 ? -0.867 -1.965 -18.912 1.00 8.82 ? 295 ALA A C 1 ATOM 1610 O O . ALA A 1 207 ? -0.922 -0.732 -18.908 1.00 8.68 ? 295 ALA A O 1 ATOM 1611 C CB . ALA A 1 207 ? -1.202 -2.371 -16.492 1.00 9.13 ? 295 ALA A CB 1 ATOM 1612 N N . GLY A 1 208 ? -0.126 -2.647 -19.782 1.00 7.25 ? 296 GLY A N 1 ATOM 1613 C CA . GLY A 1 208 ? 0.716 -2.004 -20.780 1.00 7.36 ? 296 GLY A CA 1 ATOM 1614 C C . GLY A 1 208 ? 2.045 -1.522 -20.245 1.00 6.44 ? 296 GLY A C 1 ATOM 1615 O O . GLY A 1 208 ? 2.666 -0.668 -20.869 1.00 6.20 ? 296 GLY A O 1 ATOM 1616 N N . LYS A 1 209 ? 2.483 -2.075 -19.116 1.00 6.50 ? 297 LYS A N 1 ATOM 1617 C CA . LYS A 1 209 ? 3.761 -1.725 -18.465 1.00 7.32 ? 297 LYS A CA 1 ATOM 1618 C C . LYS A 1 209 ? 3.885 -0.203 -18.276 1.00 7.28 ? 297 LYS A C 1 ATOM 1619 O O . LYS A 1 209 ? 4.814 0.434 -18.824 1.00 7.01 ? 297 LYS A O 1 ATOM 1620 C CB . LYS A 1 209 ? 4.962 -2.307 -19.253 1.00 7.94 ? 297 LYS A CB 1 ATOM 1621 C CG . LYS A 1 209 ? 4.849 -3.838 -19.495 1.00 9.36 ? 297 LYS A CG 1 ATOM 1622 C CD . LYS A 1 209 ? 6.133 -4.421 -20.092 1.00 11.19 ? 297 LYS A CD 1 ATOM 1623 C CE . LYS A 1 209 ? 6.181 -5.910 -19.864 1.00 15.33 ? 297 LYS A CE 1 ATOM 1624 N NZ . LYS A 1 209 ? 7.308 -6.532 -20.608 1.00 15.12 ? 297 LYS A NZ 1 ATOM 1625 N N . PRO A 1 210 ? 2.961 0.395 -17.524 1.00 6.35 ? 298 PRO A N 1 ATOM 1626 C CA . PRO A 1 210 ? 2.956 1.855 -17.427 1.00 6.86 ? 298 PRO A CA 1 ATOM 1627 C C . PRO A 1 210 ? 4.275 2.346 -16.833 1.00 6.71 ? 298 PRO A C 1 ATOM 1628 O O . PRO A 1 210 ? 4.764 1.806 -15.827 1.00 7.19 ? 298 PRO A O 1 ATOM 1629 C CB . PRO A 1 210 ? 1.809 2.142 -16.436 1.00 7.42 ? 298 PRO A CB 1 ATOM 1630 C CG . PRO A 1 210 ? 0.952 0.912 -16.480 1.00 8.81 ? 298 PRO A CG 1 ATOM 1631 C CD . PRO A 1 210 ? 1.926 -0.207 -16.666 1.00 7.17 ? 298 PRO A CD 1 ATOM 1632 N N . ARG A 1 211 ? 4.826 3.388 -17.446 1.00 6.20 ? 299 ARG A N 1 ATOM 1633 C CA . ARG A 1 211 ? 6.080 4.001 -17.017 1.00 7.33 ? 299 ARG A CA 1 ATOM 1634 C C . ARG A 1 211 ? 6.122 4.329 -15.528 1.00 5.95 ? 299 ARG A C 1 ATOM 1635 O O . ARG A 1 211 ? 7.156 4.191 -14.881 1.00 6.18 ? 299 ARG A O 1 ATOM 1636 C CB . ARG A 1 211 ? 6.309 5.295 -17.834 1.00 7.11 ? 299 ARG A CB 1 ATOM 1637 C CG . ARG A 1 211 ? 7.613 6.067 -17.532 1.00 10.40 ? 299 ARG A CG 1 ATOM 1638 C CD . ARG A 1 211 ? 7.500 7.666 -17.473 1.00 13.04 ? 299 ARG A CD 1 ATOM 1639 N NE . ARG A 1 211 ? 6.588 8.097 -16.450 1.00 13.04 ? 299 ARG A NE 1 ATOM 1640 C CZ . ARG A 1 211 ? 6.872 8.140 -15.159 1.00 12.61 ? 299 ARG A CZ 1 ATOM 1641 N NH1 . ARG A 1 211 ? 8.080 7.786 -14.702 1.00 14.37 ? 299 ARG A NH1 1 ATOM 1642 N NH2 . ARG A 1 211 ? 5.939 8.534 -14.296 1.00 16.10 ? 299 ARG A NH2 1 ATOM 1643 N N . ALA A 1 212 ? 5.004 4.785 -14.985 1.00 6.89 ? 300 ALA A N 1 ATOM 1644 C CA . ALA A 1 212 ? 4.945 5.229 -13.587 1.00 6.99 ? 300 ALA A CA 1 ATOM 1645 C C . ALA A 1 212 ? 4.995 4.106 -12.590 1.00 7.55 ? 300 ALA A C 1 ATOM 1646 O O . ALA A 1 212 ? 5.260 4.348 -11.439 1.00 9.63 ? 300 ALA A O 1 ATOM 1647 C CB . ALA A 1 212 ? 3.731 6.057 -13.352 1.00 6.53 ? 300 ALA A CB 1 ATOM 1648 N N . VAL A 1 213 ? 4.786 2.867 -13.035 1.00 6.65 ? 301 VAL A N 1 ATOM 1649 C CA . VAL A 1 213 ? 4.922 1.694 -12.142 1.00 7.43 ? 301 VAL A CA 1 ATOM 1650 C C . VAL A 1 213 ? 6.380 1.389 -11.886 1.00 6.87 ? 301 VAL A C 1 ATOM 1651 O O . VAL A 1 213 ? 7.130 0.968 -12.759 1.00 8.20 ? 301 VAL A O 1 ATOM 1652 C CB . VAL A 1 213 ? 4.194 0.463 -12.658 1.00 6.65 ? 301 VAL A CB 1 ATOM 1653 C CG1 . VAL A 1 213 ? 4.521 -0.771 -11.777 1.00 8.86 ? 301 VAL A CG1 1 ATOM 1654 C CG2 . VAL A 1 213 ? 2.707 0.749 -12.741 1.00 9.57 ? 301 VAL A CG2 1 ATOM 1655 N N . ARG A 1 214 ? 6.815 1.712 -10.686 1.00 8.14 ? 302 ARG A N 1 ATOM 1656 C CA . ARG A 1 214 ? 8.192 1.581 -10.273 1.00 6.49 ? 302 ARG A CA 1 ATOM 1657 C C . ARG A 1 214 ? 8.472 0.182 -9.705 1.00 7.25 ? 302 ARG A C 1 ATOM 1658 O O . ARG A 1 214 ? 9.580 -0.325 -9.826 1.00 7.93 ? 302 ARG A O 1 ATOM 1659 C CB . ARG A 1 214 ? 8.458 2.623 -9.201 1.00 7.87 ? 302 ARG A CB 1 ATOM 1660 C CG . ARG A 1 214 ? 9.806 2.681 -8.680 1.00 9.50 ? 302 ARG A CG 1 ATOM 1661 C CD . ARG A 1 214 ? 10.897 3.089 -9.649 1.00 9.71 ? 302 ARG A CD 1 ATOM 1662 N NE . ARG A 1 214 ? 12.188 3.085 -8.971 1.00 9.24 ? 302 ARG A NE 1 ATOM 1663 C CZ . ARG A 1 214 ? 13.350 3.259 -9.578 1.00 6.92 ? 302 ARG A CZ 1 ATOM 1664 N NH1 . ARG A 1 214 ? 13.385 3.457 -10.902 1.00 9.04 ? 302 ARG A NH1 1 ATOM 1665 N NH2 . ARG A 1 214 ? 14.502 3.200 -8.905 1.00 6.71 ? 302 ARG A NH2 1 ATOM 1666 N N . GLY A 1 215 ? 7.463 -0.441 -9.133 1.00 6.98 ? 303 GLY A N 1 ATOM 1667 C CA . GLY A 1 215 ? 7.661 -1.740 -8.507 1.00 7.05 ? 303 GLY A CA 1 ATOM 1668 C C . GLY A 1 215 ? 6.631 -2.104 -7.497 1.00 6.09 ? 303 GLY A C 1 ATOM 1669 O O . GLY A 1 215 ? 5.455 -1.957 -7.746 1.00 6.27 ? 303 GLY A O 1 ATOM 1670 N N . LEU A 1 216 ? 7.069 -2.630 -6.358 1.00 5.98 ? 304 LEU A N 1 ATOM 1671 C CA . LEU A 1 216 ? 6.202 -3.250 -5.375 1.00 6.00 ? 304 LEU A CA 1 ATOM 1672 C C . LEU A 1 216 ? 6.555 -2.753 -3.990 1.00 6.79 ? 304 LEU A C 1 ATOM 1673 O O . LEU A 1 216 ? 7.684 -2.386 -3.740 1.00 7.18 ? 304 LEU A O 1 ATOM 1674 C CB . LEU A 1 216 ? 6.335 -4.780 -5.411 1.00 5.95 ? 304 LEU A CB 1 ATOM 1675 C CG . LEU A 1 216 ? 6.011 -5.438 -6.762 1.00 5.74 ? 304 LEU A CG 1 ATOM 1676 C CD1 . LEU A 1 216 ? 6.439 -6.906 -6.691 1.00 7.41 ? 304 LEU A CD1 1 ATOM 1677 C CD2 . LEU A 1 216 ? 4.582 -5.254 -7.097 1.00 8.01 ? 304 LEU A CD2 1 ATOM 1678 N N . ALA A 1 217 ? 5.564 -2.783 -3.100 1.00 7.27 ? 305 ALA A N 1 ATOM 1679 C CA . ALA A 1 217 ? 5.745 -2.444 -1.709 1.00 6.42 ? 305 ALA A CA 1 ATOM 1680 C C . ALA A 1 217 ? 5.617 -3.746 -0.921 1.00 7.94 ? 305 ALA A C 1 ATOM 1681 O O . ALA A 1 217 ? 4.710 -4.549 -1.198 1.00 8.43 ? 305 ALA A O 1 ATOM 1682 C CB . ALA A 1 217 ? 4.664 -1.470 -1.262 1.00 6.75 ? 305 ALA A CB 1 ATOM 1683 N N . THR A 1 218 ? 6.463 -3.927 0.083 1.00 6.81 ? 306 THR A N 1 ATOM 1684 C CA . THR A 1 218 ? 6.349 -5.100 0.971 1.00 7.10 ? 306 THR A CA 1 ATOM 1685 C C . THR A 1 218 ? 6.254 -4.743 2.436 1.00 6.87 ? 306 THR A C 1 ATOM 1686 O O . THR A 1 218 ? 6.625 -3.657 2.837 1.00 7.97 ? 306 THR A O 1 ATOM 1687 C CB . THR A 1 218 ? 7.497 -6.120 0.749 1.00 6.36 ? 306 THR A CB 1 ATOM 1688 O OG1 . THR A 1 218 ? 8.712 -5.607 1.263 1.00 11.91 ? 306 THR A OG1 1 ATOM 1689 C CG2 . THR A 1 218 ? 7.745 -6.374 -0.772 1.00 10.70 ? 306 THR A CG2 1 ATOM 1690 N N . ASN A 1 219 ? 5.676 -5.654 3.207 1.00 6.28 ? 307 ASN A N 1 ATOM 1691 C CA . ASN A 1 219 ? 5.591 -5.544 4.671 1.00 7.12 ? 307 ASN A CA 1 ATOM 1692 C C . ASN A 1 219 ? 4.599 -4.493 5.149 1.00 6.62 ? 307 ASN A C 1 ATOM 1693 O O . ASN A 1 219 ? 4.617 -4.117 6.300 1.00 6.71 ? 307 ASN A O 1 ATOM 1694 C CB . ASN A 1 219 ? 6.945 -5.334 5.313 1.00 6.45 ? 307 ASN A CB 1 ATOM 1695 C CG . ASN A 1 219 ? 7.002 -5.859 6.753 1.00 6.67 ? 307 ASN A CG 1 ATOM 1696 O OD1 . ASN A 1 219 ? 6.468 -6.925 7.052 1.00 6.14 ? 307 ASN A OD1 1 ATOM 1697 N ND2 . ASN A 1 219 ? 7.590 -5.069 7.674 1.00 8.27 ? 307 ASN A ND2 1 ATOM 1698 N N . VAL A 1 220 ? 3.715 -4.046 4.268 1.00 6.61 ? 308 VAL A N 1 ATOM 1699 C CA . VAL A 1 220 ? 2.782 -2.995 4.640 1.00 7.10 ? 308 VAL A CA 1 ATOM 1700 C C . VAL A 1 220 ? 1.858 -3.471 5.758 1.00 7.00 ? 308 VAL A C 1 ATOM 1701 O O . VAL A 1 220 ? 1.198 -4.553 5.639 1.00 7.37 ? 308 VAL A O 1 ATOM 1702 C CB . VAL A 1 220 ? 1.902 -2.567 3.416 1.00 8.53 ? 308 VAL A CB 1 ATOM 1703 C CG1 . VAL A 1 220 ? 0.838 -1.583 3.862 1.00 8.35 ? 308 VAL A CG1 1 ATOM 1704 C CG2 . VAL A 1 220 ? 2.813 -1.889 2.360 1.00 7.68 ? 308 VAL A CG2 1 ATOM 1705 N N . ALA A 1 221 ? 1.785 -2.694 6.845 1.00 6.44 ? 309 ALA A N 1 ATOM 1706 C CA . ALA A 1 221 ? 0.987 -3.055 8.018 1.00 6.77 ? 309 ALA A CA 1 ATOM 1707 C C . ALA A 1 221 ? 1.406 -4.376 8.687 1.00 6.99 ? 309 ALA A C 1 ATOM 1708 O O . ALA A 1 221 ? 0.626 -5.019 9.405 1.00 9.23 ? 309 ALA A O 1 ATOM 1709 C CB . ALA A 1 221 ? -0.523 -3.022 7.703 1.00 7.45 ? 309 ALA A CB 1 ATOM 1710 N N . ASN A 1 222 ? 2.635 -4.805 8.435 1.00 8.46 ? 310 ASN A N 1 ATOM 1711 C CA . ASN A 1 222 ? 3.175 -5.971 9.104 1.00 7.89 ? 310 ASN A CA 1 ATOM 1712 C C . ASN A 1 222 ? 4.481 -5.583 9.816 1.00 7.11 ? 310 ASN A C 1 ATOM 1713 O O . ASN A 1 222 ? 4.730 -4.391 10.008 1.00 6.87 ? 310 ASN A O 1 ATOM 1714 C CB . ASN A 1 222 ? 3.307 -7.143 8.128 1.00 7.64 ? 310 ASN A CB 1 ATOM 1715 C CG . ASN A 1 222 ? 3.086 -8.500 8.822 1.00 9.77 ? 310 ASN A CG 1 ATOM 1716 O OD1 . ASN A 1 222 ? 3.933 -8.921 9.640 1.00 10.32 ? 310 ASN A OD1 1 ATOM 1717 N ND2 . ASN A 1 222 ? 1.929 -9.154 8.546 1.00 8.82 ? 310 ASN A ND2 1 ATOM 1718 N N . TYR A 1 223 ? 5.234 -6.573 10.289 1.00 6.72 ? 311 TYR A N 1 ATOM 1719 C CA . TYR A 1 223 ? 6.230 -6.354 11.333 1.00 5.93 ? 311 TYR A CA 1 ATOM 1720 C C . TYR A 1 223 ? 7.596 -6.938 11.010 1.00 7.25 ? 311 TYR A C 1 ATOM 1721 O O . TYR A 1 223 ? 8.452 -6.967 11.884 1.00 7.44 ? 311 TYR A O 1 ATOM 1722 C CB . TYR A 1 223 ? 5.740 -6.992 12.625 1.00 6.37 ? 311 TYR A CB 1 ATOM 1723 C CG . TYR A 1 223 ? 4.318 -6.682 12.966 1.00 7.34 ? 311 TYR A CG 1 ATOM 1724 C CD1 . TYR A 1 223 ? 3.986 -5.509 13.611 1.00 8.67 ? 311 TYR A CD1 1 ATOM 1725 C CD2 . TYR A 1 223 ? 3.313 -7.584 12.678 1.00 10.04 ? 311 TYR A CD2 1 ATOM 1726 C CE1 . TYR A 1 223 ? 2.645 -5.257 13.965 1.00 6.19 ? 311 TYR A CE1 1 ATOM 1727 C CE2 . TYR A 1 223 ? 2.005 -7.345 12.998 1.00 8.25 ? 311 TYR A CE2 1 ATOM 1728 C CZ . TYR A 1 223 ? 1.667 -6.182 13.648 1.00 8.05 ? 311 TYR A CZ 1 ATOM 1729 O OH . TYR A 1 223 ? 0.323 -5.995 13.978 1.00 10.69 ? 311 TYR A OH 1 ATOM 1730 N N . ASN A 1 224 ? 7.764 -7.467 9.803 1.00 6.16 ? 312 ASN A N 1 ATOM 1731 C CA . ASN A 1 224 ? 8.943 -8.246 9.502 1.00 6.90 ? 312 ASN A CA 1 ATOM 1732 C C . ASN A 1 224 ? 10.187 -7.380 9.531 1.00 6.96 ? 312 ASN A C 1 ATOM 1733 O O . ASN A 1 224 ? 10.141 -6.183 9.235 1.00 6.99 ? 312 ASN A O 1 ATOM 1734 C CB . ASN A 1 224 ? 8.868 -8.901 8.153 1.00 6.36 ? 312 ASN A CB 1 ATOM 1735 C CG . ASN A 1 224 ? 7.716 -9.908 8.048 1.00 10.28 ? 312 ASN A CG 1 ATOM 1736 O OD1 . ASN A 1 224 ? 7.209 -10.406 9.054 1.00 11.52 ? 312 ASN A OD1 1 ATOM 1737 N ND2 . ASN A 1 224 ? 7.375 -10.259 6.832 1.00 8.90 ? 312 ASN A ND2 1 ATOM 1738 N N . ALA A 1 225 ? 11.288 -8.024 9.864 1.00 6.61 ? 313 ALA A N 1 ATOM 1739 C CA . ALA A 1 225 ? 12.602 -7.404 9.772 1.00 6.94 ? 313 ALA A CA 1 ATOM 1740 C C . ALA A 1 225 ? 12.985 -7.160 8.305 1.00 7.64 ? 313 ALA A C 1 ATOM 1741 O O . ALA A 1 225 ? 12.646 -7.951 7.421 1.00 7.00 ? 313 ALA A O 1 ATOM 1742 C CB . ALA A 1 225 ? 13.629 -8.289 10.415 1.00 7.59 ? 313 ALA A CB 1 ATOM 1743 N N . TRP A 1 226 ? 13.715 -6.085 8.048 1.00 7.05 ? 314 TRP A N 1 ATOM 1744 C CA . TRP A 1 226 ? 14.423 -5.965 6.787 1.00 7.97 ? 314 TRP A CA 1 ATOM 1745 C C . TRP A 1 226 ? 15.496 -7.042 6.766 1.00 8.37 ? 314 TRP A C 1 ATOM 1746 O O . TRP A 1 226 ? 15.516 -7.862 5.857 1.00 8.80 ? 314 TRP A O 1 ATOM 1747 C CB . TRP A 1 226 ? 15.046 -4.584 6.635 1.00 8.18 ? 314 TRP A CB 1 ATOM 1748 C CG . TRP A 1 226 ? 16.203 -4.564 5.689 1.00 7.71 ? 314 TRP A CG 1 ATOM 1749 C CD1 . TRP A 1 226 ? 17.466 -4.267 5.995 1.00 10.69 ? 314 TRP A CD1 1 ATOM 1750 C CD2 . TRP A 1 226 ? 16.187 -4.872 4.287 1.00 8.47 ? 314 TRP A CD2 1 ATOM 1751 N NE1 . TRP A 1 226 ? 18.262 -4.340 4.875 1.00 9.05 ? 314 TRP A NE1 1 ATOM 1752 C CE2 . TRP A 1 226 ? 17.494 -4.692 3.809 1.00 7.51 ? 314 TRP A CE2 1 ATOM 1753 C CE3 . TRP A 1 226 ? 15.189 -5.192 3.374 1.00 7.97 ? 314 TRP A CE3 1 ATOM 1754 C CZ2 . TRP A 1 226 ? 17.834 -4.898 2.483 1.00 7.28 ? 314 TRP A CZ2 1 ATOM 1755 C CZ3 . TRP A 1 226 ? 15.515 -5.390 2.059 1.00 7.31 ? 314 TRP A CZ3 1 ATOM 1756 C CH2 . TRP A 1 226 ? 16.838 -5.271 1.625 1.00 7.48 ? 314 TRP A CH2 1 ATOM 1757 N N . SER A 1 227 ? 16.358 -7.078 7.773 1.00 8.21 ? 315 SER A N 1 ATOM 1758 C CA . SER A 1 227 ? 17.469 -8.021 7.773 1.00 9.25 ? 315 SER A CA 1 ATOM 1759 C C . SER A 1 227 ? 17.862 -8.378 9.199 1.00 10.73 ? 315 SER A C 1 ATOM 1760 O O . SER A 1 227 ? 18.131 -7.489 10.026 1.00 11.45 ? 315 SER A O 1 ATOM 1761 C CB . SER A 1 227 ? 18.677 -7.492 7.001 1.00 9.44 ? 315 SER A CB 1 ATOM 1762 O OG . SER A 1 227 ? 19.744 -8.421 6.950 1.00 8.94 ? 315 SER A OG 1 ATOM 1763 N N . VAL A 1 228 ? 17.764 -9.667 9.496 1.00 11.25 ? 316 VAL A N 1 ATOM 1764 C CA . VAL A 1 228 ? 18.228 -10.203 10.782 1.00 12.52 ? 316 VAL A CA 1 ATOM 1765 C C . VAL A 1 228 ? 19.143 -11.382 10.518 1.00 11.91 ? 316 VAL A C 1 ATOM 1766 O O . VAL A 1 228 ? 19.071 -12.036 9.470 1.00 12.00 ? 316 VAL A O 1 ATOM 1767 C CB . VAL A 1 228 ? 17.084 -10.609 11.740 1.00 13.06 ? 316 VAL A CB 1 ATOM 1768 C CG1 . VAL A 1 228 ? 16.495 -9.418 12.397 1.00 16.74 ? 316 VAL A CG1 1 ATOM 1769 C CG2 . VAL A 1 228 ? 16.019 -11.477 11.027 1.00 13.08 ? 316 VAL A CG2 1 ATOM 1770 N N . SER A 1 229 ? 20.018 -11.673 11.479 1.00 11.70 ? 317 SER A N 1 ATOM 1771 C CA . SER A 1 229 ? 21.056 -12.674 11.310 1.00 12.51 ? 317 SER A CA 1 ATOM 1772 C C . SER A 1 229 ? 20.575 -14.121 11.469 1.00 11.95 ? 317 SER A C 1 ATOM 1773 O O . SER A 1 229 ? 21.273 -15.048 11.091 1.00 12.00 ? 317 SER A O 1 ATOM 1774 C CB . SER A 1 229 ? 22.204 -12.437 12.320 1.00 13.05 ? 317 SER A CB 1 ATOM 1775 O OG . SER A 1 229 ? 21.705 -12.367 13.656 1.00 15.87 ? 317 SER A OG 1 ATOM 1776 N N . SER A 1 230 ? 19.409 -14.317 12.071 1.00 10.67 ? 318 SER A N 1 ATOM 1777 C CA . SER A 1 230 ? 18.895 -15.676 12.277 1.00 11.11 ? 318 SER A CA 1 ATOM 1778 C C . SER A 1 230 ? 17.363 -15.610 12.177 1.00 9.81 ? 318 SER A C 1 ATOM 1779 O O . SER A 1 230 ? 16.787 -14.609 12.531 1.00 9.94 ? 318 SER A O 1 ATOM 1780 C CB . SER A 1 230 ? 19.363 -16.271 13.635 1.00 11.10 ? 318 SER A CB 1 ATOM 1781 O OG . SER A 1 230 ? 18.756 -15.602 14.742 1.00 15.22 ? 318 SER A OG 1 ATOM 1782 N N . PRO A 1 231 ? 16.723 -16.666 11.691 1.00 9.79 ? 319 PRO A N 1 ATOM 1783 C CA . PRO A 1 231 ? 15.271 -16.641 11.535 1.00 9.77 ? 319 PRO A CA 1 ATOM 1784 C C . PRO A 1 231 ? 14.540 -16.553 12.865 1.00 9.74 ? 319 PRO A C 1 ATOM 1785 O O . PRO A 1 231 ? 14.802 -17.406 13.725 1.00 10.14 ? 319 PRO A O 1 ATOM 1786 C CB . PRO A 1 231 ? 14.962 -17.976 10.848 1.00 9.32 ? 319 PRO A CB 1 ATOM 1787 C CG . PRO A 1 231 ? 16.136 -18.844 11.101 1.00 10.85 ? 319 PRO A CG 1 ATOM 1788 C CD . PRO A 1 231 ? 17.305 -17.924 11.213 1.00 10.53 ? 319 PRO A CD 1 ATOM 1789 N N . PRO A 1 232 ? 13.621 -15.621 13.037 1.00 8.72 ? 320 PRO A N 1 ATOM 1790 C CA . PRO A 1 232 ? 12.736 -15.700 14.206 1.00 10.09 ? 320 PRO A CA 1 ATOM 1791 C C . PRO A 1 232 ? 11.985 -17.044 14.238 1.00 10.11 ? 320 PRO A C 1 ATOM 1792 O O . PRO A 1 232 ? 11.723 -17.639 13.186 1.00 10.86 ? 320 PRO A O 1 ATOM 1793 C CB . PRO A 1 232 ? 11.824 -14.515 14.039 1.00 10.52 ? 320 PRO A CB 1 ATOM 1794 C CG . PRO A 1 232 ? 12.605 -13.584 13.124 1.00 10.01 ? 320 PRO A CG 1 ATOM 1795 C CD . PRO A 1 232 ? 13.307 -14.461 12.182 1.00 8.94 ? 320 PRO A CD 1 ATOM 1796 N N . PRO A 1 233 ? 11.741 -17.592 15.430 1.00 10.29 ? 321 PRO A N 1 ATOM 1797 C CA . PRO A 1 233 ? 11.156 -18.932 15.541 1.00 10.08 ? 321 PRO A CA 1 ATOM 1798 C C . PRO A 1 233 ? 9.897 -19.138 14.750 1.00 9.05 ? 321 PRO A C 1 ATOM 1799 O O . PRO A 1 233 ? 9.740 -20.209 14.138 1.00 9.96 ? 321 PRO A O 1 ATOM 1800 C CB . PRO A 1 233 ? 10.862 -19.072 17.044 1.00 9.91 ? 321 PRO A CB 1 ATOM 1801 C CG . PRO A 1 233 ? 11.936 -18.232 17.657 1.00 10.22 ? 321 PRO A CG 1 ATOM 1802 C CD . PRO A 1 233 ? 12.071 -17.035 16.756 1.00 11.34 ? 321 PRO A CD 1 ATOM 1803 N N . TYR A 1 234 ? 9.031 -18.135 14.766 1.00 8.86 ? 322 TYR A N 1 ATOM 1804 C CA . TYR A 1 234 ? 7.732 -18.210 14.086 1.00 8.41 ? 322 TYR A CA 1 ATOM 1805 C C . TYR A 1 234 ? 7.866 -18.232 12.554 1.00 8.45 ? 322 TYR A C 1 ATOM 1806 O O . TYR A 1 234 ? 6.887 -18.502 11.855 1.00 8.29 ? 322 TYR A O 1 ATOM 1807 C CB . TYR A 1 234 ? 6.778 -17.080 14.540 1.00 8.70 ? 322 TYR A CB 1 ATOM 1808 C CG . TYR A 1 234 ? 7.411 -15.717 14.526 1.00 7.17 ? 322 TYR A CG 1 ATOM 1809 C CD1 . TYR A 1 234 ? 7.596 -15.015 13.341 1.00 6.79 ? 322 TYR A CD1 1 ATOM 1810 C CD2 . TYR A 1 234 ? 7.856 -15.156 15.684 1.00 6.89 ? 322 TYR A CD2 1 ATOM 1811 C CE1 . TYR A 1 234 ? 8.199 -13.783 13.352 1.00 8.56 ? 322 TYR A CE1 1 ATOM 1812 C CE2 . TYR A 1 234 ? 8.462 -13.937 15.704 1.00 8.29 ? 322 TYR A CE2 1 ATOM 1813 C CZ . TYR A 1 234 ? 8.660 -13.257 14.543 1.00 7.34 ? 322 TYR A CZ 1 ATOM 1814 O OH . TYR A 1 234 ? 9.293 -12.016 14.571 1.00 7.65 ? 322 TYR A OH 1 ATOM 1815 N N . THR A 1 235 ? 9.045 -17.936 12.016 1.00 6.96 ? 323 THR A N 1 ATOM 1816 C CA . THR A 1 235 ? 9.248 -17.973 10.569 1.00 7.59 ? 323 THR A CA 1 ATOM 1817 C C . THR A 1 235 ? 9.599 -19.360 10.009 1.00 8.92 ? 323 THR A C 1 ATOM 1818 O O . THR A 1 235 ? 9.529 -19.549 8.788 1.00 9.07 ? 323 THR A O 1 ATOM 1819 C CB . THR A 1 235 ? 10.351 -16.979 10.095 1.00 7.44 ? 323 THR A CB 1 ATOM 1820 O OG1 . THR A 1 235 ? 11.658 -17.385 10.565 1.00 7.85 ? 323 THR A OG1 1 ATOM 1821 C CG2 . THR A 1 235 ? 10.114 -15.537 10.550 1.00 7.20 ? 323 THR A CG2 1 ATOM 1822 N N . SER A 1 236 ? 10.000 -20.328 10.849 1.00 9.41 ? 324 SER A N 1 ATOM 1823 C CA . SER A 1 236 ? 10.443 -21.625 10.326 1.00 9.68 ? 324 SER A CA 1 ATOM 1824 C C . SER A 1 236 ? 9.266 -22.414 9.715 1.00 9.42 ? 324 SER A C 1 ATOM 1825 O O . SER A 1 236 ? 8.132 -22.321 10.222 1.00 9.39 ? 324 SER A O 1 ATOM 1826 C CB A SER A 1 236 ? 11.145 -22.475 11.401 0.70 11.01 ? 324 SER A CB 1 ATOM 1827 C CB B SER A 1 236 ? 11.063 -22.462 11.447 0.30 10.39 ? 324 SER A CB 1 ATOM 1828 O OG A SER A 1 236 ? 12.257 -21.789 11.967 0.70 11.49 ? 324 SER A OG 1 ATOM 1829 O OG B SER A 1 236 ? 10.158 -22.587 12.539 0.30 11.62 ? 324 SER A OG 1 ATOM 1830 N N . PRO A 1 237 ? 9.483 -23.163 8.640 1.00 8.30 ? 325 PRO A N 1 ATOM 1831 C CA . PRO A 1 237 ? 10.757 -23.318 7.904 1.00 8.36 ? 325 PRO A CA 1 ATOM 1832 C C . PRO A 1 237 ? 10.951 -22.457 6.612 1.00 8.02 ? 325 PRO A C 1 ATOM 1833 O O . PRO A 1 237 ? 11.643 -22.877 5.671 1.00 7.05 ? 325 PRO A O 1 ATOM 1834 C CB . PRO A 1 237 ? 10.679 -24.765 7.501 1.00 7.88 ? 325 PRO A CB 1 ATOM 1835 C CG . PRO A 1 237 ? 9.219 -24.972 7.194 1.00 7.38 ? 325 PRO A CG 1 ATOM 1836 C CD . PRO A 1 237 ? 8.444 -24.054 8.102 1.00 9.46 ? 325 PRO A CD 1 ATOM 1837 N N . ASN A 1 238 ? 10.343 -21.286 6.556 1.00 7.50 ? 326 ASN A N 1 ATOM 1838 C CA . ASN A 1 238 ? 10.505 -20.396 5.406 1.00 6.84 ? 326 ASN A CA 1 ATOM 1839 C C . ASN A 1 238 ? 11.965 -19.926 5.301 1.00 7.42 ? 326 ASN A C 1 ATOM 1840 O O . ASN A 1 238 ? 12.425 -19.230 6.189 1.00 6.53 ? 326 ASN A O 1 ATOM 1841 C CB . ASN A 1 238 ? 9.607 -19.191 5.583 1.00 7.58 ? 326 ASN A CB 1 ATOM 1842 C CG . ASN A 1 238 ? 9.418 -18.394 4.317 1.00 6.83 ? 326 ASN A CG 1 ATOM 1843 O OD1 . ASN A 1 238 ? 10.155 -18.568 3.345 1.00 8.32 ? 326 ASN A OD1 1 ATOM 1844 N ND2 . ASN A 1 238 ? 8.416 -17.493 4.320 1.00 7.28 ? 326 ASN A ND2 1 ATOM 1845 N N . PRO A 1 239 ? 12.669 -20.240 4.212 1.00 7.17 ? 327 PRO A N 1 ATOM 1846 C CA . PRO A 1 239 ? 14.025 -19.717 4.031 1.00 7.73 ? 327 PRO A CA 1 ATOM 1847 C C . PRO A 1 239 ? 14.031 -18.187 3.851 1.00 7.72 ? 327 PRO A C 1 ATOM 1848 O O . PRO A 1 239 ? 15.033 -17.540 4.108 1.00 6.72 ? 327 PRO A O 1 ATOM 1849 C CB . PRO A 1 239 ? 14.511 -20.455 2.791 1.00 8.40 ? 327 PRO A CB 1 ATOM 1850 C CG . PRO A 1 239 ? 13.264 -20.768 2.034 1.00 8.43 ? 327 PRO A CG 1 ATOM 1851 C CD . PRO A 1 239 ? 12.246 -21.049 3.059 1.00 7.36 ? 327 PRO A CD 1 ATOM 1852 N N . ASN A 1 240 ? 12.915 -17.610 3.410 1.00 5.95 ? 328 ASN A N 1 ATOM 1853 C CA . ASN A 1 240 ? 12.772 -16.154 3.277 1.00 6.04 ? 328 ASN A CA 1 ATOM 1854 C C . ASN A 1 240 ? 12.130 -15.593 4.537 1.00 6.40 ? 328 ASN A C 1 ATOM 1855 O O . ASN A 1 240 ? 10.922 -15.281 4.580 1.00 7.00 ? 328 ASN A O 1 ATOM 1856 C CB . ASN A 1 240 ? 11.959 -15.862 2.030 1.00 5.86 ? 328 ASN A CB 1 ATOM 1857 C CG . ASN A 1 240 ? 12.596 -16.424 0.793 1.00 6.29 ? 328 ASN A CG 1 ATOM 1858 O OD1 . ASN A 1 240 ? 13.804 -16.358 0.644 1.00 8.82 ? 328 ASN A OD1 1 ATOM 1859 N ND2 . ASN A 1 240 ? 11.784 -16.955 -0.118 1.00 10.90 ? 328 ASN A ND2 1 ATOM 1860 N N . TYR A 1 241 ? 12.963 -15.471 5.573 1.00 6.05 ? 329 TYR A N 1 ATOM 1861 C CA . TYR A 1 241 ? 12.477 -15.120 6.891 1.00 7.19 ? 329 TYR A CA 1 ATOM 1862 C C . TYR A 1 241 ? 12.556 -13.641 7.236 1.00 7.21 ? 329 TYR A C 1 ATOM 1863 O O . TYR A 1 241 ? 12.135 -13.231 8.309 1.00 8.41 ? 329 TYR A O 1 ATOM 1864 C CB . TYR A 1 241 ? 13.165 -15.981 7.944 1.00 7.52 ? 329 TYR A CB 1 ATOM 1865 C CG . TYR A 1 241 ? 14.659 -15.848 7.946 1.00 7.55 ? 329 TYR A CG 1 ATOM 1866 C CD1 . TYR A 1 241 ? 15.284 -14.701 8.472 1.00 10.03 ? 329 TYR A CD1 1 ATOM 1867 C CD2 . TYR A 1 241 ? 15.458 -16.875 7.476 1.00 8.78 ? 329 TYR A CD2 1 ATOM 1868 C CE1 . TYR A 1 241 ? 16.656 -14.605 8.525 1.00 11.88 ? 329 TYR A CE1 1 ATOM 1869 C CE2 . TYR A 1 241 ? 16.824 -16.765 7.498 1.00 13.52 ? 329 TYR A CE2 1 ATOM 1870 C CZ . TYR A 1 241 ? 17.408 -15.624 8.006 1.00 13.30 ? 329 TYR A CZ 1 ATOM 1871 O OH . TYR A 1 241 ? 18.783 -15.568 8.051 1.00 18.95 ? 329 TYR A OH 1 ATOM 1872 N N . ASP A 1 242 ? 13.040 -12.838 6.301 1.00 6.86 ? 330 ASP A N 1 ATOM 1873 C CA . ASP A 1 242 ? 12.999 -11.414 6.410 1.00 7.30 ? 330 ASP A CA 1 ATOM 1874 C C . ASP A 1 242 ? 12.811 -10.805 5.018 1.00 6.15 ? 330 ASP A C 1 ATOM 1875 O O . ASP A 1 242 ? 12.830 -11.521 4.029 1.00 6.64 ? 330 ASP A O 1 ATOM 1876 C CB . ASP A 1 242 ? 14.244 -10.882 7.137 1.00 7.39 ? 330 ASP A CB 1 ATOM 1877 C CG . ASP A 1 242 ? 15.550 -11.238 6.445 1.00 8.45 ? 330 ASP A CG 1 ATOM 1878 O OD1 . ASP A 1 242 ? 15.551 -11.583 5.231 1.00 8.32 ? 330 ASP A OD1 1 ATOM 1879 O OD2 . ASP A 1 242 ? 16.656 -11.205 7.039 1.00 8.01 ? 330 ASP A OD2 1 ATOM 1880 N N . GLU A 1 243 ? 12.617 -9.500 4.959 1.00 6.22 ? 331 GLU A N 1 ATOM 1881 C CA . GLU A 1 243 ? 12.238 -8.844 3.710 1.00 6.52 ? 331 GLU A CA 1 ATOM 1882 C C . GLU A 1 243 ? 13.385 -8.866 2.692 1.00 6.85 ? 331 GLU A C 1 ATOM 1883 O O . GLU A 1 243 ? 13.147 -9.029 1.520 1.00 6.47 ? 331 GLU A O 1 ATOM 1884 C CB . GLU A 1 243 ? 11.684 -7.444 3.923 1.00 7.37 ? 331 GLU A CB 1 ATOM 1885 C CG . GLU A 1 243 ? 10.371 -7.423 4.715 1.00 7.68 ? 331 GLU A CG 1 ATOM 1886 C CD . GLU A 1 243 ? 9.208 -8.157 4.031 1.00 9.28 ? 331 GLU A CD 1 ATOM 1887 O OE1 . GLU A 1 243 ? 8.968 -7.846 2.852 1.00 10.62 ? 331 GLU A OE1 1 ATOM 1888 O OE2 . GLU A 1 243 ? 8.549 -9.075 4.626 1.00 10.90 ? 331 GLU A OE2 1 ATOM 1889 N N . LYS A 1 244 ? 14.609 -8.756 3.150 1.00 6.54 ? 332 LYS A N 1 ATOM 1890 C CA . LYS A 1 244 ? 15.741 -8.870 2.241 1.00 7.49 ? 332 LYS A CA 1 ATOM 1891 C C . LYS A 1 244 ? 15.764 -10.204 1.531 1.00 7.73 ? 332 LYS A C 1 ATOM 1892 O O . LYS A 1 244 ? 16.014 -10.246 0.322 1.00 7.31 ? 332 LYS A O 1 ATOM 1893 C CB . LYS A 1 244 ? 17.071 -8.626 2.994 1.00 7.90 ? 332 LYS A CB 1 ATOM 1894 C CG . LYS A 1 244 ? 18.339 -8.794 2.179 1.00 8.09 ? 332 LYS A CG 1 ATOM 1895 C CD . LYS A 1 244 ? 19.545 -8.256 2.945 1.00 9.14 ? 332 LYS A CD 1 ATOM 1896 C CE . LYS A 1 244 ? 20.863 -8.482 2.130 1.00 11.08 ? 332 LYS A CE 1 ATOM 1897 N NZ . LYS A 1 244 ? 22.024 -8.132 2.949 1.00 12.17 ? 332 LYS A NZ 1 ATOM 1898 N N . HIS A 1 245 ? 15.577 -11.312 2.267 1.00 7.79 ? 333 HIS A N 1 ATOM 1899 C CA . HIS A 1 245 ? 15.583 -12.642 1.607 1.00 7.74 ? 333 HIS A CA 1 ATOM 1900 C C . HIS A 1 245 ? 14.437 -12.718 0.591 1.00 7.40 ? 333 HIS A C 1 ATOM 1901 O O . HIS A 1 245 ? 14.638 -13.223 -0.541 1.00 6.81 ? 333 HIS A O 1 ATOM 1902 C CB . HIS A 1 245 ? 15.413 -13.815 2.588 1.00 7.17 ? 333 HIS A CB 1 ATOM 1903 C CG . HIS A 1 245 ? 16.654 -14.183 3.355 1.00 9.83 ? 333 HIS A CG 1 ATOM 1904 N ND1 . HIS A 1 245 ? 17.111 -13.445 4.421 1.00 10.50 ? 333 HIS A ND1 1 ATOM 1905 C CD2 . HIS A 1 245 ? 17.470 -15.259 3.269 1.00 10.68 ? 333 HIS A CD2 1 ATOM 1906 C CE1 . HIS A 1 245 ? 18.199 -14.011 4.916 1.00 7.27 ? 333 HIS A CE1 1 ATOM 1907 N NE2 . HIS A 1 245 ? 18.431 -15.119 4.244 1.00 10.90 ? 333 HIS A NE2 1 ATOM 1908 N N . TYR A 1 246 ? 13.241 -12.288 1.018 1.00 7.27 ? 334 TYR A N 1 ATOM 1909 C CA . TYR A 1 246 ? 12.052 -12.282 0.150 1.00 6.78 ? 334 TYR A CA 1 ATOM 1910 C C . TYR A 1 246 ? 12.335 -11.530 -1.149 1.00 6.91 ? 334 TYR A C 1 ATOM 1911 O O . TYR A 1 246 ? 12.161 -12.069 -2.249 1.00 5.83 ? 334 TYR A O 1 ATOM 1912 C CB . TYR A 1 246 ? 10.859 -11.668 0.895 1.00 6.33 ? 334 TYR A CB 1 ATOM 1913 C CG . TYR A 1 246 ? 9.555 -11.465 0.113 1.00 5.37 ? 334 TYR A CG 1 ATOM 1914 C CD1 . TYR A 1 246 ? 9.132 -12.349 -0.887 1.00 6.55 ? 334 TYR A CD1 1 ATOM 1915 C CD2 . TYR A 1 246 ? 8.771 -10.366 0.386 1.00 6.66 ? 334 TYR A CD2 1 ATOM 1916 C CE1 . TYR A 1 246 ? 7.937 -12.127 -1.610 1.00 4.40 ? 334 TYR A CE1 1 ATOM 1917 C CE2 . TYR A 1 246 ? 7.552 -10.150 -0.269 1.00 6.59 ? 334 TYR A CE2 1 ATOM 1918 C CZ . TYR A 1 246 ? 7.154 -11.010 -1.275 1.00 5.67 ? 334 TYR A CZ 1 ATOM 1919 O OH . TYR A 1 246 ? 5.949 -10.774 -1.894 1.00 7.02 ? 334 TYR A OH 1 ATOM 1920 N N . ILE A 1 247 ? 12.839 -10.318 -1.011 1.00 6.97 ? 335 ILE A N 1 ATOM 1921 C CA . ILE A 1 247 ? 13.071 -9.461 -2.155 1.00 7.70 ? 335 ILE A CA 1 ATOM 1922 C C . ILE A 1 247 ? 14.132 -9.991 -3.080 1.00 7.72 ? 335 ILE A C 1 ATOM 1923 O O . ILE A 1 247 ? 13.973 -9.932 -4.317 1.00 7.68 ? 335 ILE A O 1 ATOM 1924 C CB . ILE A 1 247 ? 13.332 -7.997 -1.697 1.00 7.15 ? 335 ILE A CB 1 ATOM 1925 C CG1 . ILE A 1 247 ? 11.976 -7.371 -1.280 1.00 8.86 ? 335 ILE A CG1 1 ATOM 1926 C CG2 . ILE A 1 247 ? 14.050 -7.215 -2.767 1.00 10.07 ? 335 ILE A CG2 1 ATOM 1927 C CD1 . ILE A 1 247 ? 12.046 -6.225 -0.379 1.00 10.77 ? 335 ILE A CD1 1 ATOM 1928 N N . GLU A 1 248 ? 15.222 -10.514 -2.511 1.00 8.23 ? 336 GLU A N 1 ATOM 1929 C CA . GLU A 1 248 ? 16.281 -11.112 -3.326 1.00 7.98 ? 336 GLU A CA 1 ATOM 1930 C C . GLU A 1 248 ? 15.834 -12.382 -4.095 1.00 7.26 ? 336 GLU A C 1 ATOM 1931 O O . GLU A 1 248 ? 16.385 -12.688 -5.153 1.00 7.62 ? 336 GLU A O 1 ATOM 1932 C CB . GLU A 1 248 ? 17.491 -11.415 -2.465 1.00 8.29 ? 336 GLU A CB 1 ATOM 1933 C CG . GLU A 1 248 ? 18.200 -10.154 -2.020 1.00 8.72 ? 336 GLU A CG 1 ATOM 1934 C CD . GLU A 1 248 ? 19.545 -10.375 -1.335 1.00 13.26 ? 336 GLU A CD 1 ATOM 1935 O OE1 . GLU A 1 248 ? 19.904 -11.528 -0.997 1.00 16.22 ? 336 GLU A OE1 1 ATOM 1936 O OE2 . GLU A 1 248 ? 20.261 -9.370 -1.103 1.00 15.10 ? 336 GLU A OE2 1 ATOM 1937 N N . ALA A 1 249 ? 14.835 -13.093 -3.563 1.00 6.19 ? 337 ALA A N 1 ATOM 1938 C CA . ALA A 1 249 ? 14.242 -14.264 -4.223 1.00 5.91 ? 337 ALA A CA 1 ATOM 1939 C C . ALA A 1 249 ? 13.175 -13.852 -5.223 1.00 5.69 ? 337 ALA A C 1 ATOM 1940 O O . ALA A 1 249 ? 13.042 -14.479 -6.279 1.00 6.18 ? 337 ALA A O 1 ATOM 1941 C CB . ALA A 1 249 ? 13.653 -15.210 -3.233 1.00 6.21 ? 337 ALA A CB 1 ATOM 1942 N N . PHE A 1 250 ? 12.445 -12.780 -4.905 1.00 6.00 ? 338 PHE A N 1 ATOM 1943 C CA . PHE A 1 250 ? 11.251 -12.401 -5.665 1.00 6.96 ? 338 PHE A CA 1 ATOM 1944 C C . PHE A 1 250 ? 11.611 -11.664 -6.939 1.00 7.36 ? 338 PHE A C 1 ATOM 1945 O O . PHE A 1 250 ? 11.094 -11.957 -8.008 1.00 6.51 ? 338 PHE A O 1 ATOM 1946 C CB . PHE A 1 250 ? 10.374 -11.520 -4.775 1.00 7.75 ? 338 PHE A CB 1 ATOM 1947 C CG . PHE A 1 250 ? 8.935 -11.355 -5.217 1.00 7.43 ? 338 PHE A CG 1 ATOM 1948 C CD1 . PHE A 1 250 ? 8.320 -12.223 -6.096 1.00 7.62 ? 338 PHE A CD1 1 ATOM 1949 C CD2 . PHE A 1 250 ? 8.188 -10.329 -4.648 1.00 6.28 ? 338 PHE A CD2 1 ATOM 1950 C CE1 . PHE A 1 250 ? 6.944 -12.052 -6.419 1.00 6.67 ? 338 PHE A CE1 1 ATOM 1951 C CE2 . PHE A 1 250 ? 6.849 -10.116 -4.989 1.00 8.76 ? 338 PHE A CE2 1 ATOM 1952 C CZ . PHE A 1 250 ? 6.228 -11.001 -5.867 1.00 7.26 ? 338 PHE A CZ 1 ATOM 1953 N N . ARG A 1 251 ? 12.508 -10.699 -6.822 1.00 8.24 ? 339 ARG A N 1 ATOM 1954 C CA . ARG A 1 251 ? 12.919 -9.882 -7.947 1.00 8.45 ? 339 ARG A CA 1 ATOM 1955 C C . ARG A 1 251 ? 13.364 -10.684 -9.184 1.00 8.43 ? 339 ARG A C 1 ATOM 1956 O O . ARG A 1 251 ? 12.896 -10.400 -10.261 1.00 8.17 ? 339 ARG A O 1 ATOM 1957 C CB . ARG A 1 251 ? 13.985 -8.894 -7.501 1.00 9.61 ? 339 ARG A CB 1 ATOM 1958 C CG . ARG A 1 251 ? 14.650 -8.102 -8.594 1.00 9.35 ? 339 ARG A CG 1 ATOM 1959 C CD . ARG A 1 251 ? 13.744 -7.353 -9.506 1.00 11.91 ? 339 ARG A CD 1 ATOM 1960 N NE . ARG A 1 251 ? 14.572 -6.753 -10.560 1.00 15.02 ? 339 ARG A NE 1 ATOM 1961 C CZ . ARG A 1 251 ? 15.122 -5.545 -10.507 1.00 13.02 ? 339 ARG A CZ 1 ATOM 1962 N NH1 . ARG A 1 251 ? 14.870 -4.734 -9.505 1.00 12.91 ? 339 ARG A NH1 1 ATOM 1963 N NH2 . ARG A 1 251 ? 15.899 -5.139 -11.492 1.00 16.23 ? 339 ARG A NH2 1 ATOM 1964 N N . PRO A 1 252 ? 14.289 -11.638 -9.073 1.00 8.19 ? 340 PRO A N 1 ATOM 1965 C CA . PRO A 1 252 ? 14.650 -12.443 -10.238 1.00 7.61 ? 340 PRO A CA 1 ATOM 1966 C C . PRO A 1 252 ? 13.439 -13.110 -10.893 1.00 7.26 ? 340 PRO A C 1 ATOM 1967 O O . PRO A 1 252 ? 13.413 -13.221 -12.108 1.00 6.68 ? 340 PRO A O 1 ATOM 1968 C CB . PRO A 1 252 ? 15.627 -13.478 -9.679 1.00 8.41 ? 340 PRO A CB 1 ATOM 1969 C CG . PRO A 1 252 ? 16.173 -12.848 -8.443 1.00 10.26 ? 340 PRO A CG 1 ATOM 1970 C CD . PRO A 1 252 ? 15.109 -11.962 -7.899 1.00 7.99 ? 340 PRO A CD 1 ATOM 1971 N N . LEU A 1 253 ? 12.487 -13.594 -10.113 1.00 6.33 ? 341 LEU A N 1 ATOM 1972 C CA . LEU A 1 253 ? 11.336 -14.277 -10.712 1.00 6.45 ? 341 LEU A CA 1 ATOM 1973 C C . LEU A 1 253 ? 10.447 -13.274 -11.469 1.00 6.56 ? 341 LEU A C 1 ATOM 1974 O O . LEU A 1 253 ? 9.878 -13.577 -12.518 1.00 7.46 ? 341 LEU A O 1 ATOM 1975 C CB . LEU A 1 253 ? 10.495 -14.945 -9.632 1.00 6.89 ? 341 LEU A CB 1 ATOM 1976 C CG . LEU A 1 253 ? 11.127 -16.020 -8.771 1.00 8.54 ? 341 LEU A CG 1 ATOM 1977 C CD1 . LEU A 1 253 ? 10.203 -16.378 -7.624 1.00 9.42 ? 341 LEU A CD1 1 ATOM 1978 C CD2 . LEU A 1 253 ? 11.434 -17.243 -9.615 1.00 13.07 ? 341 LEU A CD2 1 ATOM 1979 N N . LEU A 1 254 ? 10.288 -12.088 -10.902 1.00 6.16 ? 342 LEU A N 1 ATOM 1980 C CA . LEU A 1 254 ? 9.506 -11.038 -11.569 1.00 6.47 ? 342 LEU A CA 1 ATOM 1981 C C . LEU A 1 254 ? 10.188 -10.557 -12.859 1.00 7.51 ? 342 LEU A C 1 ATOM 1982 O O . LEU A 1 254 ? 9.554 -10.395 -13.927 1.00 7.96 ? 342 LEU A O 1 ATOM 1983 C CB . LEU A 1 254 ? 9.300 -9.867 -10.609 1.00 7.00 ? 342 LEU A CB 1 ATOM 1984 C CG . LEU A 1 254 ? 8.391 -10.089 -9.380 1.00 7.33 ? 342 LEU A CG 1 ATOM 1985 C CD1 . LEU A 1 254 ? 8.731 -9.056 -8.272 1.00 9.81 ? 342 LEU A CD1 1 ATOM 1986 C CD2 . LEU A 1 254 ? 6.902 -10.015 -9.756 1.00 9.73 ? 342 LEU A CD2 1 ATOM 1987 N N . GLU A 1 255 ? 11.494 -10.335 -12.772 1.00 7.92 ? 343 GLU A N 1 ATOM 1988 C CA . GLU A 1 255 ? 12.255 -9.810 -13.891 1.00 9.11 ? 343 GLU A CA 1 ATOM 1989 C C . GLU A 1 255 ? 12.237 -10.802 -15.065 1.00 8.87 ? 343 GLU A C 1 ATOM 1990 O O . GLU A 1 255 ? 12.113 -10.405 -16.218 1.00 9.48 ? 343 GLU A O 1 ATOM 1991 C CB . GLU A 1 255 ? 13.712 -9.555 -13.479 1.00 10.09 ? 343 GLU A CB 1 ATOM 1992 C CG . GLU A 1 255 ? 14.549 -8.823 -14.532 1.00 13.12 ? 343 GLU A CG 1 ATOM 1993 C CD . GLU A 1 255 ? 15.867 -8.272 -13.977 1.00 16.87 ? 343 GLU A CD 1 ATOM 1994 O OE1 . GLU A 1 255 ? 15.950 -7.991 -12.762 1.00 19.50 ? 343 GLU A OE1 1 ATOM 1995 O OE2 . GLU A 1 255 ? 16.841 -8.136 -14.755 1.00 20.91 ? 343 GLU A OE2 1 ATOM 1996 N N . ALA A 1 256 ? 12.329 -12.085 -14.748 1.00 9.25 ? 344 ALA A N 1 ATOM 1997 C CA . ALA A 1 256 ? 12.286 -13.145 -15.761 1.00 8.32 ? 344 ALA A CA 1 ATOM 1998 C C . ALA A 1 256 ? 10.929 -13.189 -16.503 1.00 8.60 ? 344 ALA A C 1 ATOM 1999 O O . ALA A 1 256 ? 10.830 -13.730 -17.636 1.00 7.11 ? 344 ALA A O 1 ATOM 2000 C CB . ALA A 1 256 ? 12.552 -14.467 -15.106 1.00 10.07 ? 344 ALA A CB 1 ATOM 2001 N N . ARG A 1 257 ? 9.883 -12.666 -15.844 1.00 7.30 ? 345 ARG A N 1 ATOM 2002 C CA . ARG A 1 257 ? 8.554 -12.524 -16.416 1.00 8.68 ? 345 ARG A CA 1 ATOM 2003 C C . ARG A 1 257 ? 8.197 -11.106 -16.881 1.00 8.92 ? 345 ARG A C 1 ATOM 2004 O O . ARG A 1 257 ? 7.011 -10.796 -17.056 1.00 8.50 ? 345 ARG A O 1 ATOM 2005 C CB . ARG A 1 257 ? 7.515 -13.014 -15.416 1.00 8.44 ? 345 ARG A CB 1 ATOM 2006 C CG . ARG A 1 257 ? 7.646 -14.490 -15.150 1.00 10.55 ? 345 ARG A CG 1 ATOM 2007 C CD . ARG A 1 257 ? 7.030 -15.005 -13.903 1.00 12.62 ? 345 ARG A CD 1 ATOM 2008 N NE . ARG A 1 257 ? 7.193 -16.461 -13.881 1.00 14.96 ? 345 ARG A NE 1 ATOM 2009 C CZ . ARG A 1 257 ? 8.293 -17.107 -13.443 1.00 17.98 ? 345 ARG A CZ 1 ATOM 2010 N NH1 . ARG A 1 257 ? 9.327 -16.437 -12.927 1.00 14.77 ? 345 ARG A NH1 1 ATOM 2011 N NH2 . ARG A 1 257 ? 8.344 -18.441 -13.503 1.00 17.42 ? 345 ARG A NH2 1 ATOM 2012 N N . GLY A 1 258 ? 9.212 -10.266 -17.091 1.00 8.89 ? 346 GLY A N 1 ATOM 2013 C CA . GLY A 1 258 ? 9.029 -8.960 -17.717 1.00 9.45 ? 346 GLY A CA 1 ATOM 2014 C C . GLY A 1 258 ? 8.788 -7.773 -16.811 1.00 8.75 ? 346 GLY A C 1 ATOM 2015 O O . GLY A 1 258 ? 8.534 -6.669 -17.310 1.00 9.32 ? 346 GLY A O 1 ATOM 2016 N N . PHE A 1 259 ? 8.901 -7.967 -15.494 1.00 8.38 ? 347 PHE A N 1 ATOM 2017 C CA . PHE A 1 259 ? 8.637 -6.899 -14.517 1.00 8.48 ? 347 PHE A CA 1 ATOM 2018 C C . PHE A 1 259 ? 9.825 -6.721 -13.562 1.00 8.86 ? 347 PHE A C 1 ATOM 2019 O O . PHE A 1 259 ? 9.880 -7.404 -12.538 1.00 8.98 ? 347 PHE A O 1 ATOM 2020 C CB . PHE A 1 259 ? 7.379 -7.268 -13.743 1.00 8.05 ? 347 PHE A CB 1 ATOM 2021 C CG . PHE A 1 259 ? 6.891 -6.215 -12.775 1.00 7.79 ? 347 PHE A CG 1 ATOM 2022 C CD1 . PHE A 1 259 ? 7.398 -4.929 -12.791 1.00 8.61 ? 347 PHE A CD1 1 ATOM 2023 C CD2 . PHE A 1 259 ? 5.867 -6.537 -11.867 1.00 7.82 ? 347 PHE A CD2 1 ATOM 2024 C CE1 . PHE A 1 259 ? 6.909 -3.996 -11.909 1.00 8.79 ? 347 PHE A CE1 1 ATOM 2025 C CE2 . PHE A 1 259 ? 5.387 -5.618 -10.966 1.00 6.97 ? 347 PHE A CE2 1 ATOM 2026 C CZ . PHE A 1 259 ? 5.899 -4.337 -10.998 1.00 7.05 ? 347 PHE A CZ 1 ATOM 2027 N N . PRO A 1 260 ? 10.760 -5.838 -13.901 1.00 10.03 ? 348 PRO A N 1 ATOM 2028 C CA . PRO A 1 260 ? 11.974 -5.623 -13.101 1.00 10.83 ? 348 PRO A CA 1 ATOM 2029 C C . PRO A 1 260 ? 11.702 -4.682 -11.911 1.00 9.68 ? 348 PRO A C 1 ATOM 2030 O O . PRO A 1 260 ? 12.198 -3.557 -11.861 1.00 12.15 ? 348 PRO A O 1 ATOM 2031 C CB . PRO A 1 260 ? 12.931 -4.978 -14.096 1.00 10.73 ? 348 PRO A CB 1 ATOM 2032 C CG . PRO A 1 260 ? 12.061 -4.228 -15.028 1.00 10.89 ? 348 PRO A CG 1 ATOM 2033 C CD . PRO A 1 260 ? 10.740 -4.961 -15.093 1.00 10.68 ? 348 PRO A CD 1 ATOM 2034 N N . ALA A 1 261 ? 10.881 -5.146 -10.993 1.00 9.78 ? 349 ALA A N 1 ATOM 2035 C CA . ALA A 1 261 ? 10.323 -4.319 -9.933 1.00 8.86 ? 349 ALA A CA 1 ATOM 2036 C C . ALA A 1 261 ? 11.412 -3.810 -8.977 1.00 8.89 ? 349 ALA A C 1 ATOM 2037 O O . ALA A 1 261 ? 12.297 -4.560 -8.569 1.00 11.18 ? 349 ALA A O 1 ATOM 2038 C CB . ALA A 1 261 ? 9.327 -5.118 -9.160 1.00 9.16 ? 349 ALA A CB 1 ATOM 2039 N N . GLN A 1 262 ? 11.350 -2.530 -8.636 1.00 8.45 ? 350 GLN A N 1 ATOM 2040 C CA . GLN A 1 262 ? 12.100 -2.007 -7.493 1.00 7.98 ? 350 GLN A CA 1 ATOM 2041 C C . GLN A 1 262 ? 11.168 -2.076 -6.291 1.00 8.03 ? 350 GLN A C 1 ATOM 2042 O O . GLN A 1 262 ? 9.977 -2.121 -6.448 1.00 8.24 ? 350 GLN A O 1 ATOM 2043 C CB . GLN A 1 262 ? 12.518 -0.572 -7.775 1.00 8.94 ? 350 GLN A CB 1 ATOM 2044 C CG . GLN A 1 262 ? 13.634 -0.419 -8.791 1.00 8.79 ? 350 GLN A CG 1 ATOM 2045 C CD . GLN A 1 262 ? 14.975 -0.929 -8.284 1.00 7.60 ? 350 GLN A CD 1 ATOM 2046 O OE1 . GLN A 1 262 ? 15.505 -1.907 -8.804 1.00 8.53 ? 350 GLN A OE1 1 ATOM 2047 N NE2 . GLN A 1 262 ? 15.542 -0.253 -7.323 1.00 6.59 ? 350 GLN A NE2 1 ATOM 2048 N N . PHE A 1 263 ? 11.699 -2.034 -5.078 1.00 6.74 ? 351 PHE A N 1 ATOM 2049 C CA . PHE A 1 263 ? 10.895 -2.281 -3.913 1.00 6.57 ? 351 PHE A CA 1 ATOM 2050 C C . PHE A 1 263 ? 10.969 -1.123 -2.904 1.00 6.75 ? 351 PHE A C 1 ATOM 2051 O O . PHE A 1 263 ? 11.995 -0.451 -2.766 1.00 5.76 ? 351 PHE A O 1 ATOM 2052 C CB . PHE A 1 263 ? 11.357 -3.536 -3.217 1.00 6.91 ? 351 PHE A CB 1 ATOM 2053 C CG . PHE A 1 263 ? 10.981 -4.788 -3.954 1.00 6.48 ? 351 PHE A CG 1 ATOM 2054 C CD1 . PHE A 1 263 ? 11.760 -5.225 -5.017 1.00 6.32 ? 351 PHE A CD1 1 ATOM 2055 C CD2 . PHE A 1 263 ? 9.872 -5.511 -3.592 1.00 6.68 ? 351 PHE A CD2 1 ATOM 2056 C CE1 . PHE A 1 263 ? 11.431 -6.376 -5.681 1.00 9.06 ? 351 PHE A CE1 1 ATOM 2057 C CE2 . PHE A 1 263 ? 9.518 -6.663 -4.280 1.00 8.04 ? 351 PHE A CE2 1 ATOM 2058 C CZ . PHE A 1 263 ? 10.274 -7.098 -5.300 1.00 7.44 ? 351 PHE A CZ 1 ATOM 2059 N N . ILE A 1 264 ? 9.889 -0.940 -2.180 1.00 5.13 ? 352 ILE A N 1 ATOM 2060 C CA . ILE A 1 264 ? 9.922 -0.213 -0.901 1.00 5.54 ? 352 ILE A CA 1 ATOM 2061 C C . ILE A 1 264 ? 9.445 -1.151 0.190 1.00 6.96 ? 352 ILE A C 1 ATOM 2062 O O . ILE A 1 264 ? 8.634 -2.056 -0.042 1.00 6.52 ? 352 ILE A O 1 ATOM 2063 C CB . ILE A 1 264 ? 9.142 1.113 -0.919 1.00 5.38 ? 352 ILE A CB 1 ATOM 2064 C CG1 . ILE A 1 264 ? 7.676 0.910 -1.190 1.00 5.80 ? 352 ILE A CG1 1 ATOM 2065 C CG2 . ILE A 1 264 ? 9.819 2.062 -1.882 1.00 6.57 ? 352 ILE A CG2 1 ATOM 2066 C CD1 . ILE A 1 264 ? 6.840 2.196 -1.116 1.00 6.69 ? 352 ILE A CD1 1 ATOM 2067 N N . VAL A 1 265 ? 9.955 -0.950 1.403 1.00 6.69 ? 353 VAL A N 1 ATOM 2068 C CA . VAL A 1 265 ? 9.678 -1.899 2.490 1.00 7.29 ? 353 VAL A CA 1 ATOM 2069 C C . VAL A 1 265 ? 9.191 -1.147 3.715 1.00 6.23 ? 353 VAL A C 1 ATOM 2070 O O . VAL A 1 265 ? 9.900 -0.290 4.205 1.00 6.98 ? 353 VAL A O 1 ATOM 2071 C CB . VAL A 1 265 ? 10.972 -2.680 2.842 1.00 7.67 ? 353 VAL A CB 1 ATOM 2072 C CG1 . VAL A 1 265 ? 10.703 -3.664 3.987 1.00 8.10 ? 353 VAL A CG1 1 ATOM 2073 C CG2 . VAL A 1 265 ? 11.508 -3.443 1.620 1.00 8.09 ? 353 VAL A CG2 1 ATOM 2074 N N . ASP A 1 266 ? 7.992 -1.487 4.204 1.00 5.82 ? 354 ASP A N 1 ATOM 2075 C CA . ASP A 1 266 ? 7.464 -0.897 5.409 1.00 6.62 ? 354 ASP A CA 1 ATOM 2076 C C . ASP A 1 266 ? 8.332 -1.365 6.575 1.00 6.05 ? 354 ASP A C 1 ATOM 2077 O O . ASP A 1 266 ? 8.579 -2.550 6.716 1.00 6.98 ? 354 ASP A O 1 ATOM 2078 C CB . ASP A 1 266 ? 6.003 -1.294 5.594 1.00 5.62 ? 354 ASP A CB 1 ATOM 2079 C CG . ASP A 1 266 ? 5.236 -0.402 6.537 1.00 8.32 ? 354 ASP A CG 1 ATOM 2080 O OD1 . ASP A 1 266 ? 5.834 0.450 7.260 1.00 7.97 ? 354 ASP A OD1 1 ATOM 2081 O OD2 . ASP A 1 266 ? 3.948 -0.517 6.585 1.00 6.51 ? 354 ASP A OD2 1 ATOM 2082 N N . GLN A 1 267 ? 8.836 -0.421 7.361 1.00 6.70 ? 355 GLN A N 1 ATOM 2083 C CA . GLN A 1 267 ? 9.551 -0.714 8.606 1.00 6.12 ? 355 GLN A CA 1 ATOM 2084 C C . GLN A 1 267 ? 8.961 -0.003 9.847 1.00 5.97 ? 355 GLN A C 1 ATOM 2085 O O . GLN A 1 267 ? 9.563 0.001 10.917 1.00 6.67 ? 355 GLN A O 1 ATOM 2086 C CB . GLN A 1 267 ? 11.051 -0.426 8.465 1.00 6.91 ? 355 GLN A CB 1 ATOM 2087 C CG . GLN A 1 267 ? 11.790 -1.382 7.524 1.00 8.09 ? 355 GLN A CG 1 ATOM 2088 C CD . GLN A 1 267 ? 12.009 -2.727 8.161 1.00 6.94 ? 355 GLN A CD 1 ATOM 2089 O OE1 . GLN A 1 267 ? 12.961 -2.890 8.991 1.00 8.71 ? 355 GLN A OE1 1 ATOM 2090 N NE2 . GLN A 1 267 ? 11.167 -3.736 7.757 1.00 7.64 ? 355 GLN A NE2 1 ATOM 2091 N N . GLY A 1 268 ? 7.761 0.558 9.702 1.00 7.27 ? 356 GLY A N 1 ATOM 2092 C CA . GLY A 1 268 ? 7.155 1.345 10.752 1.00 6.97 ? 356 GLY A CA 1 ATOM 2093 C C . GLY A 1 268 ? 6.908 0.607 12.032 1.00 6.14 ? 356 GLY A C 1 ATOM 2094 O O . GLY A 1 268 ? 6.847 1.242 13.091 1.00 7.69 ? 356 GLY A O 1 ATOM 2095 N N . ARG A 1 269 ? 6.739 -0.714 11.985 1.00 5.56 ? 357 ARG A N 1 ATOM 2096 C CA . ARG A 1 269 ? 6.501 -1.497 13.215 1.00 6.22 ? 357 ARG A CA 1 ATOM 2097 C C . ARG A 1 269 ? 7.439 -2.692 13.292 1.00 5.48 ? 357 ARG A C 1 ATOM 2098 O O . ARG A 1 269 ? 7.128 -3.735 13.898 1.00 5.36 ? 357 ARG A O 1 ATOM 2099 C CB . ARG A 1 269 ? 5.030 -1.901 13.397 1.00 7.38 ? 357 ARG A CB 1 ATOM 2100 C CG . ARG A 1 269 ? 4.061 -0.762 13.363 1.00 6.71 ? 357 ARG A CG 1 ATOM 2101 C CD . ARG A 1 269 ? 2.605 -1.152 13.620 1.00 7.22 ? 357 ARG A CD 1 ATOM 2102 N NE . ARG A 1 269 ? 1.967 -1.990 12.600 1.00 6.17 ? 357 ARG A NE 1 ATOM 2103 C CZ . ARG A 1 269 ? 0.780 -2.544 12.743 1.00 7.70 ? 357 ARG A CZ 1 ATOM 2104 N NH1 . ARG A 1 269 ? 0.052 -2.374 13.847 1.00 7.75 ? 357 ARG A NH1 1 ATOM 2105 N NH2 . ARG A 1 269 ? 0.329 -3.343 11.805 1.00 8.75 ? 357 ARG A NH2 1 ATOM 2106 N N . SER A 1 270 ? 8.647 -2.480 12.774 1.00 6.46 ? 358 SER A N 1 ATOM 2107 C CA . SER A 1 270 ? 9.662 -3.548 12.640 1.00 6.30 ? 358 SER A CA 1 ATOM 2108 C C . SER A 1 270 ? 10.873 -3.434 13.543 1.00 6.44 ? 358 SER A C 1 ATOM 2109 O O . SER A 1 270 ? 11.815 -4.219 13.443 1.00 5.18 ? 358 SER A O 1 ATOM 2110 C CB . SER A 1 270 ? 10.184 -3.562 11.197 1.00 7.07 ? 358 SER A CB 1 ATOM 2111 O OG . SER A 1 270 ? 9.150 -3.962 10.287 1.00 7.30 ? 358 SER A OG 1 ATOM 2112 N N . GLY A 1 271 ? 10.848 -2.456 14.432 1.00 6.24 ? 359 GLY A N 1 ATOM 2113 C CA . GLY A 1 271 ? 12.037 -2.157 15.234 1.00 5.92 ? 359 GLY A CA 1 ATOM 2114 C C . GLY A 1 271 ? 12.466 -3.241 16.210 1.00 6.46 ? 359 GLY A C 1 ATOM 2115 O O . GLY A 1 271 ? 13.664 -3.321 16.507 1.00 7.35 ? 359 GLY A O 1 ATOM 2116 N N . LYS A 1 272 ? 11.530 -4.030 16.751 1.00 6.06 ? 360 LYS A N 1 ATOM 2117 C CA . LYS A 1 272 ? 11.822 -5.106 17.700 1.00 7.57 ? 360 LYS A CA 1 ATOM 2118 C C . LYS A 1 272 ? 11.697 -6.497 17.041 1.00 8.11 ? 360 LYS A C 1 ATOM 2119 O O . LYS A 1 272 ? 10.667 -6.829 16.445 1.00 8.24 ? 360 LYS A O 1 ATOM 2120 C CB . LYS A 1 272 ? 10.945 -5.001 18.931 1.00 8.54 ? 360 LYS A CB 1 ATOM 2121 C CG . LYS A 1 272 ? 11.420 -5.872 20.063 1.00 10.11 ? 360 LYS A CG 1 ATOM 2122 C CD . LYS A 1 272 ? 10.649 -5.588 21.354 1.00 11.73 ? 360 LYS A CD 1 ATOM 2123 C CE . LYS A 1 272 ? 11.376 -6.120 22.606 1.00 17.48 ? 360 LYS A CE 1 ATOM 2124 N NZ . LYS A 1 272 ? 11.585 -7.572 22.506 1.00 18.81 ? 360 LYS A NZ 1 ATOM 2125 N N . GLN A 1 273 ? 12.796 -7.234 17.062 1.00 7.69 ? 361 GLN A N 1 ATOM 2126 C CA . GLN A 1 273 ? 12.857 -8.551 16.438 1.00 8.46 ? 361 GLN A CA 1 ATOM 2127 C C . GLN A 1 273 ? 13.578 -9.541 17.353 1.00 8.88 ? 361 GLN A C 1 ATOM 2128 O O . GLN A 1 273 ? 14.591 -9.200 17.911 1.00 8.91 ? 361 GLN A O 1 ATOM 2129 C CB . GLN A 1 273 ? 13.636 -8.467 15.121 1.00 8.16 ? 361 GLN A CB 1 ATOM 2130 C CG . GLN A 1 273 ? 13.086 -7.508 14.129 1.00 6.70 ? 361 GLN A CG 1 ATOM 2131 C CD . GLN A 1 273 ? 11.739 -7.940 13.595 1.00 6.65 ? 361 GLN A CD 1 ATOM 2132 O OE1 . GLN A 1 273 ? 11.420 -9.137 13.605 1.00 7.04 ? 361 GLN A OE1 1 ATOM 2133 N NE2 . GLN A 1 273 ? 10.967 -7.000 13.086 1.00 6.99 ? 361 GLN A NE2 1 ATOM 2134 N N . PRO A 1 274 ? 13.057 -10.757 17.530 1.00 8.76 ? 362 PRO A N 1 ATOM 2135 C CA . PRO A 1 274 ? 11.743 -11.155 17.070 1.00 9.73 ? 362 PRO A CA 1 ATOM 2136 C C . PRO A 1 274 ? 10.639 -10.347 17.732 1.00 9.21 ? 362 PRO A C 1 ATOM 2137 O O . PRO A 1 274 ? 10.863 -9.756 18.793 1.00 8.72 ? 362 PRO A O 1 ATOM 2138 C CB . PRO A 1 274 ? 11.643 -12.614 17.531 1.00 9.59 ? 362 PRO A CB 1 ATOM 2139 C CG . PRO A 1 274 ? 13.037 -13.028 17.716 1.00 11.77 ? 362 PRO A CG 1 ATOM 2140 C CD . PRO A 1 274 ? 13.771 -11.852 18.211 1.00 9.56 ? 362 PRO A CD 1 ATOM 2141 N N . THR A 1 275 ? 9.472 -10.333 17.095 1.00 8.84 ? 363 THR A N 1 ATOM 2142 C CA . THR A 1 275 ? 8.285 -9.748 17.684 1.00 8.45 ? 363 THR A CA 1 ATOM 2143 C C . THR A 1 275 ? 7.703 -10.708 18.701 1.00 9.31 ? 363 THR A C 1 ATOM 2144 O O . THR A 1 275 ? 8.260 -11.797 18.960 1.00 9.85 ? 363 THR A O 1 ATOM 2145 C CB . THR A 1 275 ? 7.204 -9.494 16.621 1.00 9.62 ? 363 THR A CB 1 ATOM 2146 O OG1 . THR A 1 275 ? 6.696 -10.765 16.211 1.00 9.02 ? 363 THR A OG1 1 ATOM 2147 C CG2 . THR A 1 275 ? 7.760 -8.830 15.369 1.00 7.40 ? 363 THR A CG2 1 ATOM 2148 N N . GLY A 1 276 ? 6.563 -10.321 19.261 1.00 10.20 ? 364 GLY A N 1 ATOM 2149 C CA . GLY A 1 276 ? 5.821 -11.176 20.188 1.00 11.04 ? 364 GLY A CA 1 ATOM 2150 C C . GLY A 1 276 ? 4.764 -12.025 19.519 1.00 11.66 ? 364 GLY A C 1 ATOM 2151 O O . GLY A 1 276 ? 3.911 -12.598 20.189 1.00 11.67 ? 364 GLY A O 1 ATOM 2152 N N . GLN A 1 277 ? 4.811 -12.130 18.197 1.00 10.59 ? 365 GLN A N 1 ATOM 2153 C CA . GLN A 1 277 ? 3.868 -12.963 17.459 1.00 10.75 ? 365 GLN A CA 1 ATOM 2154 C C . GLN A 1 277 ? 4.119 -14.430 17.811 1.00 11.19 ? 365 GLN A C 1 ATOM 2155 O O . GLN A 1 277 ? 5.271 -14.891 17.817 1.00 12.35 ? 365 GLN A O 1 ATOM 2156 C CB . GLN A 1 277 ? 4.079 -12.781 15.954 1.00 10.36 ? 365 GLN A CB 1 ATOM 2157 C CG . GLN A 1 277 ? 3.630 -11.407 15.380 1.00 9.44 ? 365 GLN A CG 1 ATOM 2158 C CD . GLN A 1 277 ? 4.163 -11.172 13.989 1.00 8.90 ? 365 GLN A CD 1 ATOM 2159 O OE1 . GLN A 1 277 ? 5.393 -10.934 13.801 1.00 9.60 ? 365 GLN A OE1 1 ATOM 2160 N NE2 . GLN A 1 277 ? 3.282 -11.287 12.984 1.00 9.42 ? 365 GLN A NE2 1 ATOM 2161 N N . LYS A 1 278 ? 3.064 -15.142 18.176 1.00 11.10 ? 366 LYS A N 1 ATOM 2162 C CA . LYS A 1 278 ? 3.167 -16.590 18.455 1.00 11.54 ? 366 LYS A CA 1 ATOM 2163 C C . LYS A 1 278 ? 3.252 -17.403 17.165 1.00 11.01 ? 366 LYS A C 1 ATOM 2164 O O . LYS A 1 278 ? 3.871 -18.479 17.143 1.00 10.27 ? 366 LYS A O 1 ATOM 2165 C CB . LYS A 1 278 ? 1.965 -17.069 19.278 1.00 12.01 ? 366 LYS A CB 1 ATOM 2166 C CG . LYS A 1 278 ? 1.817 -16.428 20.662 1.00 15.66 ? 366 LYS A CG 1 ATOM 2167 C CD . LYS A 1 278 ? 2.858 -16.935 21.644 1.00 19.65 ? 366 LYS A CD 1 ATOM 2168 C CE . LYS A 1 278 ? 2.268 -17.792 22.819 1.00 23.44 ? 366 LYS A CE 1 ATOM 2169 N NZ . LYS A 1 278 ? 1.306 -18.941 22.446 1.00 23.53 ? 366 LYS A NZ 1 ATOM 2170 N N . GLU A 1 279 ? 2.543 -16.947 16.141 1.00 11.11 ? 367 GLU A N 1 ATOM 2171 C CA . GLU A 1 279 ? 2.583 -17.501 14.791 1.00 10.52 ? 367 GLU A CA 1 ATOM 2172 C C . GLU A 1 279 ? 2.764 -16.356 13.798 1.00 10.16 ? 367 GLU A C 1 ATOM 2173 O O . GLU A 1 279 ? 2.324 -15.220 14.049 1.00 9.20 ? 367 GLU A O 1 ATOM 2174 C CB . GLU A 1 279 ? 1.301 -18.287 14.495 1.00 11.59 ? 367 GLU A CB 1 ATOM 2175 C CG . GLU A 1 279 ? 0.967 -19.354 15.542 1.00 14.26 ? 367 GLU A CG 1 ATOM 2176 C CD . GLU A 1 279 ? 1.825 -20.585 15.426 1.00 20.03 ? 367 GLU A CD 1 ATOM 2177 O OE1 . GLU A 1 279 ? 2.668 -20.660 14.498 1.00 25.35 ? 367 GLU A OE1 1 ATOM 2178 O OE2 . GLU A 1 279 ? 1.654 -21.509 16.255 1.00 25.12 ? 367 GLU A OE2 1 ATOM 2179 N N . TRP A 1 280 ? 3.390 -16.631 12.660 1.00 9.06 ? 368 TRP A N 1 ATOM 2180 C CA . TRP A 1 280 ? 3.744 -15.553 11.736 1.00 9.04 ? 368 TRP A CA 1 ATOM 2181 C C . TRP A 1 280 ? 2.525 -14.873 11.087 1.00 9.67 ? 368 TRP A C 1 ATOM 2182 O O . TRP A 1 280 ? 2.552 -13.689 10.733 1.00 10.09 ? 368 TRP A O 1 ATOM 2183 C CB . TRP A 1 280 ? 4.681 -16.092 10.664 1.00 9.16 ? 368 TRP A CB 1 ATOM 2184 C CG . TRP A 1 280 ? 5.581 -15.082 10.046 1.00 9.35 ? 368 TRP A CG 1 ATOM 2185 C CD1 . TRP A 1 280 ? 5.619 -13.751 10.295 1.00 12.99 ? 368 TRP A CD1 1 ATOM 2186 C CD2 . TRP A 1 280 ? 6.568 -15.333 9.044 1.00 9.16 ? 368 TRP A CD2 1 ATOM 2187 N NE1 . TRP A 1 280 ? 6.569 -13.135 9.504 1.00 11.81 ? 368 TRP A NE1 1 ATOM 2188 C CE2 . TRP A 1 280 ? 7.198 -14.102 8.758 1.00 10.46 ? 368 TRP A CE2 1 ATOM 2189 C CE3 . TRP A 1 280 ? 7.015 -16.484 8.386 1.00 8.55 ? 368 TRP A CE3 1 ATOM 2190 C CZ2 . TRP A 1 280 ? 8.217 -13.985 7.823 1.00 8.98 ? 368 TRP A CZ2 1 ATOM 2191 C CZ3 . TRP A 1 280 ? 8.040 -16.360 7.475 1.00 9.02 ? 368 TRP A CZ3 1 ATOM 2192 C CH2 . TRP A 1 280 ? 8.606 -15.122 7.187 1.00 6.74 ? 368 TRP A CH2 1 ATOM 2193 N N . GLY A 1 281 ? 1.431 -15.631 10.994 1.00 9.36 ? 369 GLY A N 1 ATOM 2194 C CA . GLY A 1 281 ? 0.206 -15.144 10.392 1.00 7.98 ? 369 GLY A CA 1 ATOM 2195 C C . GLY A 1 281 ? -0.651 -14.311 11.326 1.00 8.62 ? 369 GLY A C 1 ATOM 2196 O O . GLY A 1 281 ? -1.762 -13.895 10.949 1.00 9.51 ? 369 GLY A O 1 ATOM 2197 N N . HIS A 1 282 ? -0.145 -14.044 12.524 1.00 7.67 ? 370 HIS A N 1 ATOM 2198 C CA . HIS A 1 282 ? -0.844 -13.199 13.475 1.00 7.89 ? 370 HIS A CA 1 ATOM 2199 C C . HIS A 1 282 ? -0.510 -11.729 13.198 1.00 7.77 ? 370 HIS A C 1 ATOM 2200 O O . HIS A 1 282 ? 0.487 -11.214 13.670 1.00 9.12 ? 370 HIS A O 1 ATOM 2201 C CB . HIS A 1 282 ? -0.514 -13.620 14.905 1.00 7.63 ? 370 HIS A CB 1 ATOM 2202 C CG . HIS A 1 282 ? -1.022 -14.982 15.253 1.00 9.51 ? 370 HIS A CG 1 ATOM 2203 N ND1 . HIS A 1 282 ? -0.817 -15.570 16.481 1.00 11.12 ? 370 HIS A ND1 1 ATOM 2204 C CD2 . HIS A 1 282 ? -1.721 -15.882 14.523 1.00 10.58 ? 370 HIS A CD2 1 ATOM 2205 C CE1 . HIS A 1 282 ? -1.382 -16.769 16.497 1.00 9.55 ? 370 HIS A CE1 1 ATOM 2206 N NE2 . HIS A 1 282 ? -1.927 -16.986 15.320 1.00 9.58 ? 370 HIS A NE2 1 ATOM 2207 N N . TRP A 1 283 ? -1.380 -11.074 12.434 1.00 7.27 ? 371 TRP A N 1 ATOM 2208 C CA . TRP A 1 283 ? -1.151 -9.724 11.911 1.00 6.65 ? 371 TRP A CA 1 ATOM 2209 C C . TRP A 1 283 ? -1.782 -8.614 12.757 1.00 7.59 ? 371 TRP A C 1 ATOM 2210 O O . TRP A 1 283 ? -1.485 -7.440 12.551 1.00 8.16 ? 371 TRP A O 1 ATOM 2211 C CB . TRP A 1 283 ? -1.670 -9.608 10.429 1.00 6.25 ? 371 TRP A CB 1 ATOM 2212 C CG . TRP A 1 283 ? -3.054 -10.120 10.250 1.00 6.40 ? 371 TRP A CG 1 ATOM 2213 C CD1 . TRP A 1 283 ? -3.411 -11.340 9.794 1.00 7.67 ? 371 TRP A CD1 1 ATOM 2214 C CD2 . TRP A 1 283 ? -4.279 -9.416 10.523 1.00 5.55 ? 371 TRP A CD2 1 ATOM 2215 N NE1 . TRP A 1 283 ? -4.777 -11.457 9.760 1.00 6.84 ? 371 TRP A NE1 1 ATOM 2216 C CE2 . TRP A 1 283 ? -5.340 -10.291 10.195 1.00 6.61 ? 371 TRP A CE2 1 ATOM 2217 C CE3 . TRP A 1 283 ? -4.590 -8.123 10.960 1.00 7.05 ? 371 TRP A CE3 1 ATOM 2218 C CZ2 . TRP A 1 283 ? -6.677 -9.943 10.333 1.00 8.04 ? 371 TRP A CZ2 1 ATOM 2219 C CZ3 . TRP A 1 283 ? -5.973 -7.766 11.107 1.00 6.94 ? 371 TRP A CZ3 1 ATOM 2220 C CH2 . TRP A 1 283 ? -6.967 -8.670 10.809 1.00 7.94 ? 371 TRP A CH2 1 ATOM 2221 N N . CYS A 1 284 ? -2.727 -8.951 13.628 1.00 6.81 ? 372 CYS A N 1 ATOM 2222 C CA . CYS A 1 284 ? -3.518 -7.907 14.265 1.00 7.25 ? 372 CYS A CA 1 ATOM 2223 C C . CYS A 1 284 ? -2.944 -7.395 15.596 1.00 6.20 ? 372 CYS A C 1 ATOM 2224 O O . CYS A 1 284 ? -2.858 -8.164 16.548 1.00 6.67 ? 372 CYS A O 1 ATOM 2225 C CB . CYS A 1 284 ? -4.924 -8.393 14.484 1.00 7.02 ? 372 CYS A CB 1 ATOM 2226 S SG . CYS A 1 284 ? -6.041 -7.060 14.965 1.00 7.10 ? 372 CYS A SG 1 ATOM 2227 N N . ASN A 1 285 ? -2.604 -6.091 15.637 1.00 6.25 ? 373 ASN A N 1 ATOM 2228 C CA . ASN A 1 285 ? -2.157 -5.424 16.863 1.00 6.01 ? 373 ASN A CA 1 ATOM 2229 C C . ASN A 1 285 ? -1.159 -6.286 17.643 1.00 5.99 ? 373 ASN A C 1 ATOM 2230 O O . ASN A 1 285 ? -1.286 -6.449 18.854 1.00 7.41 ? 373 ASN A O 1 ATOM 2231 C CB . ASN A 1 285 ? -3.359 -5.110 17.753 1.00 6.24 ? 373 ASN A CB 1 ATOM 2232 C CG . ASN A 1 285 ? -4.415 -4.286 17.029 1.00 6.38 ? 373 ASN A CG 1 ATOM 2233 O OD1 . ASN A 1 285 ? -4.084 -3.355 16.248 1.00 6.63 ? 373 ASN A OD1 1 ATOM 2234 N ND2 . ASN A 1 285 ? -5.682 -4.667 17.230 1.00 4.33 ? 373 ASN A ND2 1 ATOM 2235 N N . ALA A 1 286 ? -0.150 -6.810 16.968 1.00 6.70 ? 374 ALA A N 1 ATOM 2236 C CA . ALA A 1 286 ? 0.782 -7.766 17.589 1.00 6.56 ? 374 ALA A CA 1 ATOM 2237 C C . ALA A 1 286 ? 1.570 -7.139 18.729 1.00 8.13 ? 374 ALA A C 1 ATOM 2238 O O . ALA A 1 286 ? 2.111 -6.053 18.590 1.00 7.17 ? 374 ALA A O 1 ATOM 2239 C CB . ALA A 1 286 ? 1.742 -8.279 16.605 1.00 7.24 ? 374 ALA A CB 1 ATOM 2240 N N . ILE A 1 287 ? 1.662 -7.867 19.824 1.00 6.54 ? 375 ILE A N 1 ATOM 2241 C CA . ILE A 1 287 ? 2.477 -7.415 20.936 1.00 8.33 ? 375 ILE A CA 1 ATOM 2242 C C . ILE A 1 287 ? 3.956 -7.590 20.637 1.00 7.79 ? 375 ILE A C 1 ATOM 2243 O O . ILE A 1 287 ? 4.340 -8.294 19.702 1.00 6.13 ? 375 ILE A O 1 ATOM 2244 C CB . ILE A 1 287 ? 2.095 -8.150 22.248 1.00 8.70 ? 375 ILE A CB 1 ATOM 2245 C CG1 . ILE A 1 287 ? 2.379 -9.667 22.169 1.00 11.25 ? 375 ILE A CG1 1 ATOM 2246 C CG2 . ILE A 1 287 ? 0.653 -7.833 22.584 1.00 8.95 ? 375 ILE A CG2 1 ATOM 2247 C CD1 . ILE A 1 287 ? 1.984 -10.431 23.500 1.00 11.94 ? 375 ILE A CD1 1 ATOM 2248 N N . GLY A 1 288 ? 4.786 -6.916 21.434 1.00 7.55 ? 376 GLY A N 1 ATOM 2249 C CA . GLY A 1 288 ? 6.227 -7.023 21.302 1.00 7.14 ? 376 GLY A CA 1 ATOM 2250 C C . GLY A 1 288 ? 6.859 -6.400 20.077 1.00 7.65 ? 376 GLY A C 1 ATOM 2251 O O . GLY A 1 288 ? 7.899 -6.890 19.602 1.00 7.29 ? 376 GLY A O 1 ATOM 2252 N N . THR A 1 289 ? 6.205 -5.383 19.526 1.00 7.64 ? 377 THR A N 1 ATOM 2253 C CA . THR A 1 289 ? 6.698 -4.669 18.376 1.00 7.43 ? 377 THR A CA 1 ATOM 2254 C C . THR A 1 289 ? 7.107 -3.247 18.745 1.00 7.28 ? 377 THR A C 1 ATOM 2255 O O . THR A 1 289 ? 6.652 -2.682 19.739 1.00 8.02 ? 377 THR A O 1 ATOM 2256 C CB . THR A 1 289 ? 5.652 -4.600 17.283 1.00 8.06 ? 377 THR A CB 1 ATOM 2257 O OG1 . THR A 1 289 ? 4.503 -3.898 17.762 1.00 6.88 ? 377 THR A OG1 1 ATOM 2258 C CG2 . THR A 1 289 ? 5.167 -6.008 16.897 1.00 9.31 ? 377 THR A CG2 1 ATOM 2259 N N . GLY A 1 290 ? 7.928 -2.672 17.889 1.00 7.56 ? 378 GLY A N 1 ATOM 2260 C CA . GLY A 1 290 ? 8.440 -1.309 18.068 1.00 6.86 ? 378 GLY A CA 1 ATOM 2261 C C . GLY A 1 290 ? 8.544 -0.550 16.774 1.00 6.86 ? 378 GLY A C 1 ATOM 2262 O O . GLY A 1 290 ? 8.612 -1.107 15.679 1.00 5.78 ? 378 GLY A O 1 ATOM 2263 N N . PHE A 1 291 ? 8.513 0.767 16.881 1.00 6.59 ? 379 PHE A N 1 ATOM 2264 C CA . PHE A 1 291 ? 8.851 1.619 15.747 1.00 6.32 ? 379 PHE A CA 1 ATOM 2265 C C . PHE A 1 291 ? 10.232 1.218 15.225 1.00 5.92 ? 379 PHE A C 1 ATOM 2266 O O . PHE A 1 291 ? 11.109 0.972 16.011 1.00 6.70 ? 379 PHE A O 1 ATOM 2267 C CB . PHE A 1 291 ? 8.879 3.094 16.154 1.00 6.70 ? 379 PHE A CB 1 ATOM 2268 C CG . PHE A 1 291 ? 7.519 3.705 16.375 1.00 5.66 ? 379 PHE A CG 1 ATOM 2269 C CD1 . PHE A 1 291 ? 6.585 3.755 15.338 1.00 6.49 ? 379 PHE A CD1 1 ATOM 2270 C CD2 . PHE A 1 291 ? 7.184 4.299 17.568 1.00 5.38 ? 379 PHE A CD2 1 ATOM 2271 C CE1 . PHE A 1 291 ? 5.345 4.364 15.539 1.00 6.08 ? 379 PHE A CE1 1 ATOM 2272 C CE2 . PHE A 1 291 ? 5.888 4.855 17.751 1.00 6.28 ? 379 PHE A CE2 1 ATOM 2273 C CZ . PHE A 1 291 ? 5.020 4.899 16.729 1.00 5.69 ? 379 PHE A CZ 1 ATOM 2274 N N . GLY A 1 292 ? 10.384 1.154 13.898 1.00 5.98 ? 380 GLY A N 1 ATOM 2275 C CA . GLY A 1 292 ? 11.616 0.694 13.271 1.00 7.69 ? 380 GLY A CA 1 ATOM 2276 C C . GLY A 1 292 ? 12.416 1.766 12.557 1.00 7.92 ? 380 GLY A C 1 ATOM 2277 O O . GLY A 1 292 ? 12.281 2.954 12.875 1.00 8.09 ? 380 GLY A O 1 ATOM 2278 N N . MET A 1 293 ? 13.244 1.333 11.603 1.00 7.79 ? 381 MET A N 1 ATOM 2279 C CA . MET A 1 293 ? 14.139 2.206 10.867 1.00 9.46 ? 381 MET A CA 1 ATOM 2280 C C . MET A 1 293 ? 13.335 3.340 10.225 1.00 9.15 ? 381 MET A C 1 ATOM 2281 O O . MET A 1 293 ? 12.254 3.124 9.693 1.00 8.86 ? 381 MET A O 1 ATOM 2282 C CB . MET A 1 293 ? 14.836 1.420 9.792 1.00 9.70 ? 381 MET A CB 1 ATOM 2283 C CG . MET A 1 293 ? 15.999 0.583 10.336 1.00 13.60 ? 381 MET A CG 1 ATOM 2284 S SD . MET A 1 293 ? 17.001 -0.123 9.020 1.00 18.26 ? 381 MET A SD 1 ATOM 2285 C CE . MET A 1 293 ? 15.661 -0.698 7.967 1.00 13.04 ? 381 MET A CE 1 ATOM 2286 N N . ARG A 1 294 ? 13.872 4.552 10.331 1.00 10.39 ? 382 ARG A N 1 ATOM 2287 C CA . ARG A 1 294 ? 13.192 5.715 9.822 1.00 11.06 ? 382 ARG A CA 1 ATOM 2288 C C . ARG A 1 294 ? 13.262 5.725 8.295 1.00 9.79 ? 382 ARG A C 1 ATOM 2289 O O . ARG A 1 294 ? 14.256 5.220 7.703 1.00 8.54 ? 382 ARG A O 1 ATOM 2290 C CB . ARG A 1 294 ? 13.827 6.986 10.348 1.00 11.65 ? 382 ARG A CB 1 ATOM 2291 C CG . ARG A 1 294 ? 14.083 6.994 11.854 1.00 13.92 ? 382 ARG A CG 1 ATOM 2292 C CD . ARG A 1 294 ? 12.795 6.992 12.655 1.00 13.93 ? 382 ARG A CD 1 ATOM 2293 N NE . ARG A 1 294 ? 13.074 6.616 14.030 1.00 15.40 ? 382 ARG A NE 1 ATOM 2294 C CZ . ARG A 1 294 ? 13.644 7.398 14.903 1.00 17.61 ? 382 ARG A CZ 1 ATOM 2295 N NH1 . ARG A 1 294 ? 13.982 8.659 14.590 1.00 21.81 ? 382 ARG A NH1 1 ATOM 2296 N NH2 . ARG A 1 294 ? 13.872 6.963 16.125 1.00 12.68 ? 382 ARG A NH2 1 ATOM 2297 N N . PRO A 1 295 ? 12.223 6.293 7.667 1.00 9.24 ? 383 PRO A N 1 ATOM 2298 C CA . PRO A 1 295 ? 12.210 6.365 6.220 1.00 9.36 ? 383 PRO A CA 1 ATOM 2299 C C . PRO A 1 295 ? 13.492 6.969 5.690 1.00 8.38 ? 383 PRO A C 1 ATOM 2300 O O . PRO A 1 295 ? 13.950 7.994 6.163 1.00 8.57 ? 383 PRO A O 1 ATOM 2301 C CB . PRO A 1 295 ? 11.018 7.248 5.922 1.00 9.47 ? 383 PRO A CB 1 ATOM 2302 C CG . PRO A 1 295 ? 10.045 7.030 7.090 1.00 10.80 ? 383 PRO A CG 1 ATOM 2303 C CD . PRO A 1 295 ? 11.010 6.887 8.256 1.00 9.39 ? 383 PRO A CD 1 ATOM 2304 N N . THR A 1 296 ? 14.005 6.341 4.658 1.00 7.72 ? 384 THR A N 1 ATOM 2305 C CA . THR A 1 296 ? 15.210 6.754 3.986 1.00 7.81 ? 384 THR A CA 1 ATOM 2306 C C . THR A 1 296 ? 15.332 6.069 2.628 1.00 7.89 ? 384 THR A C 1 ATOM 2307 O O . THR A 1 296 ? 14.938 4.935 2.466 1.00 7.48 ? 384 THR A O 1 ATOM 2308 C CB . THR A 1 296 ? 16.390 6.454 4.875 1.00 8.81 ? 384 THR A CB 1 ATOM 2309 O OG1 . THR A 1 296 ? 17.591 6.889 4.248 1.00 8.93 ? 384 THR A OG1 1 ATOM 2310 C CG2 . THR A 1 296 ? 16.619 4.942 5.088 1.00 10.73 ? 384 THR A CG2 1 ATOM 2311 N N . ALA A 1 297 ? 15.956 6.772 1.683 1.00 8.13 ? 385 ALA A N 1 ATOM 2312 C CA . ALA A 1 297 ? 16.398 6.179 0.422 1.00 8.83 ? 385 ALA A CA 1 ATOM 2313 C C . ALA A 1 297 ? 17.743 5.469 0.519 1.00 9.39 ? 385 ALA A C 1 ATOM 2314 O O . ALA A 1 297 ? 18.174 4.831 -0.450 1.00 11.66 ? 385 ALA A O 1 ATOM 2315 C CB . ALA A 1 297 ? 16.454 7.257 -0.664 1.00 7.92 ? 385 ALA A CB 1 ATOM 2316 N N . ASN A 1 298 ? 18.431 5.586 1.644 1.00 10.79 ? 386 ASN A N 1 ATOM 2317 C CA . ASN A 1 298 ? 19.765 5.000 1.786 1.00 12.17 ? 386 ASN A CA 1 ATOM 2318 C C . ASN A 1 298 ? 19.650 3.570 2.282 1.00 12.52 ? 386 ASN A C 1 ATOM 2319 O O . ASN A 1 298 ? 19.847 3.284 3.471 1.00 13.70 ? 386 ASN A O 1 ATOM 2320 C CB . ASN A 1 298 ? 20.622 5.823 2.732 1.00 13.78 ? 386 ASN A CB 1 ATOM 2321 C CG . ASN A 1 298 ? 22.064 5.352 2.762 1.00 18.08 ? 386 ASN A CG 1 ATOM 2322 O OD1 . ASN A 1 298 ? 22.480 4.514 1.942 1.00 23.70 ? 386 ASN A OD1 1 ATOM 2323 N ND2 . ASN A 1 298 ? 22.837 5.871 3.724 1.00 22.64 ? 386 ASN A ND2 1 ATOM 2324 N N . THR A 1 299 ? 19.288 2.652 1.385 1.00 11.62 ? 387 THR A N 1 ATOM 2325 C CA . THR A 1 299 ? 18.960 1.291 1.807 1.00 10.96 ? 387 THR A CA 1 ATOM 2326 C C . THR A 1 299 ? 20.154 0.365 1.772 1.00 10.54 ? 387 THR A C 1 ATOM 2327 O O . THR A 1 299 ? 20.140 -0.677 2.402 1.00 11.89 ? 387 THR A O 1 ATOM 2328 C CB . THR A 1 299 ? 17.894 0.709 0.905 1.00 10.26 ? 387 THR A CB 1 ATOM 2329 O OG1 . THR A 1 299 ? 18.428 0.591 -0.429 1.00 8.70 ? 387 THR A OG1 1 ATOM 2330 C CG2 . THR A 1 299 ? 16.695 1.618 0.830 1.00 10.46 ? 387 THR A CG2 1 ATOM 2331 N N . GLY A 1 300 ? 21.168 0.718 0.994 1.00 10.44 ? 388 GLY A N 1 ATOM 2332 C CA . GLY A 1 300 ? 22.304 -0.132 0.768 1.00 9.13 ? 388 GLY A CA 1 ATOM 2333 C C . GLY A 1 300 ? 21.989 -1.340 -0.103 1.00 8.51 ? 388 GLY A C 1 ATOM 2334 O O . GLY A 1 300 ? 22.786 -2.286 -0.123 1.00 8.66 ? 388 GLY A O 1 ATOM 2335 N N . HIS A 1 301 ? 20.838 -1.339 -0.814 1.00 7.51 ? 389 HIS A N 1 ATOM 2336 C CA . HIS A 1 301 ? 20.441 -2.489 -1.606 1.00 7.37 ? 389 HIS A CA 1 ATOM 2337 C C . HIS A 1 301 ? 19.993 -2.033 -2.968 1.00 9.01 ? 389 HIS A C 1 ATOM 2338 O O . HIS A 1 301 ? 19.137 -1.157 -3.079 1.00 7.91 ? 389 HIS A O 1 ATOM 2339 C CB . HIS A 1 301 ? 19.273 -3.292 -0.953 1.00 7.91 ? 389 HIS A CB 1 ATOM 2340 C CG . HIS A 1 301 ? 19.174 -4.693 -1.477 1.00 6.92 ? 389 HIS A CG 1 ATOM 2341 N ND1 . HIS A 1 301 ? 18.769 -4.976 -2.760 1.00 10.17 ? 389 HIS A ND1 1 ATOM 2342 C CD2 . HIS A 1 301 ? 19.577 -5.873 -0.942 1.00 9.94 ? 389 HIS A CD2 1 ATOM 2343 C CE1 . HIS A 1 301 ? 18.862 -6.278 -2.969 1.00 9.88 ? 389 HIS A CE1 1 ATOM 2344 N NE2 . HIS A 1 301 ? 19.359 -6.843 -1.884 1.00 10.16 ? 389 HIS A NE2 1 ATOM 2345 N N . GLN A 1 302 ? 20.511 -2.662 -4.018 1.00 8.77 ? 390 GLN A N 1 ATOM 2346 C CA . GLN A 1 302 ? 20.185 -2.145 -5.350 1.00 9.87 ? 390 GLN A CA 1 ATOM 2347 C C . GLN A 1 302 ? 18.711 -2.271 -5.728 1.00 9.20 ? 390 GLN A C 1 ATOM 2348 O O . GLN A 1 302 ? 18.255 -1.500 -6.560 1.00 10.39 ? 390 GLN A O 1 ATOM 2349 C CB A GLN A 1 302 ? 21.091 -2.745 -6.433 0.50 10.27 ? 390 GLN A CB 1 ATOM 2350 C CB B GLN A 1 302 ? 21.072 -2.775 -6.417 0.50 10.22 ? 390 GLN A CB 1 ATOM 2351 C CG A GLN A 1 302 ? 20.788 -4.169 -6.817 0.50 11.80 ? 390 GLN A CG 1 ATOM 2352 C CG B GLN A 1 302 ? 22.493 -2.212 -6.393 0.50 12.42 ? 390 GLN A CG 1 ATOM 2353 C CD A GLN A 1 302 ? 21.585 -4.663 -8.039 0.50 15.60 ? 390 GLN A CD 1 ATOM 2354 C CD B GLN A 1 302 ? 22.626 -0.846 -7.101 0.50 13.81 ? 390 GLN A CD 1 ATOM 2355 O OE1 A GLN A 1 302 ? 21.860 -3.901 -8.978 0.50 18.97 ? 390 GLN A OE1 1 ATOM 2356 O OE1 B GLN A 1 302 ? 22.622 -0.782 -8.326 0.50 19.48 ? 390 GLN A OE1 1 ATOM 2357 N NE2 A GLN A 1 302 ? 21.951 -5.938 -8.020 0.50 15.71 ? 390 GLN A NE2 1 ATOM 2358 N NE2 B GLN A 1 302 ? 22.777 0.220 -6.332 0.50 14.72 ? 390 GLN A NE2 1 ATOM 2359 N N . TYR A 1 303 ? 17.980 -3.209 -5.124 1.00 8.73 ? 391 TYR A N 1 ATOM 2360 C CA . TYR A 1 303 ? 16.591 -3.458 -5.532 1.00 8.73 ? 391 TYR A CA 1 ATOM 2361 C C . TYR A 1 303 ? 15.589 -2.710 -4.681 1.00 7.69 ? 391 TYR A C 1 ATOM 2362 O O . TYR A 1 303 ? 14.343 -2.828 -4.933 1.00 6.86 ? 391 TYR A O 1 ATOM 2363 C CB . TYR A 1 303 ? 16.245 -4.945 -5.446 1.00 9.25 ? 391 TYR A CB 1 ATOM 2364 C CG . TYR A 1 303 ? 17.011 -5.863 -6.378 1.00 11.64 ? 391 TYR A CG 1 ATOM 2365 C CD1 . TYR A 1 303 ? 17.545 -5.406 -7.582 1.00 12.76 ? 391 TYR A CD1 1 ATOM 2366 C CD2 . TYR A 1 303 ? 17.135 -7.215 -6.073 1.00 12.18 ? 391 TYR A CD2 1 ATOM 2367 C CE1 . TYR A 1 303 ? 18.256 -6.270 -8.414 1.00 13.06 ? 391 TYR A CE1 1 ATOM 2368 C CE2 . TYR A 1 303 ? 17.793 -8.085 -6.920 1.00 13.66 ? 391 TYR A CE2 1 ATOM 2369 C CZ . TYR A 1 303 ? 18.351 -7.603 -8.080 1.00 14.61 ? 391 TYR A CZ 1 ATOM 2370 O OH . TYR A 1 303 ? 19.004 -8.481 -8.921 1.00 17.39 ? 391 TYR A OH 1 ATOM 2371 N N . VAL A 1 304 ? 16.077 -1.964 -3.685 1.00 6.98 ? 392 VAL A N 1 ATOM 2372 C CA . VAL A 1 304 ? 15.173 -1.336 -2.703 1.00 6.17 ? 392 VAL A CA 1 ATOM 2373 C C . VAL A 1 304 ? 15.341 0.185 -2.778 1.00 5.96 ? 392 VAL A C 1 ATOM 2374 O O . VAL A 1 304 ? 16.387 0.719 -2.410 1.00 6.13 ? 392 VAL A O 1 ATOM 2375 C CB . VAL A 1 304 ? 15.437 -1.856 -1.261 1.00 6.23 ? 392 VAL A CB 1 ATOM 2376 C CG1 . VAL A 1 304 ? 14.387 -1.356 -0.301 1.00 7.81 ? 392 VAL A CG1 1 ATOM 2377 C CG2 . VAL A 1 304 ? 15.463 -3.376 -1.269 1.00 7.36 ? 392 VAL A CG2 1 ATOM 2378 N N . ASP A 1 305 ? 14.307 0.867 -3.258 1.00 6.44 ? 393 ASP A N 1 ATOM 2379 C CA . ASP A 1 305 ? 14.331 2.312 -3.363 1.00 6.05 ? 393 ASP A CA 1 ATOM 2380 C C . ASP A 1 305 ? 14.339 3.006 -1.998 1.00 5.83 ? 393 ASP A C 1 ATOM 2381 O O . ASP A 1 305 ? 14.894 4.090 -1.851 1.00 7.19 ? 393 ASP A O 1 ATOM 2382 C CB . ASP A 1 305 ? 13.153 2.843 -4.168 1.00 5.43 ? 393 ASP A CB 1 ATOM 2383 C CG . ASP A 1 305 ? 13.255 2.546 -5.632 1.00 6.20 ? 393 ASP A CG 1 ATOM 2384 O OD1 . ASP A 1 305 ? 14.362 2.280 -6.174 1.00 6.37 ? 393 ASP A OD1 1 ATOM 2385 O OD2 . ASP A 1 305 ? 12.208 2.548 -6.325 1.00 7.50 ? 393 ASP A OD2 1 ATOM 2386 N N . ALA A 1 306 ? 13.658 2.406 -1.019 1.00 7.21 ? 394 ALA A N 1 ATOM 2387 C CA . ALA A 1 306 ? 13.517 3.069 0.266 1.00 6.30 ? 394 ALA A CA 1 ATOM 2388 C C . ALA A 1 306 ? 12.965 2.151 1.292 1.00 5.48 ? 394 ALA A C 1 ATOM 2389 O O . ALA A 1 306 ? 12.195 1.241 0.994 1.00 5.95 ? 394 ALA A O 1 ATOM 2390 C CB . ALA A 1 306 ? 12.567 4.312 0.118 1.00 6.34 ? 394 ALA A CB 1 ATOM 2391 N N . PHE A 1 307 ? 13.358 2.414 2.539 1.00 6.80 ? 395 PHE A N 1 ATOM 2392 C CA . PHE A 1 307 ? 12.605 1.988 3.690 1.00 6.72 ? 395 PHE A CA 1 ATOM 2393 C C . PHE A 1 307 ? 11.608 3.083 3.999 1.00 6.80 ? 395 PHE A C 1 ATOM 2394 O O . PHE A 1 307 ? 11.958 4.282 4.032 1.00 7.33 ? 395 PHE A O 1 ATOM 2395 C CB . PHE A 1 307 ? 13.534 1.746 4.898 1.00 7.44 ? 395 PHE A CB 1 ATOM 2396 C CG . PHE A 1 307 ? 14.578 0.714 4.646 1.00 7.21 ? 395 PHE A CG 1 ATOM 2397 C CD1 . PHE A 1 307 ? 14.219 -0.547 4.187 1.00 9.06 ? 395 PHE A CD1 1 ATOM 2398 C CD2 . PHE A 1 307 ? 15.942 0.984 4.847 1.00 9.31 ? 395 PHE A CD2 1 ATOM 2399 C CE1 . PHE A 1 307 ? 15.164 -1.515 3.908 1.00 10.55 ? 395 PHE A CE1 1 ATOM 2400 C CE2 . PHE A 1 307 ? 16.893 0.016 4.565 1.00 11.62 ? 395 PHE A CE2 1 ATOM 2401 C CZ . PHE A 1 307 ? 16.520 -1.230 4.073 1.00 9.25 ? 395 PHE A CZ 1 ATOM 2402 N N . VAL A 1 308 ? 10.396 2.657 4.271 1.00 5.89 ? 396 VAL A N 1 ATOM 2403 C CA . VAL A 1 308 ? 9.270 3.574 4.443 1.00 7.61 ? 396 VAL A CA 1 ATOM 2404 C C . VAL A 1 308 ? 8.443 3.222 5.665 1.00 7.57 ? 396 VAL A C 1 ATOM 2405 O O . VAL A 1 308 ? 8.583 2.134 6.209 1.00 8.04 ? 396 VAL A O 1 ATOM 2406 C CB . VAL A 1 308 ? 8.399 3.620 3.194 1.00 8.26 ? 396 VAL A CB 1 ATOM 2407 C CG1 . VAL A 1 308 ? 9.081 4.353 2.091 1.00 7.09 ? 396 VAL A CG1 1 ATOM 2408 C CG2 . VAL A 1 308 ? 7.945 2.232 2.750 1.00 9.26 ? 396 VAL A CG2 1 ATOM 2409 N N . TRP A 1 309 ? 7.577 4.134 6.112 1.00 7.54 ? 397 TRP A N 1 ATOM 2410 C CA . TRP A 1 309 ? 6.528 3.817 7.088 1.00 8.22 ? 397 TRP A CA 1 ATOM 2411 C C . TRP A 1 309 ? 5.181 3.963 6.381 1.00 8.43 ? 397 TRP A C 1 ATOM 2412 O O . TRP A 1 309 ? 4.754 5.084 6.095 1.00 6.60 ? 397 TRP A O 1 ATOM 2413 C CB . TRP A 1 309 ? 6.566 4.775 8.285 1.00 8.32 ? 397 TRP A CB 1 ATOM 2414 C CG . TRP A 1 309 ? 7.680 4.553 9.240 1.00 6.40 ? 397 TRP A CG 1 ATOM 2415 C CD1 . TRP A 1 309 ? 8.841 3.836 9.055 1.00 6.48 ? 397 TRP A CD1 1 ATOM 2416 C CD2 . TRP A 1 309 ? 7.746 5.058 10.581 1.00 5.62 ? 397 TRP A CD2 1 ATOM 2417 N NE1 . TRP A 1 309 ? 9.615 3.879 10.199 1.00 8.45 ? 397 TRP A NE1 1 ATOM 2418 C CE2 . TRP A 1 309 ? 8.954 4.597 11.151 1.00 7.16 ? 397 TRP A CE2 1 ATOM 2419 C CE3 . TRP A 1 309 ? 6.882 5.818 11.363 1.00 8.50 ? 397 TRP A CE3 1 ATOM 2420 C CZ2 . TRP A 1 309 ? 9.331 4.882 12.488 1.00 7.98 ? 397 TRP A CZ2 1 ATOM 2421 C CZ3 . TRP A 1 309 ? 7.271 6.109 12.706 1.00 7.49 ? 397 TRP A CZ3 1 ATOM 2422 C CH2 . TRP A 1 309 ? 8.479 5.654 13.210 1.00 8.43 ? 397 TRP A CH2 1 ATOM 2423 N N . VAL A 1 310 ? 4.591 2.832 6.013 1.00 7.66 ? 398 VAL A N 1 ATOM 2424 C CA . VAL A 1 310 ? 3.321 2.853 5.279 1.00 6.94 ? 398 VAL A CA 1 ATOM 2425 C C . VAL A 1 310 ? 2.166 2.844 6.248 1.00 6.89 ? 398 VAL A C 1 ATOM 2426 O O . VAL A 1 310 ? 1.370 3.783 6.286 1.00 7.95 ? 398 VAL A O 1 ATOM 2427 C CB . VAL A 1 310 ? 3.215 1.724 4.232 1.00 6.94 ? 398 VAL A CB 1 ATOM 2428 C CG1 . VAL A 1 310 ? 1.948 1.963 3.383 1.00 7.02 ? 398 VAL A CG1 1 ATOM 2429 C CG2 . VAL A 1 310 ? 4.452 1.723 3.367 1.00 9.96 ? 398 VAL A CG2 1 ATOM 2430 N N . LYS A 1 311 ? 2.063 1.796 7.060 1.00 6.89 ? 399 LYS A N 1 ATOM 2431 C CA . LYS A 1 311 ? 1.085 1.752 8.120 1.00 7.96 ? 399 LYS A CA 1 ATOM 2432 C C . LYS A 1 311 ? 1.538 2.695 9.237 1.00 7.27 ? 399 LYS A C 1 ATOM 2433 O O . LYS A 1 311 ? 2.605 2.493 9.760 1.00 7.34 ? 399 LYS A O 1 ATOM 2434 C CB . LYS A 1 311 ? 0.942 0.310 8.646 1.00 8.38 ? 399 LYS A CB 1 ATOM 2435 C CG . LYS A 1 311 ? 0.092 0.177 9.908 1.00 8.02 ? 399 LYS A CG 1 ATOM 2436 C CD . LYS A 1 311 ? -1.362 0.457 9.663 1.00 7.56 ? 399 LYS A CD 1 ATOM 2437 C CE . LYS A 1 311 ? -2.186 0.290 10.966 1.00 6.40 ? 399 LYS A CE 1 ATOM 2438 N NZ . LYS A 1 311 ? -3.597 0.305 10.708 1.00 6.86 ? 399 LYS A NZ 1 ATOM 2439 N N . PRO A 1 312 ? 0.733 3.704 9.612 1.00 6.56 ? 400 PRO A N 1 ATOM 2440 C CA . PRO A 1 312 ? 1.134 4.613 10.711 1.00 8.10 ? 400 PRO A CA 1 ATOM 2441 C C . PRO A 1 312 ? 0.917 3.927 12.069 1.00 7.62 ? 400 PRO A C 1 ATOM 2442 O O . PRO A 1 312 ? -0.196 3.738 12.504 1.00 6.03 ? 400 PRO A O 1 ATOM 2443 C CB . PRO A 1 312 ? 0.222 5.853 10.524 1.00 9.68 ? 400 PRO A CB 1 ATOM 2444 C CG . PRO A 1 312 ? -0.483 5.632 9.227 1.00 7.28 ? 400 PRO A CG 1 ATOM 2445 C CD . PRO A 1 312 ? -0.525 4.155 9.006 1.00 7.46 ? 400 PRO A CD 1 ATOM 2446 N N . GLY A 1 313 ? 2.002 3.670 12.768 1.00 7.79 ? 401 GLY A N 1 ATOM 2447 C CA . GLY A 1 313 ? 1.950 2.975 14.062 1.00 8.53 ? 401 GLY A CA 1 ATOM 2448 C C . GLY A 1 313 ? 1.142 3.752 15.085 1.00 8.27 ? 401 GLY A C 1 ATOM 2449 O O . GLY A 1 313 ? 1.365 4.955 15.260 1.00 8.11 ? 401 GLY A O 1 ATOM 2450 N N . GLY A 1 314 ? 0.179 3.066 15.708 1.00 6.78 ? 402 GLY A N 1 ATOM 2451 C CA . GLY A 1 314 ? -0.763 3.708 16.580 1.00 6.58 ? 402 GLY A CA 1 ATOM 2452 C C . GLY A 1 314 ? -2.158 3.606 16.066 1.00 5.84 ? 402 GLY A C 1 ATOM 2453 O O . GLY A 1 314 ? -3.099 3.577 16.874 1.00 6.16 ? 402 GLY A O 1 ATOM 2454 N N . GLU A 1 315 ? -2.314 3.583 14.742 1.00 5.99 ? 403 GLU A N 1 ATOM 2455 C CA . GLU A 1 315 ? -3.622 3.351 14.126 1.00 5.91 ? 403 GLU A CA 1 ATOM 2456 C C . GLU A 1 315 ? -3.879 1.850 14.136 1.00 6.84 ? 403 GLU A C 1 ATOM 2457 O O . GLU A 1 315 ? -3.058 1.057 13.709 1.00 8.06 ? 403 GLU A O 1 ATOM 2458 C CB . GLU A 1 315 ? -3.695 3.936 12.720 1.00 6.06 ? 403 GLU A CB 1 ATOM 2459 C CG . GLU A 1 315 ? -3.424 5.419 12.716 1.00 8.09 ? 403 GLU A CG 1 ATOM 2460 C CD . GLU A 1 315 ? -3.481 6.087 11.361 1.00 11.00 ? 403 GLU A CD 1 ATOM 2461 O OE1 . GLU A 1 315 ? -3.825 5.437 10.349 1.00 10.33 ? 403 GLU A OE1 1 ATOM 2462 O OE2 . GLU A 1 315 ? -3.257 7.348 11.320 1.00 10.58 ? 403 GLU A OE2 1 ATOM 2463 N N . CYS A 1 316 ? -5.000 1.483 14.718 1.00 6.36 ? 404 CYS A N 1 ATOM 2464 C CA . CYS A 1 316 ? -5.350 0.110 15.001 1.00 6.13 ? 404 CYS A CA 1 ATOM 2465 C C . CYS A 1 316 ? -5.485 -0.744 13.746 1.00 6.31 ? 404 CYS A C 1 ATOM 2466 O O . CYS A 1 316 ? -5.830 -0.227 12.693 1.00 7.60 ? 404 CYS A O 1 ATOM 2467 C CB . CYS A 1 316 ? -6.659 0.094 15.752 1.00 6.17 ? 404 CYS A CB 1 ATOM 2468 S SG . CYS A 1 316 ? -6.969 -1.460 16.599 1.00 7.30 ? 404 CYS A SG 1 ATOM 2469 N N . ASP A 1 317 ? -5.233 -2.042 13.894 1.00 7.50 ? 405 ASP A N 1 ATOM 2470 C CA . ASP A 1 317 ? -5.408 -3.007 12.809 1.00 7.21 ? 405 ASP A CA 1 ATOM 2471 C C . ASP A 1 317 ? -6.812 -3.631 12.810 1.00 7.95 ? 405 ASP A C 1 ATOM 2472 O O . ASP A 1 317 ? -7.195 -4.264 11.834 1.00 8.40 ? 405 ASP A O 1 ATOM 2473 C CB . ASP A 1 317 ? -4.431 -4.160 12.944 1.00 7.40 ? 405 ASP A CB 1 ATOM 2474 C CG . ASP A 1 317 ? -3.004 -3.754 12.906 1.00 9.24 ? 405 ASP A CG 1 ATOM 2475 O OD1 . ASP A 1 317 ? -2.625 -2.912 12.030 1.00 10.64 ? 405 ASP A OD1 1 ATOM 2476 O OD2 . ASP A 1 317 ? -2.151 -4.258 13.687 1.00 9.29 ? 405 ASP A OD2 1 ATOM 2477 N N . GLY A 1 318 ? -7.544 -3.476 13.917 1.00 7.51 ? 406 GLY A N 1 ATOM 2478 C CA . GLY A 1 318 ? -8.854 -4.102 14.050 1.00 7.54 ? 406 GLY A CA 1 ATOM 2479 C C . GLY A 1 318 ? -9.356 -4.182 15.460 1.00 7.47 ? 406 GLY A C 1 ATOM 2480 O O . GLY A 1 318 ? -8.586 -4.265 16.403 1.00 6.74 ? 406 GLY A O 1 ATOM 2481 N N . THR A 1 319 ? -10.674 -4.138 15.601 1.00 6.49 ? 407 THR A N 1 ATOM 2482 C CA . THR A 1 319 ? -11.286 -4.189 16.913 1.00 7.26 ? 407 THR A CA 1 ATOM 2483 C C . THR A 1 319 ? -11.157 -5.540 17.586 1.00 6.84 ? 407 THR A C 1 ATOM 2484 O O . THR A 1 319 ? -11.212 -6.584 16.930 1.00 7.92 ? 407 THR A O 1 ATOM 2485 C CB . THR A 1 319 ? -12.729 -3.757 16.817 1.00 7.58 ? 407 THR A CB 1 ATOM 2486 O OG1 . THR A 1 319 ? -13.311 -3.787 18.111 1.00 7.87 ? 407 THR A OG1 1 ATOM 2487 C CG2 . THR A 1 319 ? -13.551 -4.753 15.908 1.00 6.94 ? 407 THR A CG2 1 ATOM 2488 N N . SER A 1 320 ? -10.984 -5.522 18.906 1.00 6.20 ? 408 SER A N 1 ATOM 2489 C CA . SER A 1 320 ? -11.018 -6.757 19.703 1.00 6.18 ? 408 SER A CA 1 ATOM 2490 C C . SER A 1 320 ? -12.396 -6.995 20.338 1.00 6.44 ? 408 SER A C 1 ATOM 2491 O O . SER A 1 320 ? -12.570 -7.943 21.122 1.00 6.31 ? 408 SER A O 1 ATOM 2492 C CB . SER A 1 320 ? -9.899 -6.736 20.756 1.00 6.48 ? 408 SER A CB 1 ATOM 2493 O OG . SER A 1 320 ? -10.197 -5.735 21.741 1.00 8.38 ? 408 SER A OG 1 ATOM 2494 N N . ASP A 1 321 ? -13.371 -6.147 20.006 1.00 5.97 ? 409 ASP A N 1 ATOM 2495 C CA . ASP A 1 321 ? -14.729 -6.285 20.531 1.00 7.43 ? 409 ASP A CA 1 ATOM 2496 C C . ASP A 1 321 ? -15.409 -7.437 19.772 1.00 6.53 ? 409 ASP A C 1 ATOM 2497 O O . ASP A 1 321 ? -15.684 -7.313 18.588 1.00 7.29 ? 409 ASP A O 1 ATOM 2498 C CB . ASP A 1 321 ? -15.492 -4.963 20.350 1.00 7.14 ? 409 ASP A CB 1 ATOM 2499 C CG . ASP A 1 321 ? -16.924 -5.028 20.840 1.00 9.90 ? 409 ASP A CG 1 ATOM 2500 O OD1 . ASP A 1 321 ? -17.451 -6.103 21.336 1.00 10.66 ? 409 ASP A OD1 1 ATOM 2501 O OD2 . ASP A 1 321 ? -17.651 -4.004 20.736 1.00 11.53 ? 409 ASP A OD2 1 ATOM 2502 N N . THR A 1 322 ? -15.661 -8.549 20.450 1.00 7.40 ? 410 THR A N 1 ATOM 2503 C CA . THR A 1 322 ? -16.234 -9.732 19.803 1.00 7.30 ? 410 THR A CA 1 ATOM 2504 C C . THR A 1 322 ? -17.632 -9.538 19.273 1.00 7.93 ? 410 THR A C 1 ATOM 2505 O O . THR A 1 322 ? -18.091 -10.374 18.477 1.00 8.45 ? 410 THR A O 1 ATOM 2506 C CB . THR A 1 322 ? -16.229 -10.964 20.710 1.00 7.48 ? 410 THR A CB 1 ATOM 2507 O OG1 . THR A 1 322 ? -17.003 -10.700 21.891 1.00 7.66 ? 410 THR A OG1 1 ATOM 2508 C CG2 . THR A 1 322 ? -14.834 -11.248 21.191 1.00 8.96 ? 410 THR A CG2 1 ATOM 2509 N N . THR A 1 323 ? -18.341 -8.498 19.744 1.00 8.44 ? 411 THR A N 1 ATOM 2510 C CA . THR A 1 323 ? -19.706 -8.217 19.263 1.00 8.95 ? 411 THR A CA 1 ATOM 2511 C C . THR A 1 323 ? -19.774 -7.289 18.049 1.00 8.61 ? 411 THR A C 1 ATOM 2512 O O . THR A 1 323 ? -20.850 -7.105 17.473 1.00 7.60 ? 411 THR A O 1 ATOM 2513 C CB . THR A 1 323 ? -20.575 -7.620 20.415 1.00 8.98 ? 411 THR A CB 1 ATOM 2514 O OG1 . THR A 1 323 ? -20.179 -6.256 20.667 1.00 11.37 ? 411 THR A OG1 1 ATOM 2515 C CG2 . THR A 1 323 ? -20.302 -8.310 21.710 1.00 10.28 ? 411 THR A CG2 1 ATOM 2516 N N . ALA A 1 324 ? -18.641 -6.719 17.634 1.00 7.61 ? 412 ALA A N 1 ATOM 2517 C CA . ALA A 1 324 ? -18.597 -5.744 16.523 1.00 8.66 ? 412 ALA A CA 1 ATOM 2518 C C . ALA A 1 324 ? -18.704 -6.446 15.163 1.00 8.90 ? 412 ALA A C 1 ATOM 2519 O O . ALA A 1 324 ? -18.252 -7.575 14.971 1.00 7.39 ? 412 ALA A O 1 ATOM 2520 C CB . ALA A 1 324 ? -17.333 -4.921 16.538 1.00 9.64 ? 412 ALA A CB 1 ATOM 2521 N N . ALA A 1 325 ? -19.262 -5.719 14.219 1.00 8.45 ? 413 ALA A N 1 ATOM 2522 C CA . ALA A 1 325 ? -19.470 -6.206 12.875 1.00 8.48 ? 413 ALA A CA 1 ATOM 2523 C C . ALA A 1 325 ? -18.171 -6.613 12.237 1.00 8.50 ? 413 ALA A C 1 ATOM 2524 O O . ALA A 1 325 ? -18.114 -7.584 11.483 1.00 9.33 ? 413 ALA A O 1 ATOM 2525 C CB . ALA A 1 325 ? -20.090 -5.103 12.057 1.00 9.22 ? 413 ALA A CB 1 ATOM 2526 N N . ARG A 1 326 ? -17.137 -5.823 12.487 1.00 6.83 ? 414 ARG A N 1 ATOM 2527 C CA . ARG A 1 326 ? -15.823 -6.028 11.885 1.00 6.54 ? 414 ARG A CA 1 ATOM 2528 C C . ARG A 1 326 ? -14.887 -6.826 12.773 1.00 6.11 ? 414 ARG A C 1 ATOM 2529 O O . ARG A 1 326 ? -13.694 -6.809 12.554 1.00 6.78 ? 414 ARG A O 1 ATOM 2530 C CB . ARG A 1 326 ? -15.209 -4.690 11.488 1.00 6.19 ? 414 ARG A CB 1 ATOM 2531 C CG . ARG A 1 326 ? -15.978 -3.913 10.393 1.00 6.81 ? 414 ARG A CG 1 ATOM 2532 C CD . ARG A 1 326 ? -15.129 -2.978 9.529 1.00 9.53 ? 414 ARG A CD 1 ATOM 2533 N NE . ARG A 1 326 ? -14.475 -1.988 10.363 1.00 6.52 ? 414 ARG A NE 1 ATOM 2534 C CZ . ARG A 1 326 ? -13.530 -1.148 9.953 1.00 9.94 ? 414 ARG A CZ 1 ATOM 2535 N NH1 . ARG A 1 326 ? -13.132 -1.102 8.693 1.00 10.61 ? 414 ARG A NH1 1 ATOM 2536 N NH2 . ARG A 1 326 ? -12.970 -0.328 10.823 1.00 11.10 ? 414 ARG A NH2 1 ATOM 2537 N N . TYR A 1 327 ? -15.402 -7.535 13.763 1.00 6.31 ? 415 TYR A N 1 ATOM 2538 C CA . TYR A 1 327 ? -14.557 -8.396 14.605 1.00 5.45 ? 415 TYR A CA 1 ATOM 2539 C C . TYR A 1 327 ? -13.970 -9.531 13.750 1.00 5.74 ? 415 TYR A C 1 ATOM 2540 O O . TYR A 1 327 ? -14.707 -10.302 13.093 1.00 5.65 ? 415 TYR A O 1 ATOM 2541 C CB . TYR A 1 327 ? -15.308 -8.989 15.786 1.00 5.51 ? 415 TYR A CB 1 ATOM 2542 C CG . TYR A 1 327 ? -14.399 -9.926 16.594 1.00 3.07 ? 415 TYR A CG 1 ATOM 2543 C CD1 . TYR A 1 327 ? -13.329 -9.422 17.298 1.00 4.65 ? 415 TYR A CD1 1 ATOM 2544 C CD2 . TYR A 1 327 ? -14.600 -11.283 16.591 1.00 5.81 ? 415 TYR A CD2 1 ATOM 2545 C CE1 . TYR A 1 327 ? -12.477 -10.238 18.020 1.00 7.40 ? 415 TYR A CE1 1 ATOM 2546 C CE2 . TYR A 1 327 ? -13.790 -12.108 17.315 1.00 5.88 ? 415 TYR A CE2 1 ATOM 2547 C CZ . TYR A 1 327 ? -12.682 -11.576 17.994 1.00 5.71 ? 415 TYR A CZ 1 ATOM 2548 O OH . TYR A 1 327 ? -11.869 -12.410 18.730 1.00 9.15 ? 415 TYR A OH 1 ATOM 2549 N N . ASP A 1 328 ? -12.655 -9.630 13.817 1.00 5.74 ? 416 ASP A N 1 ATOM 2550 C CA . ASP A 1 328 ? -11.850 -10.685 13.205 1.00 6.53 ? 416 ASP A CA 1 ATOM 2551 C C . ASP A 1 328 ? -11.136 -11.448 14.320 1.00 6.33 ? 416 ASP A C 1 ATOM 2552 O O . ASP A 1 328 ? -10.502 -10.833 15.209 1.00 7.20 ? 416 ASP A O 1 ATOM 2553 C CB . ASP A 1 328 ? -10.814 -10.051 12.285 1.00 6.64 ? 416 ASP A CB 1 ATOM 2554 C CG . ASP A 1 328 ? -10.121 -11.089 11.388 1.00 9.28 ? 416 ASP A CG 1 ATOM 2555 O OD1 . ASP A 1 328 ? -9.301 -11.885 11.910 1.00 8.25 ? 416 ASP A OD1 1 ATOM 2556 O OD2 . ASP A 1 328 ? -10.394 -11.184 10.165 1.00 10.30 ? 416 ASP A OD2 1 ATOM 2557 N N . TYR A 1 329 ? -11.222 -12.777 14.308 1.00 6.52 ? 417 TYR A N 1 ATOM 2558 C CA . TYR A 1 329 ? -10.598 -13.553 15.358 1.00 6.20 ? 417 TYR A CA 1 ATOM 2559 C C . TYR A 1 329 ? -9.101 -13.281 15.548 1.00 5.41 ? 417 TYR A C 1 ATOM 2560 O O . TYR A 1 329 ? -8.573 -13.491 16.657 1.00 6.12 ? 417 TYR A O 1 ATOM 2561 C CB . TYR A 1 329 ? -10.842 -15.046 15.146 1.00 7.50 ? 417 TYR A CB 1 ATOM 2562 C CG . TYR A 1 329 ? -9.905 -15.696 14.162 1.00 7.83 ? 417 TYR A CG 1 ATOM 2563 C CD1 . TYR A 1 329 ? -10.230 -15.735 12.817 1.00 10.21 ? 417 TYR A CD1 1 ATOM 2564 C CD2 . TYR A 1 329 ? -8.722 -16.319 14.580 1.00 8.40 ? 417 TYR A CD2 1 ATOM 2565 C CE1 . TYR A 1 329 ? -9.413 -16.344 11.898 1.00 11.06 ? 417 TYR A CE1 1 ATOM 2566 C CE2 . TYR A 1 329 ? -7.903 -16.966 13.641 1.00 8.91 ? 417 TYR A CE2 1 ATOM 2567 C CZ . TYR A 1 329 ? -8.256 -16.949 12.317 1.00 11.11 ? 417 TYR A CZ 1 ATOM 2568 O OH . TYR A 1 329 ? -7.500 -17.538 11.333 1.00 15.56 ? 417 TYR A OH 1 ATOM 2569 N N . HIS A 1 330 ? -8.402 -12.836 14.499 1.00 5.00 ? 418 HIS A N 1 ATOM 2570 C CA . HIS A 1 330 ? -6.984 -12.506 14.676 1.00 6.12 ? 418 HIS A CA 1 ATOM 2571 C C . HIS A 1 330 ? -6.746 -11.422 15.726 1.00 6.48 ? 418 HIS A C 1 ATOM 2572 O O . HIS A 1 330 ? -5.724 -11.411 16.392 1.00 6.58 ? 418 HIS A O 1 ATOM 2573 C CB . HIS A 1 330 ? -6.306 -12.087 13.384 1.00 5.83 ? 418 HIS A CB 1 ATOM 2574 C CG . HIS A 1 330 ? -6.155 -13.199 12.391 1.00 7.32 ? 418 HIS A CG 1 ATOM 2575 N ND1 . HIS A 1 330 ? -7.094 -13.459 11.416 1.00 9.11 ? 418 HIS A ND1 1 ATOM 2576 C CD2 . HIS A 1 330 ? -5.132 -14.063 12.171 1.00 11.24 ? 418 HIS A CD2 1 ATOM 2577 C CE1 . HIS A 1 330 ? -6.670 -14.466 10.659 1.00 11.32 ? 418 HIS A CE1 1 ATOM 2578 N NE2 . HIS A 1 330 ? -5.482 -14.849 11.102 1.00 10.60 ? 418 HIS A NE2 1 ATOM 2579 N N . CYS A 1 331 ? -7.731 -10.561 15.905 1.00 6.55 ? 419 CYS A N 1 ATOM 2580 C CA . CYS A 1 331 ? -7.647 -9.475 16.854 1.00 6.94 ? 419 CYS A CA 1 ATOM 2581 C C . CYS A 1 331 ? -8.031 -9.837 18.295 1.00 7.16 ? 419 CYS A C 1 ATOM 2582 O O . CYS A 1 331 ? -7.911 -9.002 19.190 1.00 7.18 ? 419 CYS A O 1 ATOM 2583 C CB . CYS A 1 331 ? -8.496 -8.311 16.312 1.00 7.11 ? 419 CYS A CB 1 ATOM 2584 S SG . CYS A 1 331 ? -7.954 -7.722 14.661 1.00 8.49 ? 419 CYS A SG 1 ATOM 2585 N N . GLY A 1 332 ? -8.510 -11.057 18.497 1.00 7.00 ? 420 GLY A N 1 ATOM 2586 C CA . GLY A 1 332 ? -8.816 -11.560 19.833 1.00 8.55 ? 420 GLY A CA 1 ATOM 2587 C C . GLY A 1 332 ? -7.795 -12.530 20.365 1.00 8.58 ? 420 GLY A C 1 ATOM 2588 O O . GLY A 1 332 ? -7.949 -13.038 21.473 1.00 9.23 ? 420 GLY A O 1 ATOM 2589 N N . LEU A 1 333 ? -6.736 -12.767 19.601 1.00 8.68 ? 421 LEU A N 1 ATOM 2590 C CA . LEU A 1 333 ? -5.743 -13.757 19.947 1.00 9.05 ? 421 LEU A CA 1 ATOM 2591 C C . LEU A 1 333 ? -4.886 -13.286 21.128 1.00 9.68 ? 421 LEU A C 1 ATOM 2592 O O . LEU A 1 333 ? -4.861 -12.111 21.470 1.00 9.49 ? 421 LEU A O 1 ATOM 2593 C CB . LEU A 1 333 ? -4.870 -14.079 18.745 1.00 10.10 ? 421 LEU A CB 1 ATOM 2594 C CG . LEU A 1 333 ? -5.482 -14.787 17.551 1.00 10.45 ? 421 LEU A CG 1 ATOM 2595 C CD1 . LEU A 1 333 ? -4.454 -14.859 16.421 1.00 11.22 ? 421 LEU A CD1 1 ATOM 2596 C CD2 . LEU A 1 333 ? -5.980 -16.206 17.885 1.00 13.16 ? 421 LEU A CD2 1 ATOM 2597 N N . GLU A 1 334 ? -4.174 -14.233 21.728 1.00 10.01 ? 422 GLU A N 1 ATOM 2598 C CA . GLU A 1 334 ? -3.416 -14.012 22.972 1.00 11.01 ? 422 GLU A CA 1 ATOM 2599 C C . GLU A 1 334 ? -2.301 -12.992 22.760 1.00 10.28 ? 422 GLU A C 1 ATOM 2600 O O . GLU A 1 334 ? -1.887 -12.297 23.707 1.00 10.66 ? 422 GLU A O 1 ATOM 2601 C CB . GLU A 1 334 ? -2.805 -15.359 23.433 1.00 12.18 ? 422 GLU A CB 1 ATOM 2602 C CG . GLU A 1 334 ? -3.732 -16.598 23.314 1.00 17.73 ? 422 GLU A CG 1 ATOM 2603 C CD . GLU A 1 334 ? -4.259 -16.973 21.883 1.00 20.94 ? 422 GLU A CD 1 ATOM 2604 O OE1 . GLU A 1 334 ? -3.477 -17.300 20.943 1.00 22.85 ? 422 GLU A OE1 1 ATOM 2605 O OE2 . GLU A 1 334 ? -5.509 -17.011 21.692 1.00 27.49 ? 422 GLU A OE2 1 ATOM 2606 N N . ASP A 1 335 ? -1.833 -12.899 21.514 1.00 8.27 ? 423 ASP A N 1 ATOM 2607 C CA . ASP A 1 335 ? -0.726 -12.010 21.143 1.00 9.07 ? 423 ASP A CA 1 ATOM 2608 C C . ASP A 1 335 ? -1.156 -10.739 20.428 1.00 9.42 ? 423 ASP A C 1 ATOM 2609 O O . ASP A 1 335 ? -0.343 -10.023 19.789 1.00 10.15 ? 423 ASP A O 1 ATOM 2610 C CB . ASP A 1 335 ? 0.345 -12.772 20.362 1.00 8.96 ? 423 ASP A CB 1 ATOM 2611 C CG . ASP A 1 335 ? -0.154 -13.347 19.077 1.00 11.70 ? 423 ASP A CG 1 ATOM 2612 O OD1 . ASP A 1 335 ? -1.308 -12.984 18.652 1.00 15.04 ? 423 ASP A OD1 1 ATOM 2613 O OD2 . ASP A 1 335 ? 0.523 -14.170 18.404 1.00 10.57 ? 423 ASP A OD2 1 ATOM 2614 N N . ALA A 1 336 ? -2.438 -10.434 20.527 1.00 8.76 ? 424 ALA A N 1 ATOM 2615 C CA . ALA A 1 336 ? -2.989 -9.190 20.013 1.00 8.70 ? 424 ALA A CA 1 ATOM 2616 C C . ALA A 1 336 ? -3.270 -8.324 21.235 1.00 9.04 ? 424 ALA A C 1 ATOM 2617 O O . ALA A 1 336 ? -3.888 -8.780 22.209 1.00 10.68 ? 424 ALA A O 1 ATOM 2618 C CB . ALA A 1 336 ? -4.290 -9.438 19.224 1.00 9.80 ? 424 ALA A CB 1 ATOM 2619 N N . LEU A 1 337 ? -2.815 -7.080 21.202 1.00 7.67 ? 425 LEU A N 1 ATOM 2620 C CA . LEU A 1 337 ? -3.084 -6.152 22.296 1.00 8.24 ? 425 LEU A CA 1 ATOM 2621 C C . LEU A 1 337 ? -4.539 -5.717 22.356 1.00 8.19 ? 425 LEU A C 1 ATOM 2622 O O . LEU A 1 337 ? -5.174 -5.458 21.342 1.00 8.20 ? 425 LEU A O 1 ATOM 2623 C CB . LEU A 1 337 ? -2.164 -4.936 22.215 1.00 7.67 ? 425 LEU A CB 1 ATOM 2624 C CG . LEU A 1 337 ? -1.976 -4.114 23.478 1.00 8.84 ? 425 LEU A CG 1 ATOM 2625 C CD1 . LEU A 1 337 ? -1.193 -4.894 24.557 1.00 11.21 ? 425 LEU A CD1 1 ATOM 2626 C CD2 . LEU A 1 337 ? -1.257 -2.776 23.110 1.00 8.47 ? 425 LEU A CD2 1 ATOM 2627 N N . LYS A 1 338 ? -5.073 -5.684 23.575 1.00 9.77 ? 426 LYS A N 1 ATOM 2628 C CA . LYS A 1 338 ? -6.501 -5.443 23.805 1.00 10.57 ? 426 LYS A CA 1 ATOM 2629 C C . LYS A 1 338 ? -6.681 -4.576 25.038 1.00 12.49 ? 426 LYS A C 1 ATOM 2630 O O . LYS A 1 338 ? -5.792 -4.568 25.917 1.00 12.50 ? 426 LYS A O 1 ATOM 2631 C CB . LYS A 1 338 ? -7.227 -6.770 24.063 1.00 11.88 ? 426 LYS A CB 1 ATOM 2632 C CG . LYS A 1 338 ? -6.979 -7.789 23.036 1.00 12.71 ? 426 LYS A CG 1 ATOM 2633 C CD . LYS A 1 338 ? -7.794 -9.040 23.317 1.00 15.43 ? 426 LYS A CD 1 ATOM 2634 C CE . LYS A 1 338 ? -7.065 -10.234 22.860 1.00 16.76 ? 426 LYS A CE 1 ATOM 2635 N NZ . LYS A 1 338 ? -5.736 -10.399 23.458 1.00 16.57 ? 426 LYS A NZ 1 ATOM 2636 N N . PRO A 1 339 ? -7.816 -3.889 25.162 1.00 12.22 ? 427 PRO A N 1 ATOM 2637 C CA . PRO A 1 339 ? -8.860 -3.821 24.139 1.00 12.82 ? 427 PRO A CA 1 ATOM 2638 C C . PRO A 1 339 ? -8.451 -2.885 23.035 1.00 11.23 ? 427 PRO A C 1 ATOM 2639 O O . PRO A 1 339 ? -7.819 -1.866 23.313 1.00 13.77 ? 427 PRO A O 1 ATOM 2640 C CB . PRO A 1 339 ? -10.059 -3.245 24.882 1.00 12.39 ? 427 PRO A CB 1 ATOM 2641 C CG . PRO A 1 339 ? -9.447 -2.497 26.010 1.00 14.33 ? 427 PRO A CG 1 ATOM 2642 C CD . PRO A 1 339 ? -8.214 -3.208 26.407 1.00 13.60 ? 427 PRO A CD 1 ATOM 2643 N N . ALA A 1 340 ? -8.851 -3.224 21.811 1.00 9.19 ? 428 ALA A N 1 ATOM 2644 C CA . ALA A 1 340 ? -8.473 -2.494 20.615 1.00 8.45 ? 428 ALA A CA 1 ATOM 2645 C C . ALA A 1 340 ? -9.710 -1.915 19.937 1.00 8.05 ? 428 ALA A C 1 ATOM 2646 O O . ALA A 1 340 ? -10.756 -2.591 19.868 1.00 7.74 ? 428 ALA A O 1 ATOM 2647 C CB . ALA A 1 340 ? -7.736 -3.422 19.660 1.00 7.63 ? 428 ALA A CB 1 ATOM 2648 N N . PRO A 1 341 ? -9.625 -0.666 19.481 1.00 7.59 ? 429 PRO A N 1 ATOM 2649 C CA . PRO A 1 341 ? -10.760 -0.022 18.814 1.00 7.76 ? 429 PRO A CA 1 ATOM 2650 C C . PRO A 1 341 ? -10.877 -0.469 17.327 1.00 7.86 ? 429 PRO A C 1 ATOM 2651 O O . PRO A 1 341 ? -10.169 -1.343 16.873 1.00 8.22 ? 429 PRO A O 1 ATOM 2652 C CB . PRO A 1 341 ? -10.376 1.439 18.904 1.00 6.84 ? 429 PRO A CB 1 ATOM 2653 C CG . PRO A 1 341 ? -8.916 1.400 18.719 1.00 7.52 ? 429 PRO A CG 1 ATOM 2654 C CD . PRO A 1 341 ? -8.459 0.240 19.527 1.00 9.28 ? 429 PRO A CD 1 ATOM 2655 N N . GLU A 1 342 ? -11.758 0.151 16.559 1.00 9.84 ? 430 GLU A N 1 ATOM 2656 C CA . GLU A 1 342 ? -11.891 -0.197 15.158 1.00 8.75 ? 430 GLU A CA 1 ATOM 2657 C C . GLU A 1 342 ? -10.600 0.019 14.400 1.00 8.38 ? 430 GLU A C 1 ATOM 2658 O O . GLU A 1 342 ? -9.833 0.887 14.740 1.00 7.68 ? 430 GLU A O 1 ATOM 2659 C CB . GLU A 1 342 ? -12.982 0.630 14.520 1.00 10.09 ? 430 GLU A CB 1 ATOM 2660 C CG . GLU A 1 342 ? -14.377 0.169 14.930 1.00 9.14 ? 430 GLU A CG 1 ATOM 2661 C CD . GLU A 1 342 ? -14.795 -1.167 14.311 1.00 11.43 ? 430 GLU A CD 1 ATOM 2662 O OE1 . GLU A 1 342 ? -14.213 -1.550 13.279 1.00 13.04 ? 430 GLU A OE1 1 ATOM 2663 O OE2 . GLU A 1 342 ? -15.708 -1.809 14.857 1.00 11.03 ? 430 GLU A OE2 1 ATOM 2664 N N . ALA A 1 343 ? -10.411 -0.742 13.331 1.00 7.98 ? 431 ALA A N 1 ATOM 2665 C CA . ALA A 1 343 ? -9.286 -0.528 12.433 1.00 7.33 ? 431 ALA A CA 1 ATOM 2666 C C . ALA A 1 343 ? -9.235 0.923 11.984 1.00 8.16 ? 431 ALA A C 1 ATOM 2667 O O . ALA A 1 343 ? -10.224 1.520 11.591 1.00 8.17 ? 431 ALA A O 1 ATOM 2668 C CB . ALA A 1 343 ? -9.326 -1.469 11.263 1.00 8.19 ? 431 ALA A CB 1 ATOM 2669 N N . GLY A 1 344 ? -8.043 1.482 12.063 1.00 6.79 ? 432 GLY A N 1 ATOM 2670 C CA . GLY A 1 344 ? -7.745 2.844 11.691 1.00 7.36 ? 432 GLY A CA 1 ATOM 2671 C C . GLY A 1 344 ? -7.893 3.834 12.840 1.00 8.36 ? 432 GLY A C 1 ATOM 2672 O O . GLY A 1 344 ? -7.393 4.953 12.755 1.00 8.86 ? 432 GLY A O 1 ATOM 2673 N N . GLN A 1 345 ? -8.613 3.467 13.890 1.00 8.20 ? 433 GLN A N 1 ATOM 2674 C CA . GLN A 1 345 ? -8.824 4.377 14.995 1.00 9.05 ? 433 GLN A CA 1 ATOM 2675 C C . GLN A 1 345 ? -7.554 4.327 15.870 1.00 8.34 ? 433 GLN A C 1 ATOM 2676 O O . GLN A 1 345 ? -6.833 3.353 15.869 1.00 7.00 ? 433 GLN A O 1 ATOM 2677 C CB . GLN A 1 345 ? -10.051 4.025 15.826 1.00 8.90 ? 433 GLN A CB 1 ATOM 2678 C CG . GLN A 1 345 ? -11.397 4.177 15.122 1.00 12.21 ? 433 GLN A CG 1 ATOM 2679 C CD . GLN A 1 345 ? -11.668 5.595 14.682 1.00 14.49 ? 433 GLN A CD 1 ATOM 2680 O OE1 . GLN A 1 345 ? -11.574 6.520 15.493 1.00 16.17 ? 433 GLN A OE1 1 ATOM 2681 N NE2 . GLN A 1 345 ? -11.940 5.787 13.400 1.00 14.45 ? 433 GLN A NE2 1 ATOM 2682 N N . TRP A 1 346 ? -7.344 5.404 16.606 1.00 8.37 ? 434 TRP A N 1 ATOM 2683 C CA . TRP A 1 346 ? -6.209 5.496 17.498 1.00 8.46 ? 434 TRP A CA 1 ATOM 2684 C C . TRP A 1 346 ? -6.277 4.492 18.641 1.00 7.86 ? 434 TRP A C 1 ATOM 2685 O O . TRP A 1 346 ? -7.270 4.418 19.385 1.00 7.93 ? 434 TRP A O 1 ATOM 2686 C CB . TRP A 1 346 ? -6.103 6.909 18.076 1.00 8.02 ? 434 TRP A CB 1 ATOM 2687 C CG . TRP A 1 346 ? -4.716 7.183 18.587 1.00 7.83 ? 434 TRP A CG 1 ATOM 2688 C CD1 . TRP A 1 346 ? -4.331 7.253 19.898 1.00 9.96 ? 434 TRP A CD1 1 ATOM 2689 C CD2 . TRP A 1 346 ? -3.507 7.273 17.820 1.00 7.10 ? 434 TRP A CD2 1 ATOM 2690 N NE1 . TRP A 1 346 ? -2.984 7.522 19.981 1.00 7.74 ? 434 TRP A NE1 1 ATOM 2691 C CE2 . TRP A 1 346 ? -2.444 7.489 18.731 1.00 5.30 ? 434 TRP A CE2 1 ATOM 2692 C CE3 . TRP A 1 346 ? -3.213 7.259 16.454 1.00 8.72 ? 434 TRP A CE3 1 ATOM 2693 C CZ2 . TRP A 1 346 ? -1.142 7.685 18.306 1.00 6.54 ? 434 TRP A CZ2 1 ATOM 2694 C CZ3 . TRP A 1 346 ? -1.927 7.439 16.040 1.00 9.27 ? 434 TRP A CZ3 1 ATOM 2695 C CH2 . TRP A 1 346 ? -0.886 7.645 16.973 1.00 8.24 ? 434 TRP A CH2 1 ATOM 2696 N N . PHE A 1 347 ? -5.174 3.786 18.821 1.00 6.09 ? 435 PHE A N 1 ATOM 2697 C CA . PHE A 1 347 ? -4.989 2.768 19.840 1.00 6.79 ? 435 PHE A CA 1 ATOM 2698 C C . PHE A 1 347 ? -3.813 3.204 20.711 1.00 6.41 ? 435 PHE A C 1 ATOM 2699 O O . PHE A 1 347 ? -2.659 2.819 20.504 1.00 6.21 ? 435 PHE A O 1 ATOM 2700 C CB . PHE A 1 347 ? -4.706 1.409 19.137 1.00 7.89 ? 435 PHE A CB 1 ATOM 2701 C CG . PHE A 1 347 ? -4.748 0.226 20.020 1.00 8.42 ? 435 PHE A CG 1 ATOM 2702 C CD1 . PHE A 1 347 ? -4.944 0.350 21.387 1.00 5.85 ? 435 PHE A CD1 1 ATOM 2703 C CD2 . PHE A 1 347 ? -4.578 -1.056 19.478 1.00 11.01 ? 435 PHE A CD2 1 ATOM 2704 C CE1 . PHE A 1 347 ? -4.980 -0.728 22.206 1.00 8.02 ? 435 PHE A CE1 1 ATOM 2705 C CE2 . PHE A 1 347 ? -4.606 -2.173 20.298 1.00 11.14 ? 435 PHE A CE2 1 ATOM 2706 C CZ . PHE A 1 347 ? -4.789 -2.032 21.674 1.00 8.67 ? 435 PHE A CZ 1 ATOM 2707 N N . ASN A 1 348 ? -4.106 4.004 21.708 1.00 6.31 ? 436 ASN A N 1 ATOM 2708 C CA . ASN A 1 348 ? -3.039 4.628 22.452 1.00 6.28 ? 436 ASN A CA 1 ATOM 2709 C C . ASN A 1 348 ? -2.082 3.662 23.170 1.00 6.24 ? 436 ASN A C 1 ATOM 2710 O O . ASN A 1 348 ? -0.872 3.877 23.187 1.00 5.83 ? 436 ASN A O 1 ATOM 2711 C CB . ASN A 1 348 ? -3.554 5.668 23.413 1.00 7.45 ? 436 ASN A CB 1 ATOM 2712 C CG . ASN A 1 348 ? -2.469 6.697 23.736 1.00 7.67 ? 436 ASN A CG 1 ATOM 2713 O OD1 . ASN A 1 348 ? -1.890 7.303 22.825 1.00 9.92 ? 436 ASN A OD1 1 ATOM 2714 N ND2 . ASN A 1 348 ? -2.179 6.874 25.022 1.00 8.46 ? 436 ASN A ND2 1 ATOM 2715 N N . GLU A 1 349 ? -2.597 2.592 23.764 1.00 5.68 ? 437 GLU A N 1 ATOM 2716 C CA . GLU A 1 349 ? -1.714 1.668 24.436 1.00 6.69 ? 437 GLU A CA 1 ATOM 2717 C C . GLU A 1 349 ? -0.747 1.023 23.439 1.00 6.74 ? 437 GLU A C 1 ATOM 2718 O O . GLU A 1 349 ? 0.385 0.670 23.791 1.00 5.00 ? 437 GLU A O 1 ATOM 2719 C CB . GLU A 1 349 ? -2.515 0.637 25.223 1.00 8.66 ? 437 GLU A CB 1 ATOM 2720 C CG . GLU A 1 349 ? -3.048 1.193 26.547 1.00 12.68 ? 437 GLU A CG 1 ATOM 2721 C CD . GLU A 1 349 ? -1.972 1.752 27.544 1.00 18.56 ? 437 GLU A CD 1 ATOM 2722 O OE1 . GLU A 1 349 ? -0.910 1.134 27.805 1.00 22.54 ? 437 GLU A OE1 1 ATOM 2723 O OE2 . GLU A 1 349 ? -2.210 2.821 28.145 1.00 22.84 ? 437 GLU A OE2 1 ATOM 2724 N N . TYR A 1 350 ? -1.218 0.846 22.206 1.00 6.70 ? 438 TYR A N 1 ATOM 2725 C CA . TYR A 1 350 ? -0.356 0.284 21.143 1.00 6.97 ? 438 TYR A CA 1 ATOM 2726 C C . TYR A 1 350 ? 0.729 1.241 20.753 1.00 6.40 ? 438 TYR A C 1 ATOM 2727 O O . TYR A 1 350 ? 1.913 0.871 20.587 1.00 6.27 ? 438 TYR A O 1 ATOM 2728 C CB . TYR A 1 350 ? -1.168 -0.160 19.940 1.00 7.06 ? 438 TYR A CB 1 ATOM 2729 C CG . TYR A 1 350 ? -0.398 -1.180 19.136 1.00 8.91 ? 438 TYR A CG 1 ATOM 2730 C CD1 . TYR A 1 350 ? -0.469 -2.540 19.438 1.00 8.73 ? 438 TYR A CD1 1 ATOM 2731 C CD2 . TYR A 1 350 ? 0.450 -0.780 18.095 1.00 8.66 ? 438 TYR A CD2 1 ATOM 2732 C CE1 . TYR A 1 350 ? 0.259 -3.473 18.705 1.00 6.41 ? 438 TYR A CE1 1 ATOM 2733 C CE2 . TYR A 1 350 ? 1.188 -1.698 17.374 1.00 9.12 ? 438 TYR A CE2 1 ATOM 2734 C CZ . TYR A 1 350 ? 1.086 -3.053 17.665 1.00 7.34 ? 438 TYR A CZ 1 ATOM 2735 O OH . TYR A 1 350 ? 1.872 -3.953 16.953 1.00 9.36 ? 438 TYR A OH 1 ATOM 2736 N N . PHE A 1 351 ? 0.343 2.489 20.623 1.00 5.86 ? 439 PHE A N 1 ATOM 2737 C CA . PHE A 1 351 ? 1.295 3.559 20.309 1.00 5.80 ? 439 PHE A CA 1 ATOM 2738 C C . PHE A 1 351 ? 2.410 3.589 21.368 1.00 5.29 ? 439 PHE A C 1 ATOM 2739 O O . PHE A 1 351 ? 3.576 3.689 21.047 1.00 6.04 ? 439 PHE A O 1 ATOM 2740 C CB . PHE A 1 351 ? 0.546 4.889 20.299 1.00 5.20 ? 439 PHE A CB 1 ATOM 2741 C CG . PHE A 1 351 ? 1.388 6.071 20.029 1.00 6.19 ? 439 PHE A CG 1 ATOM 2742 C CD1 . PHE A 1 351 ? 1.975 6.273 18.805 1.00 4.48 ? 439 PHE A CD1 1 ATOM 2743 C CD2 . PHE A 1 351 ? 1.558 7.041 21.018 1.00 4.63 ? 439 PHE A CD2 1 ATOM 2744 C CE1 . PHE A 1 351 ? 2.758 7.417 18.560 1.00 5.34 ? 439 PHE A CE1 1 ATOM 2745 C CE2 . PHE A 1 351 ? 2.362 8.153 20.775 1.00 6.22 ? 439 PHE A CE2 1 ATOM 2746 C CZ . PHE A 1 351 ? 2.926 8.351 19.538 1.00 6.79 ? 439 PHE A CZ 1 ATOM 2747 N N . ILE A 1 352 ? 2.016 3.538 22.637 1.00 5.69 ? 440 ILE A N 1 ATOM 2748 C CA . ILE A 1 352 ? 3.002 3.490 23.738 1.00 5.83 ? 440 ILE A CA 1 ATOM 2749 C C . ILE A 1 352 ? 3.944 2.283 23.656 1.00 6.69 ? 440 ILE A C 1 ATOM 2750 O O . ILE A 1 352 ? 5.159 2.412 23.805 1.00 4.70 ? 440 ILE A O 1 ATOM 2751 C CB . ILE A 1 352 ? 2.286 3.563 25.069 1.00 6.77 ? 440 ILE A CB 1 ATOM 2752 C CG1 . ILE A 1 352 ? 1.680 4.951 25.287 1.00 7.95 ? 440 ILE A CG1 1 ATOM 2753 C CG2 . ILE A 1 352 ? 3.245 3.203 26.222 1.00 8.59 ? 440 ILE A CG2 1 ATOM 2754 C CD1 . ILE A 1 352 ? 0.589 4.968 26.288 1.00 12.98 ? 440 ILE A CD1 1 ATOM 2755 N N . GLN A 1 353 ? 3.402 1.100 23.382 1.00 7.25 ? 441 GLN A N 1 ATOM 2756 C CA . GLN A 1 353 ? 4.240 -0.070 23.130 1.00 7.09 ? 441 GLN A CA 1 ATOM 2757 C C . GLN A 1 353 ? 5.262 0.183 22.056 1.00 6.72 ? 441 GLN A C 1 ATOM 2758 O O . GLN A 1 353 ? 6.433 -0.142 22.220 1.00 5.90 ? 441 GLN A O 1 ATOM 2759 C CB . GLN A 1 353 ? 3.363 -1.262 22.708 1.00 8.05 ? 441 GLN A CB 1 ATOM 2760 C CG . GLN A 1 353 ? 4.164 -2.502 22.270 1.00 8.77 ? 441 GLN A CG 1 ATOM 2761 C CD . GLN A 1 353 ? 3.242 -3.549 21.705 1.00 6.65 ? 441 GLN A CD 1 ATOM 2762 O OE1 . GLN A 1 353 ? 2.417 -4.131 22.443 1.00 8.41 ? 441 GLN A OE1 1 ATOM 2763 N NE2 . GLN A 1 353 ? 3.341 -3.789 20.420 1.00 9.10 ? 441 GLN A NE2 1 ATOM 2764 N N . LEU A 1 354 ? 4.829 0.720 20.917 1.00 6.94 ? 442 LEU A N 1 ATOM 2765 C CA . LEU A 1 354 ? 5.736 1.042 19.822 1.00 5.61 ? 442 LEU A CA 1 ATOM 2766 C C . LEU A 1 354 ? 6.827 2.033 20.202 1.00 6.10 ? 442 LEU A C 1 ATOM 2767 O O . LEU A 1 354 ? 7.956 1.875 19.787 1.00 5.99 ? 442 LEU A O 1 ATOM 2768 C CB . LEU A 1 354 ? 4.968 1.568 18.589 1.00 5.62 ? 442 LEU A CB 1 ATOM 2769 C CG . LEU A 1 354 ? 4.015 0.608 17.876 1.00 5.02 ? 442 LEU A CG 1 ATOM 2770 C CD1 . LEU A 1 354 ? 3.212 1.361 16.875 1.00 6.12 ? 442 LEU A CD1 1 ATOM 2771 C CD2 . LEU A 1 354 ? 4.785 -0.482 17.193 1.00 6.24 ? 442 LEU A CD2 1 ATOM 2772 N N . LEU A 1 355 ? 6.488 3.021 21.029 1.00 6.24 ? 443 LEU A N 1 ATOM 2773 C CA . LEU A 1 355 ? 7.488 3.972 21.520 1.00 7.64 ? 443 LEU A CA 1 ATOM 2774 C C . LEU A 1 355 ? 8.492 3.288 22.430 1.00 7.23 ? 443 LEU A C 1 ATOM 2775 O O . LEU A 1 355 ? 9.719 3.462 22.313 1.00 6.98 ? 443 LEU A O 1 ATOM 2776 C CB . LEU A 1 355 ? 6.813 5.130 22.248 1.00 7.94 ? 443 LEU A CB 1 ATOM 2777 C CG . LEU A 1 355 ? 6.136 6.221 21.461 1.00 10.70 ? 443 LEU A CG 1 ATOM 2778 C CD1 . LEU A 1 355 ? 5.454 7.161 22.478 1.00 11.69 ? 443 LEU A CD1 1 ATOM 2779 C CD2 . LEU A 1 355 ? 7.106 6.956 20.563 1.00 11.28 ? 443 LEU A CD2 1 ATOM 2780 N N . ARG A 1 356 ? 7.996 2.482 23.359 1.00 8.40 ? 444 ARG A N 1 ATOM 2781 C CA . ARG A 1 356 ? 8.866 1.768 24.295 1.00 7.76 ? 444 ARG A CA 1 ATOM 2782 C C . ARG A 1 356 ? 9.880 0.887 23.596 1.00 8.31 ? 444 ARG A C 1 ATOM 2783 O O . ARG A 1 356 ? 11.034 0.807 24.014 1.00 8.70 ? 444 ARG A O 1 ATOM 2784 C CB . ARG A 1 356 ? 8.037 0.906 25.259 1.00 9.16 ? 444 ARG A CB 1 ATOM 2785 C CG . ARG A 1 356 ? 7.307 1.679 26.298 1.00 11.07 ? 444 ARG A CG 1 ATOM 2786 C CD . ARG A 1 356 ? 8.255 2.236 27.311 1.00 15.47 ? 444 ARG A CD 1 ATOM 2787 N NE . ARG A 1 356 ? 7.600 2.624 28.558 1.00 17.70 ? 444 ARG A NE 1 ATOM 2788 C CZ . ARG A 1 356 ? 8.074 3.552 29.375 1.00 15.64 ? 444 ARG A CZ 1 ATOM 2789 N NH1 . ARG A 1 356 ? 9.198 4.198 29.087 1.00 17.26 ? 444 ARG A NH1 1 ATOM 2790 N NH2 . ARG A 1 356 ? 7.421 3.836 30.480 1.00 15.11 ? 444 ARG A NH2 1 ATOM 2791 N N . ASN A 1 357 ? 9.453 0.241 22.530 1.00 7.84 ? 445 ASN A N 1 ATOM 2792 C CA . ASN A 1 357 ? 10.250 -0.763 21.819 1.00 7.97 ? 445 ASN A CA 1 ATOM 2793 C C . ASN A 1 357 ? 10.938 -0.182 20.582 1.00 8.01 ? 445 ASN A C 1 ATOM 2794 O O . ASN A 1 357 ? 11.557 -0.913 19.808 1.00 8.18 ? 445 ASN A O 1 ATOM 2795 C CB . ASN A 1 357 ? 9.343 -1.919 21.438 1.00 8.34 ? 445 ASN A CB 1 ATOM 2796 C CG . ASN A 1 357 ? 8.849 -2.719 22.620 1.00 9.43 ? 445 ASN A CG 1 ATOM 2797 O OD1 . ASN A 1 357 ? 9.540 -2.824 23.661 1.00 11.02 ? 445 ASN A OD1 1 ATOM 2798 N ND2 . ASN A 1 357 ? 7.669 -3.347 22.476 1.00 8.54 ? 445 ASN A ND2 1 ATOM 2799 N N . ALA A 1 358 ? 10.873 1.134 20.416 1.00 7.99 ? 446 ALA A N 1 ATOM 2800 C CA . ALA A 1 358 ? 11.400 1.766 19.213 1.00 6.89 ? 446 ALA A CA 1 ATOM 2801 C C . ALA A 1 358 ? 12.896 1.494 19.058 1.00 7.00 ? 446 ALA A C 1 ATOM 2802 O O . ALA A 1 358 ? 13.659 1.574 20.028 1.00 7.75 ? 446 ALA A O 1 ATOM 2803 C CB . ALA A 1 358 ? 11.157 3.223 19.225 1.00 8.49 ? 446 ALA A CB 1 ATOM 2804 N N . ASN A 1 359 ? 13.309 1.130 17.856 1.00 7.08 ? 447 ASN A N 1 ATOM 2805 C CA . ASN A 1 359 ? 14.724 0.931 17.529 1.00 8.31 ? 447 ASN A CA 1 ATOM 2806 C C . ASN A 1 359 ? 14.937 1.355 16.083 1.00 9.80 ? 447 ASN A C 1 ATOM 2807 O O . ASN A 1 359 ? 14.394 0.706 15.187 1.00 9.73 ? 447 ASN A O 1 ATOM 2808 C CB . ASN A 1 359 ? 15.101 -0.550 17.711 1.00 9.25 ? 447 ASN A CB 1 ATOM 2809 C CG . ASN A 1 359 ? 16.551 -0.820 17.436 1.00 13.26 ? 447 ASN A CG 1 ATOM 2810 O OD1 . ASN A 1 359 ? 17.341 0.092 17.331 1.00 16.20 ? 447 ASN A OD1 1 ATOM 2811 N ND2 . ASN A 1 359 ? 16.918 -2.086 17.372 1.00 20.52 ? 447 ASN A ND2 1 ATOM 2812 N N . PRO A 1 360 ? 15.692 2.421 15.829 1.00 11.04 ? 448 PRO A N 1 ATOM 2813 C CA . PRO A 1 360 ? 16.342 3.234 16.864 1.00 11.66 ? 448 PRO A CA 1 ATOM 2814 C C . PRO A 1 360 ? 15.330 3.956 17.770 1.00 10.94 ? 448 PRO A C 1 ATOM 2815 O O . PRO A 1 360 ? 14.201 4.298 17.378 1.00 9.66 ? 448 PRO A O 1 ATOM 2816 C CB . PRO A 1 360 ? 17.210 4.232 16.069 1.00 12.21 ? 448 PRO A CB 1 ATOM 2817 C CG . PRO A 1 360 ? 16.613 4.246 14.718 1.00 13.61 ? 448 PRO A CG 1 ATOM 2818 C CD . PRO A 1 360 ? 15.991 2.892 14.461 1.00 12.58 ? 448 PRO A CD 1 ATOM 2819 N N . PRO A 1 361 ? 15.746 4.195 18.989 1.00 11.62 ? 449 PRO A N 1 ATOM 2820 C CA . PRO A 1 361 ? 14.876 4.838 19.976 1.00 11.15 ? 449 PRO A CA 1 ATOM 2821 C C . PRO A 1 361 ? 14.668 6.328 19.687 1.00 11.88 ? 449 PRO A C 1 ATOM 2822 O O . PRO A 1 361 ? 15.415 6.932 18.925 1.00 11.72 ? 449 PRO A O 1 ATOM 2823 C CB . PRO A 1 361 ? 15.657 4.672 21.280 1.00 11.49 ? 449 PRO A CB 1 ATOM 2824 C CG . PRO A 1 361 ? 17.131 4.601 20.836 1.00 12.20 ? 449 PRO A CG 1 ATOM 2825 C CD . PRO A 1 361 ? 17.103 3.915 19.515 1.00 11.75 ? 449 PRO A CD 1 ATOM 2826 N N . PHE A 1 362 ? 13.609 6.879 20.282 1.00 13.03 ? 450 PHE A N 1 ATOM 2827 C CA . PHE A 1 362 ? 13.282 8.293 20.162 1.00 14.49 ? 450 PHE A CA 1 ATOM 2828 C C . PHE A 1 362 ? 13.868 9.091 21.301 1.00 16.96 ? 450 PHE A C 1 ATOM 2829 O O . PHE A 1 362 ? 14.090 10.315 21.264 1.00 19.61 ? 450 PHE A O 1 ATOM 2830 C CB . PHE A 1 362 ? 11.774 8.443 20.054 1.00 13.66 ? 450 PHE A CB 1 ATOM 2831 C CG . PHE A 1 362 ? 11.294 8.172 18.705 1.00 13.10 ? 450 PHE A CG 1 ATOM 2832 C CD1 . PHE A 1 362 ? 11.440 9.130 17.701 1.00 12.45 ? 450 PHE A CD1 1 ATOM 2833 C CD2 . PHE A 1 362 ? 10.758 6.923 18.370 1.00 12.57 ? 450 PHE A CD2 1 ATOM 2834 C CE1 . PHE A 1 362 ? 11.020 8.868 16.435 1.00 11.24 ? 450 PHE A CE1 1 ATOM 2835 C CE2 . PHE A 1 362 ? 10.362 6.658 17.112 1.00 11.02 ? 450 PHE A CE2 1 ATOM 2836 C CZ . PHE A 1 362 ? 10.456 7.638 16.124 1.00 12.69 ? 450 PHE A CZ 1 ATOM 2837 O OXT . PHE A 1 362 ? 14.300 8.512 22.299 1.00 19.96 ? 450 PHE A OXT 1 ATOM 2838 N N . ASN B 1 2 ? -41.531 33.331 -2.306 1.00 25.39 ? 90 ASN B N 1 ATOM 2839 C CA . ASN B 1 2 ? -40.369 33.467 -1.420 1.00 21.97 ? 90 ASN B CA 1 ATOM 2840 C C . ASN B 1 2 ? -39.113 32.752 -1.962 1.00 21.34 ? 90 ASN B C 1 ATOM 2841 O O . ASN B 1 2 ? -37.933 33.159 -1.690 1.00 22.51 ? 90 ASN B O 1 ATOM 2842 C CB . ASN B 1 2 ? -40.744 32.944 -0.018 1.00 22.84 ? 90 ASN B CB 1 ATOM 2843 C CG . ASN B 1 2 ? -39.633 33.086 0.984 1.00 22.77 ? 90 ASN B CG 1 ATOM 2844 O OD1 . ASN B 1 2 ? -39.349 34.208 1.509 1.00 26.68 ? 90 ASN B OD1 1 ATOM 2845 N ND2 . ASN B 1 2 ? -38.970 31.955 1.300 1.00 25.44 ? 90 ASN B ND2 1 ATOM 2846 N N . GLY B 1 3 ? -39.325 31.683 -2.727 1.00 17.30 ? 91 GLY B N 1 ATOM 2847 C CA . GLY B 1 3 ? -38.207 30.911 -3.182 1.00 14.73 ? 91 GLY B CA 1 ATOM 2848 C C . GLY B 1 3 ? -37.562 31.509 -4.408 1.00 11.27 ? 91 GLY B C 1 ATOM 2849 O O . GLY B 1 3 ? -38.212 31.794 -5.400 1.00 11.17 ? 91 GLY B O 1 ATOM 2850 N N . ASN B 1 4 ? -36.239 31.645 -4.345 1.00 10.44 ? 92 ASN B N 1 ATOM 2851 C CA . ASN B 1 4 ? -35.439 31.896 -5.547 1.00 9.10 ? 92 ASN B CA 1 ATOM 2852 C C . ASN B 1 4 ? -35.545 30.737 -6.536 1.00 9.26 ? 92 ASN B C 1 ATOM 2853 O O . ASN B 1 4 ? -35.099 29.633 -6.257 1.00 7.95 ? 92 ASN B O 1 ATOM 2854 C CB . ASN B 1 4 ? -33.995 32.100 -5.141 1.00 8.90 ? 92 ASN B CB 1 ATOM 2855 C CG . ASN B 1 4 ? -33.106 32.395 -6.300 1.00 7.51 ? 92 ASN B CG 1 ATOM 2856 O OD1 . ASN B 1 4 ? -33.516 32.286 -7.448 1.00 6.31 ? 92 ASN B OD1 1 ATOM 2857 N ND2 . ASN B 1 4 ? -31.841 32.787 -5.998 1.00 7.60 ? 92 ASN B ND2 1 ATOM 2858 N N . PRO B 1 5 ? -36.115 30.968 -7.720 1.00 9.12 ? 93 PRO B N 1 ATOM 2859 C CA . PRO B 1 5 ? -36.339 29.842 -8.636 1.00 10.03 ? 93 PRO B CA 1 ATOM 2860 C C . PRO B 1 5 ? -35.060 29.259 -9.230 1.00 9.07 ? 93 PRO B C 1 ATOM 2861 O O . PRO B 1 5 ? -35.148 28.210 -9.864 1.00 9.04 ? 93 PRO B O 1 ATOM 2862 C CB . PRO B 1 5 ? -37.214 30.439 -9.732 1.00 11.06 ? 93 PRO B CB 1 ATOM 2863 C CG . PRO B 1 5 ? -36.953 31.849 -9.686 1.00 11.73 ? 93 PRO B CG 1 ATOM 2864 C CD . PRO B 1 5 ? -36.574 32.234 -8.283 1.00 10.03 ? 93 PRO B CD 1 ATOM 2865 N N . PHE B 1 6 ? -33.927 29.942 -9.077 1.00 7.90 ? 94 PHE B N 1 ATOM 2866 C CA . PHE B 1 6 ? -32.620 29.418 -9.504 1.00 7.59 ? 94 PHE B CA 1 ATOM 2867 C C . PHE B 1 6 ? -31.875 28.573 -8.446 1.00 7.84 ? 94 PHE B C 1 ATOM 2868 O O . PHE B 1 6 ? -30.815 28.000 -8.731 1.00 7.56 ? 94 PHE B O 1 ATOM 2869 C CB . PHE B 1 6 ? -31.740 30.594 -9.944 1.00 7.11 ? 94 PHE B CB 1 ATOM 2870 C CG . PHE B 1 6 ? -32.236 31.281 -11.165 1.00 6.25 ? 94 PHE B CG 1 ATOM 2871 C CD1 . PHE B 1 6 ? -33.143 32.300 -11.087 1.00 6.78 ? 94 PHE B CD1 1 ATOM 2872 C CD2 . PHE B 1 6 ? -31.749 30.920 -12.432 1.00 8.82 ? 94 PHE B CD2 1 ATOM 2873 C CE1 . PHE B 1 6 ? -33.620 32.888 -12.238 1.00 7.29 ? 94 PHE B CE1 1 ATOM 2874 C CE2 . PHE B 1 6 ? -32.205 31.509 -13.584 1.00 8.04 ? 94 PHE B CE2 1 ATOM 2875 C CZ . PHE B 1 6 ? -33.127 32.515 -13.493 1.00 8.49 ? 94 PHE B CZ 1 ATOM 2876 N N . GLU B 1 7 ? -32.415 28.518 -7.243 1.00 7.86 ? 95 GLU B N 1 ATOM 2877 C CA . GLU B 1 7 ? -31.864 27.699 -6.172 1.00 9.30 ? 95 GLU B CA 1 ATOM 2878 C C . GLU B 1 7 ? -32.476 26.305 -6.228 1.00 8.81 ? 95 GLU B C 1 ATOM 2879 O O . GLU B 1 7 ? -33.681 26.180 -6.449 1.00 9.49 ? 95 GLU B O 1 ATOM 2880 C CB . GLU B 1 7 ? -32.136 28.336 -4.805 1.00 10.77 ? 95 GLU B CB 1 ATOM 2881 C CG . GLU B 1 7 ? -31.242 29.550 -4.528 1.00 15.69 ? 95 GLU B CG 1 ATOM 2882 C CD . GLU B 1 7 ? -29.816 29.154 -4.118 1.00 23.97 ? 95 GLU B CD 1 ATOM 2883 O OE1 . GLU B 1 7 ? -29.582 27.948 -3.814 1.00 28.70 ? 95 GLU B OE1 1 ATOM 2884 O OE2 . GLU B 1 7 ? -28.932 30.053 -4.059 1.00 28.80 ? 95 GLU B OE2 1 ATOM 2885 N N . GLY B 1 8 ? -31.656 25.270 -6.049 1.00 8.37 ? 96 GLY B N 1 ATOM 2886 C CA . GLY B 1 8 ? -32.145 23.905 -6.008 1.00 8.95 ? 96 GLY B CA 1 ATOM 2887 C C . GLY B 1 8 ? -32.449 23.232 -7.338 1.00 9.61 ? 96 GLY B C 1 ATOM 2888 O O . GLY B 1 8 ? -33.162 22.207 -7.392 1.00 10.47 ? 96 GLY B O 1 ATOM 2889 N N . VAL B 1 9 ? -31.957 23.842 -8.407 1.00 9.28 ? 97 VAL B N 1 ATOM 2890 C CA . VAL B 1 9 ? -32.072 23.314 -9.767 1.00 9.72 ? 97 VAL B CA 1 ATOM 2891 C C . VAL B 1 9 ? -30.772 23.479 -10.529 1.00 10.10 ? 97 VAL B C 1 ATOM 2892 O O . VAL B 1 9 ? -29.934 24.287 -10.178 1.00 11.24 ? 97 VAL B O 1 ATOM 2893 C CB . VAL B 1 9 ? -33.207 24.000 -10.562 1.00 9.96 ? 97 VAL B CB 1 ATOM 2894 C CG1 . VAL B 1 9 ? -34.582 23.717 -9.927 1.00 12.11 ? 97 VAL B CG1 1 ATOM 2895 C CG2 . VAL B 1 9 ? -32.969 25.491 -10.719 1.00 10.94 ? 97 VAL B CG2 1 ATOM 2896 N N . GLN B 1 10 ? -30.579 22.643 -11.537 1.00 9.84 ? 98 GLN B N 1 ATOM 2897 C CA . GLN B 1 10 ? -29.558 22.897 -12.568 1.00 9.44 ? 98 GLN B CA 1 ATOM 2898 C C . GLN B 1 10 ? -30.285 23.534 -13.759 1.00 8.68 ? 98 GLN B C 1 ATOM 2899 O O . GLN B 1 10 ? -31.486 23.266 -14.020 1.00 9.75 ? 98 GLN B O 1 ATOM 2900 C CB . GLN B 1 10 ? -28.930 21.597 -13.074 1.00 10.18 ? 98 GLN B CB 1 ATOM 2901 C CG . GLN B 1 10 ? -28.418 20.663 -12.118 1.00 13.06 ? 98 GLN B CG 1 ATOM 2902 C CD . GLN B 1 10 ? -27.810 19.429 -12.814 1.00 14.48 ? 98 GLN B CD 1 ATOM 2903 O OE1 . GLN B 1 10 ? -26.812 19.548 -13.548 1.00 15.67 ? 98 GLN B OE1 1 ATOM 2904 N NE2 . GLN B 1 10 ? -28.412 18.262 -12.593 1.00 14.28 ? 98 GLN B NE2 1 ATOM 2905 N N . LEU B 1 11 ? -29.592 24.395 -14.481 1.00 8.02 ? 99 LEU B N 1 ATOM 2906 C CA . LEU B 1 11 ? -30.220 25.051 -15.639 1.00 7.04 ? 99 LEU B CA 1 ATOM 2907 C C . LEU B 1 11 ? -29.959 24.259 -16.911 1.00 6.48 ? 99 LEU B C 1 ATOM 2908 O O . LEU B 1 11 ? -28.825 24.003 -17.255 1.00 7.97 ? 99 LEU B O 1 ATOM 2909 C CB . LEU B 1 11 ? -29.667 26.456 -15.783 1.00 6.81 ? 99 LEU B CB 1 ATOM 2910 C CG . LEU B 1 11 ? -29.968 27.349 -14.579 1.00 8.79 ? 99 LEU B CG 1 ATOM 2911 C CD1 . LEU B 1 11 ? -29.267 28.699 -14.751 1.00 12.01 ? 99 LEU B CD1 1 ATOM 2912 C CD2 . LEU B 1 11 ? -31.469 27.532 -14.358 1.00 12.54 ? 99 LEU B CD2 1 ATOM 2913 N N . TRP B 1 12 ? -31.012 23.885 -17.607 1.00 6.79 ? 100 TRP B N 1 ATOM 2914 C CA . TRP B 1 12 ? -30.884 23.116 -18.850 1.00 6.89 ? 100 TRP B CA 1 ATOM 2915 C C . TRP B 1 12 ? -30.259 23.966 -19.912 1.00 7.32 ? 100 TRP B C 1 ATOM 2916 O O . TRP B 1 12 ? -30.755 25.046 -20.171 1.00 8.60 ? 100 TRP B O 1 ATOM 2917 C CB . TRP B 1 12 ? -32.250 22.698 -19.319 1.00 7.95 ? 100 TRP B CB 1 ATOM 2918 C CG . TRP B 1 12 ? -32.313 21.872 -20.509 1.00 6.19 ? 100 TRP B CG 1 ATOM 2919 C CD1 . TRP B 1 12 ? -32.651 22.280 -21.772 1.00 6.80 ? 100 TRP B CD1 1 ATOM 2920 C CD2 . TRP B 1 12 ? -32.106 20.459 -20.593 1.00 6.94 ? 100 TRP B CD2 1 ATOM 2921 N NE1 . TRP B 1 12 ? -32.644 21.217 -22.628 1.00 6.78 ? 100 TRP B NE1 1 ATOM 2922 C CE2 . TRP B 1 12 ? -32.323 20.083 -21.930 1.00 6.65 ? 100 TRP B CE2 1 ATOM 2923 C CE3 . TRP B 1 12 ? -31.767 19.462 -19.664 1.00 5.83 ? 100 TRP B CE3 1 ATOM 2924 C CZ2 . TRP B 1 12 ? -32.212 18.753 -22.372 1.00 7.63 ? 100 TRP B CZ2 1 ATOM 2925 C CZ3 . TRP B 1 12 ? -31.663 18.140 -20.099 1.00 7.70 ? 100 TRP B CZ3 1 ATOM 2926 C CH2 . TRP B 1 12 ? -31.919 17.795 -21.449 1.00 7.86 ? 100 TRP B CH2 1 ATOM 2927 N N . ALA B 1 13 ? -29.238 23.429 -20.582 1.00 7.99 ? 101 ALA B N 1 ATOM 2928 C CA . ALA B 1 13 ? -28.612 24.080 -21.752 1.00 6.66 ? 101 ALA B CA 1 ATOM 2929 C C . ALA B 1 13 ? -29.331 23.551 -22.960 1.00 6.81 ? 101 ALA B C 1 ATOM 2930 O O . ALA B 1 13 ? -29.355 22.328 -23.168 1.00 6.79 ? 101 ALA B O 1 ATOM 2931 C CB . ALA B 1 13 ? -27.136 23.705 -21.847 1.00 8.58 ? 101 ALA B CB 1 ATOM 2932 N N . ASN B 1 14 ? -30.015 24.416 -23.708 1.00 6.34 ? 102 ASN B N 1 ATOM 2933 C CA . ASN B 1 14 ? -30.874 23.931 -24.776 1.00 6.49 ? 102 ASN B CA 1 ATOM 2934 C C . ASN B 1 14 ? -30.069 23.468 -26.010 1.00 6.34 ? 102 ASN B C 1 ATOM 2935 O O . ASN B 1 14 ? -28.906 23.899 -26.243 1.00 7.32 ? 102 ASN B O 1 ATOM 2936 C CB . ASN B 1 14 ? -31.988 24.947 -25.158 1.00 6.75 ? 102 ASN B CB 1 ATOM 2937 C CG . ASN B 1 14 ? -31.449 26.190 -25.870 1.00 9.74 ? 102 ASN B CG 1 ATOM 2938 O OD1 . ASN B 1 14 ? -31.137 26.135 -27.055 1.00 7.98 ? 102 ASN B OD1 1 ATOM 2939 N ND2 . ASN B 1 14 ? -31.333 27.311 -25.130 1.00 8.67 ? 102 ASN B ND2 1 ATOM 2940 N N . ASN B 1 15 ? -30.700 22.606 -26.803 1.00 6.01 ? 103 ASN B N 1 ATOM 2941 C CA . ASN B 1 15 ? -30.015 22.016 -27.938 1.00 6.37 ? 103 ASN B CA 1 ATOM 2942 C C . ASN B 1 15 ? -29.939 22.964 -29.153 1.00 7.00 ? 103 ASN B C 1 ATOM 2943 O O . ASN B 1 15 ? -29.262 22.671 -30.132 1.00 5.92 ? 103 ASN B O 1 ATOM 2944 C CB . ASN B 1 15 ? -30.638 20.686 -28.288 1.00 8.10 ? 103 ASN B CB 1 ATOM 2945 C CG . ASN B 1 15 ? -29.764 19.881 -29.216 1.00 8.14 ? 103 ASN B CG 1 ATOM 2946 O OD1 . ASN B 1 15 ? -28.610 19.631 -28.919 1.00 6.35 ? 103 ASN B OD1 1 ATOM 2947 N ND2 . ASN B 1 15 ? -30.305 19.474 -30.309 1.00 6.73 ? 103 ASN B ND2 1 ATOM 2948 N N . TYR B 1 16 ? -30.699 24.060 -29.144 1.00 6.95 ? 104 TYR B N 1 ATOM 2949 C CA . TYR B 1 16 ? -30.742 24.956 -30.307 1.00 7.04 ? 104 TYR B CA 1 ATOM 2950 C C . TYR B 1 16 ? -29.458 25.788 -30.373 1.00 6.86 ? 104 TYR B C 1 ATOM 2951 O O . TYR B 1 16 ? -28.830 25.884 -31.405 1.00 7.45 ? 104 TYR B O 1 ATOM 2952 C CB . TYR B 1 16 ? -32.017 25.790 -30.314 1.00 9.47 ? 104 TYR B CB 1 ATOM 2953 C CG . TYR B 1 16 ? -33.146 24.892 -29.939 1.00 9.88 ? 104 TYR B CG 1 ATOM 2954 C CD1 . TYR B 1 16 ? -33.470 23.781 -30.695 1.00 17.49 ? 104 TYR B CD1 1 ATOM 2955 C CD2 . TYR B 1 16 ? -33.810 25.072 -28.716 1.00 16.77 ? 104 TYR B CD2 1 ATOM 2956 C CE1 . TYR B 1 16 ? -34.470 22.894 -30.240 1.00 18.40 ? 104 TYR B CE1 1 ATOM 2957 C CE2 . TYR B 1 16 ? -34.773 24.234 -28.313 1.00 17.42 ? 104 TYR B CE2 1 ATOM 2958 C CZ . TYR B 1 16 ? -35.101 23.164 -29.047 1.00 16.90 ? 104 TYR B CZ 1 ATOM 2959 O OH . TYR B 1 16 ? -36.084 22.320 -28.500 1.00 21.64 ? 104 TYR B OH 1 ATOM 2960 N N . TYR B 1 17 ? -29.048 26.356 -29.247 1.00 7.58 ? 105 TYR B N 1 ATOM 2961 C CA . TYR B 1 17 ? -27.739 27.029 -29.187 1.00 6.96 ? 105 TYR B CA 1 ATOM 2962 C C . TYR B 1 17 ? -26.619 26.042 -29.426 1.00 7.39 ? 105 TYR B C 1 ATOM 2963 O O . TYR B 1 17 ? -25.675 26.330 -30.169 1.00 5.49 ? 105 TYR B O 1 ATOM 2964 C CB . TYR B 1 17 ? -27.545 27.758 -27.868 1.00 8.50 ? 105 TYR B CB 1 ATOM 2965 C CG . TYR B 1 17 ? -26.309 28.618 -27.809 1.00 6.40 ? 105 TYR B CG 1 ATOM 2966 C CD1 . TYR B 1 17 ? -26.286 29.844 -28.403 1.00 7.66 ? 105 TYR B CD1 1 ATOM 2967 C CD2 . TYR B 1 17 ? -25.176 28.207 -27.136 1.00 5.06 ? 105 TYR B CD2 1 ATOM 2968 C CE1 . TYR B 1 17 ? -25.208 30.657 -28.331 1.00 6.04 ? 105 TYR B CE1 1 ATOM 2969 C CE2 . TYR B 1 17 ? -24.044 29.006 -27.068 1.00 7.73 ? 105 TYR B CE2 1 ATOM 2970 C CZ . TYR B 1 17 ? -24.063 30.231 -27.683 1.00 6.98 ? 105 TYR B CZ 1 ATOM 2971 O OH . TYR B 1 17 ? -22.965 31.017 -27.627 1.00 8.81 ? 105 TYR B OH 1 ATOM 2972 N N . ARG B 1 18 ? -26.720 24.863 -28.810 1.00 5.77 ? 106 ARG B N 1 ATOM 2973 C CA . ARG B 1 18 ? -25.664 23.855 -29.015 1.00 5.24 ? 106 ARG B CA 1 ATOM 2974 C C . ARG B 1 18 ? -25.524 23.527 -30.529 1.00 4.77 ? 106 ARG B C 1 ATOM 2975 O O . ARG B 1 18 ? -24.386 23.395 -31.065 1.00 4.81 ? 106 ARG B O 1 ATOM 2976 C CB . ARG B 1 18 ? -25.979 22.586 -28.247 1.00 4.49 ? 106 ARG B CB 1 ATOM 2977 C CG . ARG B 1 18 ? -24.976 21.442 -28.452 1.00 5.07 ? 106 ARG B CG 1 ATOM 2978 C CD . ARG B 1 18 ? -25.274 20.189 -27.698 1.00 6.57 ? 106 ARG B CD 1 ATOM 2979 N NE . ARG B 1 18 ? -25.445 20.408 -26.265 1.00 6.50 ? 106 ARG B NE 1 ATOM 2980 C CZ . ARG B 1 18 ? -26.571 20.444 -25.579 1.00 8.09 ? 106 ARG B CZ 1 ATOM 2981 N NH1 . ARG B 1 18 ? -27.728 20.193 -26.114 1.00 8.94 ? 106 ARG B NH1 1 ATOM 2982 N NH2 . ARG B 1 18 ? -26.521 20.673 -24.269 1.00 11.11 ? 106 ARG B NH2 1 ATOM 2983 N N . SER B 1 19 ? -26.677 23.369 -31.196 1.00 5.98 ? 107 SER B N 1 ATOM 2984 C CA . SER B 1 19 ? -26.717 23.053 -32.628 1.00 6.02 ? 107 SER B CA 1 ATOM 2985 C C . SER B 1 19 ? -26.108 24.158 -33.490 1.00 5.36 ? 107 SER B C 1 ATOM 2986 O O . SER B 1 19 ? -25.354 23.855 -34.405 1.00 5.91 ? 107 SER B O 1 ATOM 2987 C CB . SER B 1 19 ? -28.115 22.670 -33.108 1.00 6.22 ? 107 SER B CB 1 ATOM 2988 O OG . SER B 1 19 ? -28.540 21.499 -32.451 1.00 6.51 ? 107 SER B OG 1 ATOM 2989 N N . GLU B 1 20 ? -26.373 25.422 -33.148 1.00 5.16 ? 108 GLU B N 1 ATOM 2990 C CA . GLU B 1 20 ? -25.791 26.533 -33.863 1.00 6.27 ? 108 GLU B CA 1 ATOM 2991 C C . GLU B 1 20 ? -24.273 26.464 -33.749 1.00 4.02 ? 108 GLU B C 1 ATOM 2992 O O . GLU B 1 20 ? -23.562 26.578 -34.727 1.00 5.91 ? 108 GLU B O 1 ATOM 2993 C CB . GLU B 1 20 ? -26.215 27.882 -33.315 1.00 6.46 ? 108 GLU B CB 1 ATOM 2994 C CG . GLU B 1 20 ? -27.673 28.169 -33.608 1.00 10.01 ? 108 GLU B CG 1 ATOM 2995 C CD . GLU B 1 20 ? -28.113 29.459 -32.969 1.00 13.03 ? 108 GLU B CD 1 ATOM 2996 O OE1 . GLU B 1 20 ? -27.914 29.653 -31.750 1.00 11.34 ? 108 GLU B OE1 1 ATOM 2997 O OE2 . GLU B 1 20 ? -28.643 30.301 -33.711 1.00 15.15 ? 108 GLU B OE2 1 ATOM 2998 N N . VAL B 1 21 ? -23.774 26.268 -32.540 1.00 5.21 ? 109 VAL B N 1 ATOM 2999 C CA . VAL B 1 21 ? -22.319 26.266 -32.344 1.00 5.19 ? 109 VAL B CA 1 ATOM 3000 C C . VAL B 1 21 ? -21.647 25.080 -33.062 1.00 5.04 ? 109 VAL B C 1 ATOM 3001 O O . VAL B 1 21 ? -20.633 25.254 -33.748 1.00 4.32 ? 109 VAL B O 1 ATOM 3002 C CB . VAL B 1 21 ? -21.922 26.250 -30.812 1.00 5.41 ? 109 VAL B CB 1 ATOM 3003 C CG1 . VAL B 1 21 ? -20.431 26.056 -30.643 1.00 7.22 ? 109 VAL B CG1 1 ATOM 3004 C CG2 . VAL B 1 21 ? -22.433 27.492 -30.091 1.00 7.56 ? 109 VAL B CG2 1 ATOM 3005 N N . HIS B 1 22 ? -22.230 23.894 -32.969 1.00 3.82 ? 110 HIS B N 1 ATOM 3006 C CA . HIS B 1 22 ? -21.624 22.716 -33.533 1.00 4.14 ? 110 HIS B CA 1 ATOM 3007 C C . HIS B 1 22 ? -21.804 22.565 -35.043 1.00 5.02 ? 110 HIS B C 1 ATOM 3008 O O . HIS B 1 22 ? -20.941 22.036 -35.688 1.00 5.40 ? 110 HIS B O 1 ATOM 3009 C CB . HIS B 1 22 ? -22.089 21.440 -32.817 1.00 3.42 ? 110 HIS B CB 1 ATOM 3010 C CG . HIS B 1 22 ? -21.409 21.205 -31.498 1.00 2.98 ? 110 HIS B CG 1 ATOM 3011 N ND1 . HIS B 1 22 ? -20.190 20.562 -31.406 1.00 4.96 ? 110 HIS B ND1 1 ATOM 3012 C CD2 . HIS B 1 22 ? -21.753 21.562 -30.236 1.00 5.82 ? 110 HIS B CD2 1 ATOM 3013 C CE1 . HIS B 1 22 ? -19.830 20.520 -30.125 1.00 6.64 ? 110 HIS B CE1 1 ATOM 3014 N NE2 . HIS B 1 22 ? -20.767 21.107 -29.402 1.00 5.95 ? 110 HIS B NE2 1 ATOM 3015 N N . THR B 1 23 ? -22.916 23.046 -35.597 1.00 5.16 ? 111 THR B N 1 ATOM 3016 C CA . THR B 1 23 ? -23.157 22.890 -37.021 1.00 4.78 ? 111 THR B CA 1 ATOM 3017 C C . THR B 1 23 ? -22.711 24.070 -37.851 1.00 5.47 ? 111 THR B C 1 ATOM 3018 O O . THR B 1 23 ? -22.497 23.893 -39.039 1.00 6.16 ? 111 THR B O 1 ATOM 3019 C CB . THR B 1 23 ? -24.604 22.551 -37.365 1.00 4.21 ? 111 THR B CB 1 ATOM 3020 O OG1 . THR B 1 23 ? -25.474 23.677 -37.073 1.00 6.37 ? 111 THR B OG1 1 ATOM 3021 C CG2 . THR B 1 23 ? -25.095 21.398 -36.560 1.00 5.35 ? 111 THR B CG2 1 ATOM 3022 N N . LEU B 1 24 ? -22.624 25.255 -37.249 1.00 5.56 ? 112 LEU B N 1 ATOM 3023 C CA . LEU B 1 24 ? -22.313 26.481 -37.966 1.00 7.23 ? 112 LEU B CA 1 ATOM 3024 C C . LEU B 1 24 ? -20.981 27.049 -37.569 1.00 7.10 ? 112 LEU B C 1 ATOM 3025 O O . LEU B 1 24 ? -20.195 27.435 -38.441 1.00 9.87 ? 112 LEU B O 1 ATOM 3026 C CB . LEU B 1 24 ? -23.361 27.546 -37.790 1.00 7.17 ? 112 LEU B CB 1 ATOM 3027 C CG . LEU B 1 24 ? -24.822 27.190 -37.993 1.00 10.92 ? 112 LEU B CG 1 ATOM 3028 C CD1 . LEU B 1 24 ? -25.760 28.377 -37.674 1.00 13.85 ? 112 LEU B CD1 1 ATOM 3029 C CD2 . LEU B 1 24 ? -24.957 26.764 -39.445 1.00 14.18 ? 112 LEU B CD2 1 ATOM 3030 N N . ALA B 1 25 ? -20.710 27.173 -36.272 1.00 7.67 ? 113 ALA B N 1 ATOM 3031 C CA . ALA B 1 25 ? -19.459 27.822 -35.822 1.00 6.98 ? 113 ALA B CA 1 ATOM 3032 C C . ALA B 1 25 ? -18.249 26.938 -35.866 1.00 6.11 ? 113 ALA B C 1 ATOM 3033 O O . ALA B 1 25 ? -17.238 27.265 -36.508 1.00 6.34 ? 113 ALA B O 1 ATOM 3034 C CB . ALA B 1 25 ? -19.660 28.412 -34.400 1.00 8.06 ? 113 ALA B CB 1 ATOM 3035 N N . ILE B 1 26 ? -18.297 25.800 -35.179 1.00 5.23 ? 114 ILE B N 1 ATOM 3036 C CA . ILE B 1 26 ? -17.110 24.970 -35.082 1.00 4.95 ? 114 ILE B CA 1 ATOM 3037 C C . ILE B 1 26 ? -16.499 24.502 -36.405 1.00 6.17 ? 114 ILE B C 1 ATOM 3038 O O . ILE B 1 26 ? -15.271 24.499 -36.550 1.00 6.79 ? 114 ILE B O 1 ATOM 3039 C CB . ILE B 1 26 ? -17.326 23.803 -34.085 1.00 5.09 ? 114 ILE B CB 1 ATOM 3040 C CG1 . ILE B 1 26 ? -17.300 24.357 -32.662 1.00 5.44 ? 114 ILE B CG1 1 ATOM 3041 C CG2 . ILE B 1 26 ? -16.268 22.678 -34.276 1.00 4.75 ? 114 ILE B CG2 1 ATOM 3042 C CD1 . ILE B 1 26 ? -17.923 23.415 -31.653 1.00 5.69 ? 114 ILE B CD1 1 ATOM 3043 N N . PRO B 1 27 ? -17.302 24.115 -37.397 1.00 5.47 ? 115 PRO B N 1 ATOM 3044 C CA . PRO B 1 27 ? -16.721 23.717 -38.673 1.00 6.16 ? 115 PRO B CA 1 ATOM 3045 C C . PRO B 1 27 ? -16.017 24.872 -39.426 1.00 8.63 ? 115 PRO B C 1 ATOM 3046 O O . PRO B 1 27 ? -15.357 24.564 -40.396 1.00 8.54 ? 115 PRO B O 1 ATOM 3047 C CB . PRO B 1 27 ? -17.918 23.177 -39.478 1.00 7.10 ? 115 PRO B CB 1 ATOM 3048 C CG . PRO B 1 27 ? -18.960 22.972 -38.570 1.00 4.47 ? 115 PRO B CG 1 ATOM 3049 C CD . PRO B 1 27 ? -18.764 23.902 -37.343 1.00 5.51 ? 115 PRO B CD 1 ATOM 3050 N N . GLN B 1 28 ? -16.225 26.119 -39.017 1.00 10.70 ? 116 GLN B N 1 ATOM 3051 C CA . GLN B 1 28 ? -15.513 27.284 -39.563 1.00 12.51 ? 116 GLN B CA 1 ATOM 3052 C C . GLN B 1 28 ? -14.360 27.782 -38.691 1.00 13.86 ? 116 GLN B C 1 ATOM 3053 O O . GLN B 1 28 ? -13.696 28.770 -39.062 1.00 15.43 ? 116 GLN B O 1 ATOM 3054 C CB . GLN B 1 28 ? -16.491 28.436 -39.770 1.00 13.72 ? 116 GLN B CB 1 ATOM 3055 C CG . GLN B 1 28 ? -17.516 28.134 -40.792 1.00 15.20 ? 116 GLN B CG 1 ATOM 3056 C CD . GLN B 1 28 ? -18.366 29.337 -41.139 1.00 21.13 ? 116 GLN B CD 1 ATOM 3057 O OE1 . GLN B 1 28 ? -17.901 30.496 -41.054 1.00 18.09 ? 116 GLN B OE1 1 ATOM 3058 N NE2 . GLN B 1 28 ? -19.615 29.076 -41.565 1.00 21.54 ? 116 GLN B NE2 1 ATOM 3059 N N . ILE B 1 29 ? -14.085 27.131 -37.575 1.00 12.72 ? 117 ILE B N 1 ATOM 3060 C CA . ILE B 1 29 ? -13.027 27.562 -36.685 1.00 13.80 ? 117 ILE B CA 1 ATOM 3061 C C . ILE B 1 29 ? -11.897 26.550 -36.811 1.00 14.38 ? 117 ILE B C 1 ATOM 3062 O O . ILE B 1 29 ? -12.135 25.353 -36.656 1.00 15.43 ? 117 ILE B O 1 ATOM 3063 C CB . ILE B 1 29 ? -13.524 27.664 -35.255 1.00 13.27 ? 117 ILE B CB 1 ATOM 3064 C CG1 . ILE B 1 29 ? -14.595 28.751 -35.139 1.00 12.99 ? 117 ILE B CG1 1 ATOM 3065 C CG2 . ILE B 1 29 ? -12.306 27.897 -34.306 1.00 14.25 ? 117 ILE B CG2 1 ATOM 3066 C CD1 . ILE B 1 29 ? -15.368 28.737 -33.884 1.00 11.58 ? 117 ILE B CD1 1 ATOM 3067 N N . THR B 1 30 ? -10.692 27.013 -37.137 1.00 15.81 ? 118 THR B N 1 ATOM 3068 C CA . THR B 1 30 ? -9.522 26.144 -37.318 1.00 16.22 ? 118 THR B CA 1 ATOM 3069 C C . THR B 1 30 ? -8.657 26.012 -36.050 1.00 15.95 ? 118 THR B C 1 ATOM 3070 O O . THR B 1 30 ? -8.098 24.941 -35.747 1.00 13.35 ? 118 THR B O 1 ATOM 3071 C CB . THR B 1 30 ? -8.616 26.701 -38.435 1.00 16.38 ? 118 THR B CB 1 ATOM 3072 O OG1 . THR B 1 30 ? -9.361 26.886 -39.656 1.00 20.44 ? 118 THR B OG1 1 ATOM 3073 C CG2 . THR B 1 30 ? -7.528 25.725 -38.797 1.00 18.39 ? 118 THR B CG2 1 ATOM 3074 N N . ASP B 1 31 ? -8.539 27.103 -35.307 1.00 15.08 ? 119 ASP B N 1 ATOM 3075 C CA . ASP B 1 31 ? -7.613 27.093 -34.184 1.00 15.40 ? 119 ASP B CA 1 ATOM 3076 C C . ASP B 1 31 ? -8.148 26.084 -33.145 1.00 14.55 ? 119 ASP B C 1 ATOM 3077 O O . ASP B 1 31 ? -9.301 26.211 -32.726 1.00 12.96 ? 119 ASP B O 1 ATOM 3078 C CB . ASP B 1 31 ? -7.496 28.488 -33.569 1.00 15.37 ? 119 ASP B CB 1 ATOM 3079 C CG . ASP B 1 31 ? -6.685 28.465 -32.305 1.00 18.01 ? 119 ASP B CG 1 ATOM 3080 O OD1 . ASP B 1 31 ? -5.454 28.582 -32.362 1.00 21.12 ? 119 ASP B OD1 1 ATOM 3081 O OD2 . ASP B 1 31 ? -7.227 28.287 -31.200 1.00 23.35 ? 119 ASP B OD2 1 ATOM 3082 N N . PRO B 1 32 ? -7.349 25.085 -32.771 1.00 14.76 ? 120 PRO B N 1 ATOM 3083 C CA . PRO B 1 32 ? -7.787 24.029 -31.842 1.00 14.37 ? 120 PRO B CA 1 ATOM 3084 C C . PRO B 1 32 ? -8.254 24.533 -30.506 1.00 14.95 ? 120 PRO B C 1 ATOM 3085 O O . PRO B 1 32 ? -9.181 23.965 -29.923 1.00 12.43 ? 120 PRO B O 1 ATOM 3086 C CB . PRO B 1 32 ? -6.531 23.162 -31.659 1.00 15.61 ? 120 PRO B CB 1 ATOM 3087 C CG . PRO B 1 32 ? -5.701 23.433 -32.850 1.00 14.61 ? 120 PRO B CG 1 ATOM 3088 C CD . PRO B 1 32 ? -5.986 24.816 -33.274 1.00 14.66 ? 120 PRO B CD 1 ATOM 3089 N N . ALA B 1 33 ? -7.597 25.559 -29.984 1.00 14.21 ? 121 ALA B N 1 ATOM 3090 C CA . ALA B 1 33 ? -8.050 26.121 -28.715 1.00 14.63 ? 121 ALA B CA 1 ATOM 3091 C C . ALA B 1 33 ? -9.401 26.752 -28.813 1.00 13.32 ? 121 ALA B C 1 ATOM 3092 O O . ALA B 1 33 ? -10.207 26.584 -27.913 1.00 12.97 ? 121 ALA B O 1 ATOM 3093 C CB . ALA B 1 33 ? -7.015 27.145 -28.150 1.00 15.07 ? 121 ALA B CB 1 ATOM 3094 N N . LEU B 1 34 ? -9.662 27.487 -29.893 1.00 12.62 ? 122 LEU B N 1 ATOM 3095 C CA . LEU B 1 34 ? -10.946 28.120 -30.076 1.00 12.24 ? 122 LEU B CA 1 ATOM 3096 C C . LEU B 1 34 ? -12.023 27.066 -30.335 1.00 10.39 ? 122 LEU B C 1 ATOM 3097 O O . LEU B 1 34 ? -13.164 27.244 -29.951 1.00 9.99 ? 122 LEU B O 1 ATOM 3098 C CB . LEU B 1 34 ? -10.931 29.118 -31.230 1.00 13.11 ? 122 LEU B CB 1 ATOM 3099 C CG . LEU B 1 34 ? -10.489 30.555 -31.018 1.00 16.41 ? 122 LEU B CG 1 ATOM 3100 C CD1 . LEU B 1 34 ? -10.616 31.326 -32.359 1.00 15.92 ? 122 LEU B CD1 1 ATOM 3101 C CD2 . LEU B 1 34 ? -11.269 31.199 -29.936 1.00 16.21 ? 122 LEU B CD2 1 ATOM 3102 N N . ARG B 1 35 ? -11.666 25.980 -31.013 1.00 10.02 ? 123 ARG B N 1 ATOM 3103 C CA . ARG B 1 35 ? -12.661 24.928 -31.253 1.00 9.88 ? 123 ARG B CA 1 ATOM 3104 C C . ARG B 1 35 ? -13.103 24.291 -29.926 1.00 9.19 ? 123 ARG B C 1 ATOM 3105 O O . ARG B 1 35 ? -14.300 24.129 -29.675 1.00 7.65 ? 123 ARG B O 1 ATOM 3106 C CB . ARG B 1 35 ? -12.123 23.874 -32.201 1.00 9.91 ? 123 ARG B CB 1 ATOM 3107 C CG . ARG B 1 35 ? -11.918 24.335 -33.608 1.00 12.94 ? 123 ARG B CG 1 ATOM 3108 C CD . ARG B 1 35 ? -11.191 23.284 -34.467 1.00 14.91 ? 123 ARG B CD 1 ATOM 3109 N NE . ARG B 1 35 ? -11.908 22.019 -34.506 1.00 16.50 ? 123 ARG B NE 1 ATOM 3110 C CZ . ARG B 1 35 ? -12.847 21.692 -35.400 1.00 19.93 ? 123 ARG B CZ 1 ATOM 3111 N NH1 . ARG B 1 35 ? -13.195 22.551 -36.345 1.00 17.88 ? 123 ARG B NH1 1 ATOM 3112 N NH2 . ARG B 1 35 ? -13.405 20.476 -35.362 1.00 20.91 ? 123 ARG B NH2 1 ATOM 3113 N N . ALA B 1 36 ? -12.139 23.985 -29.056 1.00 9.85 ? 124 ALA B N 1 ATOM 3114 C CA . ALA B 1 36 ? -12.412 23.454 -27.722 1.00 9.22 ? 124 ALA B CA 1 ATOM 3115 C C . ALA B 1 36 ? -13.251 24.471 -26.906 1.00 9.04 ? 124 ALA B C 1 ATOM 3116 O O . ALA B 1 36 ? -14.194 24.083 -26.212 1.00 7.58 ? 124 ALA B O 1 ATOM 3117 C CB . ALA B 1 36 ? -11.080 23.084 -26.975 1.00 10.28 ? 124 ALA B CB 1 ATOM 3118 N N . ALA B 1 37 ? -12.901 25.759 -26.988 1.00 8.74 ? 125 ALA B N 1 ATOM 3119 C CA . ALA B 1 37 ? -13.556 26.787 -26.225 1.00 9.40 ? 125 ALA B CA 1 ATOM 3120 C C . ALA B 1 37 ? -15.016 26.904 -26.687 1.00 8.83 ? 125 ALA B C 1 ATOM 3121 O O . ALA B 1 37 ? -15.946 27.033 -25.900 1.00 9.84 ? 125 ALA B O 1 ATOM 3122 C CB . ALA B 1 37 ? -12.825 28.098 -26.388 1.00 10.64 ? 125 ALA B CB 1 ATOM 3123 N N . ALA B 1 38 ? -15.214 26.798 -28.010 1.00 6.89 ? 126 ALA B N 1 ATOM 3124 C CA . ALA B 1 38 ? -16.555 26.887 -28.555 1.00 7.07 ? 126 ALA B CA 1 ATOM 3125 C C . ALA B 1 38 ? -17.422 25.746 -28.065 1.00 6.17 ? 126 ALA B C 1 ATOM 3126 O O . ALA B 1 38 ? -18.607 25.946 -27.780 1.00 6.74 ? 126 ALA B O 1 ATOM 3127 C CB . ALA B 1 38 ? -16.532 26.897 -30.050 1.00 6.21 ? 126 ALA B CB 1 ATOM 3128 N N . SER B 1 39 ? -16.837 24.538 -28.003 1.00 6.29 ? 127 SER B N 1 ATOM 3129 C CA . SER B 1 39 ? -17.584 23.368 -27.563 1.00 7.40 ? 127 SER B CA 1 ATOM 3130 C C . SER B 1 39 ? -18.042 23.549 -26.113 1.00 6.68 ? 127 SER B C 1 ATOM 3131 O O . SER B 1 39 ? -19.145 23.196 -25.727 1.00 6.93 ? 127 SER B O 1 ATOM 3132 C CB . SER B 1 39 ? -16.729 22.135 -27.745 1.00 8.90 ? 127 SER B CB 1 ATOM 3133 O OG . SER B 1 39 ? -17.450 21.042 -27.218 1.00 14.40 ? 127 SER B OG 1 ATOM 3134 N N . ALA B 1 40 ? -17.203 24.214 -25.319 1.00 6.86 ? 128 ALA B N 1 ATOM 3135 C CA . ALA B 1 40 ? -17.535 24.455 -23.916 1.00 6.54 ? 128 ALA B CA 1 ATOM 3136 C C . ALA B 1 40 ? -18.636 25.490 -23.749 1.00 6.50 ? 128 ALA B C 1 ATOM 3137 O O . ALA B 1 40 ? -19.554 25.354 -22.906 1.00 5.84 ? 128 ALA B O 1 ATOM 3138 C CB . ALA B 1 40 ? -16.257 24.853 -23.195 1.00 6.95 ? 128 ALA B CB 1 ATOM 3139 N N . VAL B 1 41 ? -18.605 26.561 -24.558 1.00 6.69 ? 129 VAL B N 1 ATOM 3140 C CA . VAL B 1 41 ? -19.638 27.601 -24.447 1.00 8.45 ? 129 VAL B CA 1 ATOM 3141 C C . VAL B 1 41 ? -20.984 27.110 -24.911 1.00 6.48 ? 129 VAL B C 1 ATOM 3142 O O . VAL B 1 41 ? -22.034 27.529 -24.448 1.00 6.80 ? 129 VAL B O 1 ATOM 3143 C CB . VAL B 1 41 ? -19.207 28.918 -25.116 1.00 9.42 ? 129 VAL B CB 1 ATOM 3144 C CG1 . VAL B 1 41 ? -19.235 28.846 -26.566 1.00 11.62 ? 129 VAL B CG1 1 ATOM 3145 C CG2 . VAL B 1 41 ? -20.140 30.066 -24.671 1.00 12.04 ? 129 VAL B CG2 1 ATOM 3146 N N . ALA B 1 42 ? -20.966 26.151 -25.827 1.00 6.32 ? 130 ALA B N 1 ATOM 3147 C CA . ALA B 1 42 ? -22.182 25.502 -26.283 1.00 7.10 ? 130 ALA B CA 1 ATOM 3148 C C . ALA B 1 42 ? -22.983 24.908 -25.125 1.00 8.22 ? 130 ALA B C 1 ATOM 3149 O O . ALA B 1 42 ? -24.171 24.740 -25.230 1.00 7.85 ? 130 ALA B O 1 ATOM 3150 C CB . ALA B 1 42 ? -21.828 24.387 -27.347 1.00 7.99 ? 130 ALA B CB 1 ATOM 3151 N N . GLU B 1 43 ? -22.299 24.539 -24.052 1.00 8.14 ? 131 GLU B N 1 ATOM 3152 C CA . GLU B 1 43 ? -22.935 23.959 -22.882 1.00 9.59 ? 131 GLU B CA 1 ATOM 3153 C C . GLU B 1 43 ? -23.362 24.938 -21.760 1.00 10.20 ? 131 GLU B C 1 ATOM 3154 O O . GLU B 1 43 ? -23.884 24.487 -20.748 1.00 10.65 ? 131 GLU B O 1 ATOM 3155 C CB . GLU B 1 43 ? -22.006 22.906 -22.315 1.00 9.50 ? 131 GLU B CB 1 ATOM 3156 C CG . GLU B 1 43 ? -21.652 21.786 -23.295 1.00 10.22 ? 131 GLU B CG 1 ATOM 3157 C CD . GLU B 1 43 ? -22.861 21.126 -23.932 1.00 14.24 ? 131 GLU B CD 1 ATOM 3158 O OE1 . GLU B 1 43 ? -23.831 20.791 -23.194 1.00 11.97 ? 131 GLU B OE1 1 ATOM 3159 O OE2 . GLU B 1 43 ? -22.856 20.974 -25.173 1.00 10.94 ? 131 GLU B OE2 1 ATOM 3160 N N . VAL B 1 44 ? -23.076 26.239 -21.909 1.00 9.08 ? 132 VAL B N 1 ATOM 3161 C CA . VAL B 1 44 ? -23.477 27.232 -20.922 1.00 7.20 ? 132 VAL B CA 1 ATOM 3162 C C . VAL B 1 44 ? -24.981 27.423 -21.098 1.00 7.83 ? 132 VAL B C 1 ATOM 3163 O O . VAL B 1 44 ? -25.435 27.624 -22.210 1.00 9.45 ? 132 VAL B O 1 ATOM 3164 C CB . VAL B 1 44 ? -22.724 28.555 -21.140 1.00 6.89 ? 132 VAL B CB 1 ATOM 3165 C CG1 . VAL B 1 44 ? -23.142 29.610 -20.134 1.00 9.05 ? 132 VAL B CG1 1 ATOM 3166 C CG2 . VAL B 1 44 ? -21.249 28.352 -21.067 1.00 7.15 ? 132 VAL B CG2 1 ATOM 3167 N N . PRO B 1 45 ? -25.773 27.326 -20.037 1.00 8.08 ? 133 PRO B N 1 ATOM 3168 C CA . PRO B 1 45 ? -27.247 27.375 -20.200 1.00 8.42 ? 133 PRO B CA 1 ATOM 3169 C C . PRO B 1 45 ? -27.837 28.753 -20.332 1.00 8.59 ? 133 PRO B C 1 ATOM 3170 O O . PRO B 1 45 ? -28.122 29.388 -19.336 1.00 11.00 ? 133 PRO B O 1 ATOM 3171 C CB . PRO B 1 45 ? -27.777 26.686 -18.948 1.00 8.52 ? 133 PRO B CB 1 ATOM 3172 C CG . PRO B 1 45 ? -26.724 26.900 -17.912 1.00 8.98 ? 133 PRO B CG 1 ATOM 3173 C CD . PRO B 1 45 ? -25.366 26.979 -18.659 1.00 8.94 ? 133 PRO B CD 1 ATOM 3174 N N . SER B 1 46 ? -28.054 29.164 -21.571 1.00 8.99 ? 134 SER B N 1 ATOM 3175 C CA . SER B 1 46 ? -28.666 30.437 -21.881 1.00 8.37 ? 134 SER B CA 1 ATOM 3176 C C . SER B 1 46 ? -30.138 30.228 -22.158 1.00 7.67 ? 134 SER B C 1 ATOM 3177 O O . SER B 1 46 ? -30.570 29.129 -22.475 1.00 8.78 ? 134 SER B O 1 ATOM 3178 C CB . SER B 1 46 ? -27.988 31.069 -23.099 1.00 9.99 ? 134 SER B CB 1 ATOM 3179 O OG . SER B 1 46 ? -27.968 30.175 -24.221 1.00 11.02 ? 134 SER B OG 1 ATOM 3180 N N . PHE B 1 47 ? -30.900 31.317 -22.139 1.00 6.69 ? 135 PHE B N 1 ATOM 3181 C CA . PHE B 1 47 ? -32.334 31.251 -22.363 1.00 6.82 ? 135 PHE B CA 1 ATOM 3182 C C . PHE B 1 47 ? -32.672 30.863 -23.778 1.00 7.25 ? 135 PHE B C 1 ATOM 3183 O O . PHE B 1 47 ? -31.990 31.242 -24.722 1.00 7.56 ? 135 PHE B O 1 ATOM 3184 C CB . PHE B 1 47 ? -32.966 32.631 -22.092 1.00 6.77 ? 135 PHE B CB 1 ATOM 3185 C CG . PHE B 1 47 ? -33.327 32.866 -20.644 1.00 6.55 ? 135 PHE B CG 1 ATOM 3186 C CD1 . PHE B 1 47 ? -32.350 33.040 -19.671 1.00 7.07 ? 135 PHE B CD1 1 ATOM 3187 C CD2 . PHE B 1 47 ? -34.645 32.955 -20.266 1.00 6.96 ? 135 PHE B CD2 1 ATOM 3188 C CE1 . PHE B 1 47 ? -32.699 33.254 -18.339 1.00 7.14 ? 135 PHE B CE1 1 ATOM 3189 C CE2 . PHE B 1 47 ? -35.000 33.160 -18.919 1.00 7.77 ? 135 PHE B CE2 1 ATOM 3190 C CZ . PHE B 1 47 ? -34.038 33.325 -17.981 1.00 6.66 ? 135 PHE B CZ 1 ATOM 3191 N N . GLN B 1 48 ? -33.744 30.112 -23.922 1.00 7.00 ? 136 GLN B N 1 ATOM 3192 C CA . GLN B 1 48 ? -34.359 29.818 -25.207 1.00 8.03 ? 136 GLN B CA 1 ATOM 3193 C C . GLN B 1 48 ? -35.470 30.799 -25.479 1.00 8.08 ? 136 GLN B C 1 ATOM 3194 O O . GLN B 1 48 ? -36.282 31.086 -24.614 1.00 8.90 ? 136 GLN B O 1 ATOM 3195 C CB . GLN B 1 48 ? -34.933 28.412 -25.150 1.00 8.73 ? 136 GLN B CB 1 ATOM 3196 C CG . GLN B 1 48 ? -35.535 27.922 -26.425 1.00 12.54 ? 136 GLN B CG 1 ATOM 3197 C CD . GLN B 1 48 ? -36.146 26.550 -26.235 1.00 16.18 ? 136 GLN B CD 1 ATOM 3198 O OE1 . GLN B 1 48 ? -35.641 25.739 -25.440 1.00 17.03 ? 136 GLN B OE1 1 ATOM 3199 N NE2 . GLN B 1 48 ? -37.262 26.311 -26.920 1.00 13.43 ? 136 GLN B NE2 1 ATOM 3200 N N . TRP B 1 49 ? -35.523 31.310 -26.699 1.00 7.57 ? 137 TRP B N 1 ATOM 3201 C CA . TRP B 1 49 ? -36.388 32.434 -27.048 1.00 7.28 ? 137 TRP B CA 1 ATOM 3202 C C . TRP B 1 49 ? -37.529 31.945 -27.910 1.00 7.79 ? 137 TRP B C 1 ATOM 3203 O O . TRP B 1 49 ? -37.312 31.271 -28.921 1.00 7.59 ? 137 TRP B O 1 ATOM 3204 C CB . TRP B 1 49 ? -35.588 33.491 -27.825 1.00 7.69 ? 137 TRP B CB 1 ATOM 3205 C CG . TRP B 1 49 ? -34.640 34.311 -27.007 1.00 7.49 ? 137 TRP B CG 1 ATOM 3206 C CD1 . TRP B 1 49 ? -33.531 33.882 -26.351 1.00 7.49 ? 137 TRP B CD1 1 ATOM 3207 C CD2 . TRP B 1 49 ? -34.657 35.749 -26.839 1.00 7.17 ? 137 TRP B CD2 1 ATOM 3208 N NE1 . TRP B 1 49 ? -32.881 34.931 -25.751 1.00 6.27 ? 137 TRP B NE1 1 ATOM 3209 C CE2 . TRP B 1 49 ? -33.524 36.090 -26.050 1.00 7.63 ? 137 TRP B CE2 1 ATOM 3210 C CE3 . TRP B 1 49 ? -35.521 36.775 -27.258 1.00 9.30 ? 137 TRP B CE3 1 ATOM 3211 C CZ2 . TRP B 1 49 ? -33.253 37.373 -25.673 1.00 6.61 ? 137 TRP B CZ2 1 ATOM 3212 C CZ3 . TRP B 1 49 ? -35.240 38.053 -26.905 1.00 7.02 ? 137 TRP B CZ3 1 ATOM 3213 C CH2 . TRP B 1 49 ? -34.092 38.355 -26.120 1.00 5.97 ? 137 TRP B CH2 1 ATOM 3214 N N . LEU B 1 50 ? -38.746 32.289 -27.516 1.00 7.77 ? 138 LEU B N 1 ATOM 3215 C CA . LEU B 1 50 ? -39.936 32.073 -28.349 1.00 7.58 ? 138 LEU B CA 1 ATOM 3216 C C . LEU B 1 50 ? -40.225 33.299 -29.231 1.00 8.59 ? 138 LEU B C 1 ATOM 3217 O O . LEU B 1 50 ? -41.145 34.072 -29.002 1.00 7.57 ? 138 LEU B O 1 ATOM 3218 C CB . LEU B 1 50 ? -41.113 31.755 -27.451 1.00 7.19 ? 138 LEU B CB 1 ATOM 3219 C CG . LEU B 1 50 ? -40.927 30.634 -26.425 1.00 9.40 ? 138 LEU B CG 1 ATOM 3220 C CD1 . LEU B 1 50 ? -42.217 30.415 -25.639 1.00 9.30 ? 138 LEU B CD1 1 ATOM 3221 C CD2 . LEU B 1 50 ? -40.426 29.348 -27.044 1.00 10.89 ? 138 LEU B CD2 1 ATOM 3222 N N . ASP B 1 51 ? -39.357 33.514 -30.212 1.00 9.02 ? 139 ASP B N 1 ATOM 3223 C CA . ASP B 1 51 ? -39.362 34.766 -30.980 1.00 8.67 ? 139 ASP B CA 1 ATOM 3224 C C . ASP B 1 51 ? -40.323 34.717 -32.153 1.00 8.48 ? 139 ASP B C 1 ATOM 3225 O O . ASP B 1 51 ? -40.637 35.748 -32.729 1.00 7.72 ? 139 ASP B O 1 ATOM 3226 C CB . ASP B 1 51 ? -37.943 35.052 -31.441 1.00 9.08 ? 139 ASP B CB 1 ATOM 3227 C CG . ASP B 1 51 ? -37.514 34.132 -32.531 1.00 11.27 ? 139 ASP B CG 1 ATOM 3228 O OD1 . ASP B 1 51 ? -37.542 32.900 -32.339 1.00 12.06 ? 139 ASP B OD1 1 ATOM 3229 O OD2 . ASP B 1 51 ? -37.101 34.556 -33.630 1.00 13.68 ? 139 ASP B OD2 1 ATOM 3230 N N . ARG B 1 52 ? -40.821 33.514 -32.456 1.00 8.15 ? 140 ARG B N 1 ATOM 3231 C CA . ARG B 1 52 ? -41.856 33.317 -33.470 1.00 9.03 ? 140 ARG B CA 1 ATOM 3232 C C . ARG B 1 52 ? -42.883 32.328 -32.919 1.00 7.58 ? 140 ARG B C 1 ATOM 3233 O O . ARG B 1 52 ? -42.544 31.393 -32.180 1.00 8.41 ? 140 ARG B O 1 ATOM 3234 C CB . ARG B 1 52 ? -41.196 32.696 -34.707 1.00 9.30 ? 140 ARG B CB 1 ATOM 3235 C CG . ARG B 1 52 ? -40.332 33.675 -35.487 1.00 11.35 ? 140 ARG B CG 1 ATOM 3236 C CD . ARG B 1 52 ? -39.312 32.945 -36.358 1.00 15.05 ? 140 ARG B CD 1 ATOM 3237 N NE . ARG B 1 52 ? -38.459 32.134 -35.491 1.00 20.11 ? 140 ARG B NE 1 ATOM 3238 C CZ . ARG B 1 52 ? -38.199 30.836 -35.609 1.00 21.37 ? 140 ARG B CZ 1 ATOM 3239 N NH1 . ARG B 1 52 ? -38.722 30.112 -36.582 1.00 22.54 ? 140 ARG B NH1 1 ATOM 3240 N NH2 . ARG B 1 52 ? -37.400 30.266 -34.726 1.00 22.44 ? 140 ARG B NH2 1 ATOM 3241 N N . ASN B 1 53 ? -44.134 32.497 -33.320 1.00 8.84 ? 141 ASN B N 1 ATOM 3242 C CA . ASN B 1 53 ? -45.193 31.644 -32.866 1.00 8.83 ? 141 ASN B CA 1 ATOM 3243 C C . ASN B 1 53 ? -44.948 30.157 -33.169 1.00 8.57 ? 141 ASN B C 1 ATOM 3244 O O . ASN B 1 53 ? -45.303 29.268 -32.378 1.00 9.29 ? 141 ASN B O 1 ATOM 3245 C CB . ASN B 1 53 ? -46.489 32.123 -33.533 1.00 8.67 ? 141 ASN B CB 1 ATOM 3246 C CG . ASN B 1 53 ? -47.701 31.363 -33.080 1.00 9.70 ? 141 ASN B CG 1 ATOM 3247 O OD1 . ASN B 1 53 ? -47.974 31.252 -31.872 1.00 7.49 ? 141 ASN B OD1 1 ATOM 3248 N ND2 . ASN B 1 53 ? -48.447 30.839 -34.069 1.00 9.51 ? 141 ASN B ND2 1 ATOM 3249 N N . VAL B 1 54 ? -44.353 29.864 -34.308 1.00 9.94 ? 142 VAL B N 1 ATOM 3250 C CA . VAL B 1 54 ? -44.045 28.470 -34.649 1.00 11.39 ? 142 VAL B CA 1 ATOM 3251 C C . VAL B 1 54 ? -43.214 27.706 -33.603 1.00 11.01 ? 142 VAL B C 1 ATOM 3252 O O . VAL B 1 54 ? -43.299 26.477 -33.498 1.00 10.90 ? 142 VAL B O 1 ATOM 3253 C CB . VAL B 1 54 ? -43.383 28.388 -36.051 1.00 12.91 ? 142 VAL B CB 1 ATOM 3254 C CG1 . VAL B 1 54 ? -42.007 28.904 -36.050 1.00 13.67 ? 142 VAL B CG1 1 ATOM 3255 C CG2 . VAL B 1 54 ? -43.444 26.997 -36.576 1.00 17.49 ? 142 VAL B CG2 1 ATOM 3256 N N . THR B 1 55 ? -42.463 28.438 -32.786 1.00 10.14 ? 143 THR B N 1 ATOM 3257 C CA . THR B 1 55 ? -41.600 27.797 -31.749 1.00 10.19 ? 143 THR B CA 1 ATOM 3258 C C . THR B 1 55 ? -42.385 27.193 -30.588 1.00 9.50 ? 143 THR B C 1 ATOM 3259 O O . THR B 1 55 ? -41.858 26.372 -29.869 1.00 9.52 ? 143 THR B O 1 ATOM 3260 C CB . THR B 1 55 ? -40.536 28.741 -31.175 1.00 10.63 ? 143 THR B CB 1 ATOM 3261 O OG1 . THR B 1 55 ? -41.156 29.819 -30.435 1.00 10.89 ? 143 THR B OG1 1 ATOM 3262 C CG2 . THR B 1 55 ? -39.732 29.377 -32.277 1.00 12.77 ? 143 THR B CG2 1 ATOM 3263 N N . VAL B 1 56 ? -43.620 27.629 -30.400 1.00 8.28 ? 144 VAL B N 1 ATOM 3264 C CA . VAL B 1 56 ? -44.391 27.231 -29.245 1.00 8.58 ? 144 VAL B CA 1 ATOM 3265 C C . VAL B 1 56 ? -44.710 25.730 -29.270 1.00 9.70 ? 144 VAL B C 1 ATOM 3266 O O . VAL B 1 56 ? -44.438 25.018 -28.304 1.00 8.71 ? 144 VAL B O 1 ATOM 3267 C CB . VAL B 1 56 ? -45.675 28.089 -29.111 1.00 8.43 ? 144 VAL B CB 1 ATOM 3268 C CG1 . VAL B 1 56 ? -46.596 27.559 -28.020 1.00 9.05 ? 144 VAL B CG1 1 ATOM 3269 C CG2 . VAL B 1 56 ? -45.367 29.577 -28.848 1.00 8.47 ? 144 VAL B CG2 1 ATOM 3270 N N . ASP B 1 57 ? -45.310 25.252 -30.351 1.00 8.99 ? 145 ASP B N 1 ATOM 3271 C CA . ASP B 1 57 ? -45.654 23.829 -30.390 1.00 11.22 ? 145 ASP B CA 1 ATOM 3272 C C . ASP B 1 57 ? -44.512 22.939 -30.870 1.00 12.07 ? 145 ASP B C 1 ATOM 3273 O O . ASP B 1 57 ? -44.700 21.725 -30.972 1.00 12.92 ? 145 ASP B O 1 ATOM 3274 C CB . ASP B 1 57 ? -46.874 23.605 -31.211 1.00 12.11 ? 145 ASP B CB 1 ATOM 3275 C CG . ASP B 1 57 ? -48.100 23.584 -30.370 1.00 16.20 ? 145 ASP B CG 1 ATOM 3276 O OD1 . ASP B 1 57 ? -48.229 22.642 -29.523 1.00 20.72 ? 145 ASP B OD1 1 ATOM 3277 O OD2 . ASP B 1 57 ? -48.982 24.445 -30.462 1.00 18.08 ? 145 ASP B OD2 1 ATOM 3278 N N . THR B 1 58 ? -43.349 23.520 -31.182 1.00 10.71 ? 146 THR B N 1 ATOM 3279 C CA . THR B 1 58 ? -42.211 22.709 -31.612 1.00 10.93 ? 146 THR B CA 1 ATOM 3280 C C . THR B 1 58 ? -41.068 22.739 -30.582 1.00 10.32 ? 146 THR B C 1 ATOM 3281 O O . THR B 1 58 ? -40.933 21.831 -29.767 1.00 10.69 ? 146 THR B O 1 ATOM 3282 C CB . THR B 1 58 ? -41.707 23.185 -32.985 1.00 11.53 ? 146 THR B CB 1 ATOM 3283 O OG1 . THR B 1 58 ? -41.482 24.620 -32.975 1.00 13.27 ? 146 THR B OG1 1 ATOM 3284 C CG2 . THR B 1 58 ? -42.771 22.905 -34.076 1.00 14.99 ? 146 THR B CG2 1 ATOM 3285 N N . LEU B 1 59 ? -40.270 23.803 -30.622 1.00 9.40 ? 147 LEU B N 1 ATOM 3286 C CA . LEU B 1 59 ? -39.060 23.903 -29.801 1.00 9.64 ? 147 LEU B CA 1 ATOM 3287 C C . LEU B 1 59 ? -39.324 23.995 -28.305 1.00 9.29 ? 147 LEU B C 1 ATOM 3288 O O . LEU B 1 59 ? -38.534 23.471 -27.508 1.00 9.80 ? 147 LEU B O 1 ATOM 3289 C CB . LEU B 1 59 ? -38.260 25.079 -30.244 1.00 9.25 ? 147 LEU B CB 1 ATOM 3290 C CG . LEU B 1 59 ? -37.974 25.169 -31.732 1.00 14.09 ? 147 LEU B CG 1 ATOM 3291 C CD1 . LEU B 1 59 ? -36.948 26.247 -31.979 1.00 18.14 ? 147 LEU B CD1 1 ATOM 3292 C CD2 . LEU B 1 59 ? -37.474 23.824 -32.311 1.00 17.49 ? 147 LEU B CD2 1 ATOM 3293 N N . LEU B 1 60 ? -40.426 24.635 -27.893 1.00 8.27 ? 148 LEU B N 1 ATOM 3294 C CA . LEU B 1 60 ? -40.762 24.724 -26.468 1.00 8.54 ? 148 LEU B CA 1 ATOM 3295 C C . LEU B 1 60 ? -41.127 23.339 -25.928 1.00 8.95 ? 148 LEU B C 1 ATOM 3296 O O . LEU B 1 60 ? -40.620 22.905 -24.910 1.00 8.03 ? 148 LEU B O 1 ATOM 3297 C CB . LEU B 1 60 ? -41.879 25.758 -26.219 1.00 9.24 ? 148 LEU B CB 1 ATOM 3298 C CG . LEU B 1 60 ? -42.471 25.790 -24.807 1.00 9.13 ? 148 LEU B CG 1 ATOM 3299 C CD1 . LEU B 1 60 ? -41.385 26.283 -23.861 1.00 9.83 ? 148 LEU B CD1 1 ATOM 3300 C CD2 . LEU B 1 60 ? -43.739 26.664 -24.762 1.00 8.94 ? 148 LEU B CD2 1 ATOM 3301 N N . VAL B 1 61 ? -42.015 22.643 -26.630 1.00 7.83 ? 149 VAL B N 1 ATOM 3302 C CA . VAL B 1 61 ? -42.400 21.303 -26.282 1.00 7.48 ? 149 VAL B CA 1 ATOM 3303 C C . VAL B 1 61 ? -41.172 20.372 -26.289 1.00 6.82 ? 149 VAL B C 1 ATOM 3304 O O . VAL B 1 61 ? -40.963 19.604 -25.315 1.00 6.75 ? 149 VAL B O 1 ATOM 3305 C CB . VAL B 1 61 ? -43.499 20.801 -27.221 1.00 7.45 ? 149 VAL B CB 1 ATOM 3306 C CG1 . VAL B 1 61 ? -43.813 19.345 -26.951 1.00 10.03 ? 149 VAL B CG1 1 ATOM 3307 C CG2 . VAL B 1 61 ? -44.729 21.635 -26.982 1.00 8.22 ? 149 VAL B CG2 1 ATOM 3308 N N . GLN B 1 62 ? -40.324 20.473 -27.287 0.50 6.41 ? 150 GLN B N 1 ATOM 3309 C CA . GLN B 1 62 ? -39.179 19.601 -27.321 0.50 6.90 ? 150 GLN B CA 1 ATOM 3310 C C . GLN B 1 62 ? -38.267 19.788 -26.107 0.50 6.23 ? 150 GLN B C 1 ATOM 3311 O O . GLN B 1 62 ? -37.851 18.844 -25.490 0.50 2.85 ? 150 GLN B O 1 ATOM 3312 C CB A GLN B 1 62 ? -38.363 19.815 -28.579 0.50 8.76 ? 150 GLN B CB 1 ATOM 3313 C CB B GLN B 1 62 ? -38.389 19.819 -28.612 0.50 8.86 ? 150 GLN B CB 1 ATOM 3314 C CG A GLN B 1 62 ? -37.031 19.092 -28.460 0.50 10.56 ? 150 GLN B CG 1 ATOM 3315 C CG B GLN B 1 62 ? -37.197 18.859 -28.776 0.50 11.29 ? 150 GLN B CG 1 ATOM 3316 C CD A GLN B 1 62 ? -36.092 19.399 -29.570 0.50 13.19 ? 150 GLN B CD 1 ATOM 3317 C CD B GLN B 1 62 ? -37.614 17.388 -28.819 0.50 14.18 ? 150 GLN B CD 1 ATOM 3318 O OE1 A GLN B 1 62 ? -36.518 19.563 -30.706 0.50 14.34 ? 150 GLN B OE1 1 ATOM 3319 O OE1 B GLN B 1 62 ? -38.705 17.057 -29.298 0.50 17.08 ? 150 GLN B OE1 1 ATOM 3320 N NE2 A GLN B 1 62 ? -34.784 19.443 -29.258 0.50 16.99 ? 150 GLN B NE2 1 ATOM 3321 N NE2 B GLN B 1 62 ? -36.754 16.500 -28.300 0.50 15.90 ? 150 GLN B NE2 1 ATOM 3322 N N . THR B 1 63 ? -37.896 21.028 -25.821 1.00 7.10 ? 151 THR B N 1 ATOM 3323 C CA . THR B 1 63 ? -37.090 21.320 -24.602 1.00 7.13 ? 151 THR B CA 1 ATOM 3324 C C . THR B 1 63 ? -37.735 20.816 -23.314 1.00 7.14 ? 151 THR B C 1 ATOM 3325 O O . THR B 1 63 ? -37.090 20.182 -22.475 1.00 6.46 ? 151 THR B O 1 ATOM 3326 C CB . THR B 1 63 ? -36.821 22.791 -24.505 1.00 8.64 ? 151 THR B CB 1 ATOM 3327 O OG1 . THR B 1 63 ? -35.893 23.117 -25.551 1.00 12.14 ? 151 THR B OG1 1 ATOM 3328 C CG2 . THR B 1 63 ? -36.120 23.126 -23.213 1.00 9.57 ? 151 THR B CG2 1 ATOM 3329 N N . LEU B 1 64 ? -39.001 21.106 -23.117 1.00 7.07 ? 152 LEU B N 1 ATOM 3330 C CA . LEU B 1 64 ? -39.685 20.662 -21.877 1.00 6.81 ? 152 LEU B CA 1 ATOM 3331 C C . LEU B 1 64 ? -39.726 19.126 -21.800 1.00 6.99 ? 152 LEU B C 1 ATOM 3332 O O . LEU B 1 64 ? -39.538 18.544 -20.737 1.00 8.00 ? 152 LEU B O 1 ATOM 3333 C CB . LEU B 1 64 ? -41.075 21.274 -21.813 1.00 7.64 ? 152 LEU B CB 1 ATOM 3334 C CG . LEU B 1 64 ? -41.103 22.783 -21.614 1.00 7.78 ? 152 LEU B CG 1 ATOM 3335 C CD1 . LEU B 1 64 ? -42.560 23.245 -21.616 1.00 7.24 ? 152 LEU B CD1 1 ATOM 3336 C CD2 . LEU B 1 64 ? -40.449 23.203 -20.292 1.00 8.38 ? 152 LEU B CD2 1 ATOM 3337 N N . SER B 1 65 ? -39.874 18.472 -22.943 1.00 7.02 ? 153 SER B N 1 ATOM 3338 C CA . SER B 1 65 ? -39.962 17.030 -23.006 1.00 7.75 ? 153 SER B CA 1 ATOM 3339 C C . SER B 1 65 ? -38.613 16.443 -22.603 1.00 7.15 ? 153 SER B C 1 ATOM 3340 O O . SER B 1 65 ? -38.532 15.484 -21.826 1.00 7.08 ? 153 SER B O 1 ATOM 3341 C CB . SER B 1 65 ? -40.361 16.572 -24.420 1.00 8.09 ? 153 SER B CB 1 ATOM 3342 O OG . SER B 1 65 ? -41.699 16.955 -24.669 1.00 12.96 ? 153 SER B OG 1 ATOM 3343 N N . GLU B 1 66 ? -37.568 17.056 -23.099 1.00 7.07 ? 154 GLU B N 1 ATOM 3344 C CA . GLU B 1 66 ? -36.213 16.621 -22.770 1.00 7.24 ? 154 GLU B CA 1 ATOM 3345 C C . GLU B 1 66 ? -35.903 16.742 -21.288 1.00 5.41 ? 154 GLU B C 1 ATOM 3346 O O . GLU B 1 66 ? -35.302 15.825 -20.709 1.00 6.43 ? 154 GLU B O 1 ATOM 3347 C CB . GLU B 1 66 ? -35.176 17.394 -23.596 1.00 7.99 ? 154 GLU B CB 1 ATOM 3348 C CG . GLU B 1 66 ? -35.176 16.980 -25.074 1.00 9.90 ? 154 GLU B CG 1 ATOM 3349 C CD . GLU B 1 66 ? -34.414 17.929 -25.949 1.00 11.68 ? 154 GLU B CD 1 ATOM 3350 O OE1 . GLU B 1 66 ? -33.816 18.903 -25.420 1.00 11.74 ? 154 GLU B OE1 1 ATOM 3351 O OE2 . GLU B 1 66 ? -34.398 17.691 -27.177 1.00 14.12 ? 154 GLU B OE2 1 ATOM 3352 N N . ILE B 1 67 ? -36.281 17.879 -20.692 1.00 5.39 ? 155 ILE B N 1 ATOM 3353 C CA . ILE B 1 67 ? -36.032 18.134 -19.285 1.00 4.70 ? 155 ILE B CA 1 ATOM 3354 C C . ILE B 1 67 ? -36.825 17.114 -18.469 1.00 4.75 ? 155 ILE B C 1 ATOM 3355 O O . ILE B 1 67 ? -36.294 16.524 -17.543 1.00 4.30 ? 155 ILE B O 1 ATOM 3356 C CB . ILE B 1 67 ? -36.361 19.571 -18.921 1.00 5.57 ? 155 ILE B CB 1 ATOM 3357 C CG1 . ILE B 1 67 ? -35.360 20.543 -19.496 1.00 7.43 ? 155 ILE B CG1 1 ATOM 3358 C CG2 . ILE B 1 67 ? -36.444 19.721 -17.400 1.00 5.70 ? 155 ILE B CG2 1 ATOM 3359 C CD1 . ILE B 1 67 ? -35.895 21.970 -19.543 1.00 7.04 ? 155 ILE B CD1 1 ATOM 3360 N N . ARG B 1 68 ? -38.102 16.917 -18.807 1.00 5.44 ? 156 ARG B N 1 ATOM 3361 C CA . ARG B 1 68 ? -38.885 15.895 -18.122 1.00 4.50 ? 156 ARG B CA 1 ATOM 3362 C C . ARG B 1 68 ? -38.175 14.546 -18.132 1.00 5.18 ? 156 ARG B C 1 ATOM 3363 O O . ARG B 1 68 ? -38.094 13.869 -17.091 1.00 4.81 ? 156 ARG B O 1 ATOM 3364 C CB . ARG B 1 68 ? -40.270 15.725 -18.736 1.00 5.17 ? 156 ARG B CB 1 ATOM 3365 C CG . ARG B 1 68 ? -41.044 14.552 -18.233 1.00 5.05 ? 156 ARG B CG 1 ATOM 3366 C CD . ARG B 1 68 ? -42.458 14.457 -18.880 1.00 5.53 ? 156 ARG B CD 1 ATOM 3367 N NE . ARG B 1 68 ? -43.365 15.485 -18.370 1.00 4.97 ? 156 ARG B NE 1 ATOM 3368 C CZ . ARG B 1 68 ? -44.541 15.770 -18.900 1.00 9.29 ? 156 ARG B CZ 1 ATOM 3369 N NH1 . ARG B 1 68 ? -44.933 15.185 -20.025 1.00 6.70 ? 156 ARG B NH1 1 ATOM 3370 N NH2 . ARG B 1 68 ? -45.328 16.662 -18.318 1.00 7.41 ? 156 ARG B NH2 1 ATOM 3371 N N . GLU B 1 69 ? -37.672 14.125 -19.304 1.00 5.63 ? 157 GLU B N 1 ATOM 3372 C CA . GLU B 1 69 ? -37.021 12.799 -19.366 1.00 6.09 ? 157 GLU B CA 1 ATOM 3373 C C . GLU B 1 69 ? -35.818 12.732 -18.442 1.00 5.17 ? 157 GLU B C 1 ATOM 3374 O O . GLU B 1 69 ? -35.575 11.727 -17.795 1.00 6.16 ? 157 GLU B O 1 ATOM 3375 C CB . GLU B 1 69 ? -36.580 12.497 -20.799 1.00 8.39 ? 157 GLU B CB 1 ATOM 3376 C CG . GLU B 1 69 ? -37.621 11.847 -21.676 0.50 11.63 ? 157 GLU B CG 1 ATOM 3377 C CD . GLU B 1 69 ? -36.965 10.994 -22.748 0.50 16.07 ? 157 GLU B CD 1 ATOM 3378 O OE1 . GLU B 1 69 ? -36.257 10.023 -22.385 0.50 20.20 ? 157 GLU B OE1 1 ATOM 3379 O OE2 . GLU B 1 69 ? -37.156 11.306 -23.937 0.50 16.29 ? 157 GLU B OE2 1 ATOM 3380 N N . ALA B 1 70 ? -34.995 13.783 -18.483 1.00 6.60 ? 158 ALA B N 1 ATOM 3381 C CA . ALA B 1 70 ? -33.770 13.844 -17.701 1.00 5.35 ? 158 ALA B CA 1 ATOM 3382 C C . ALA B 1 70 ? -34.131 13.794 -16.196 1.00 6.16 ? 158 ALA B C 1 ATOM 3383 O O . ALA B 1 70 ? -33.505 13.095 -15.423 1.00 4.99 ? 158 ALA B O 1 ATOM 3384 C CB . ALA B 1 70 ? -33.001 15.063 -18.079 1.00 6.36 ? 158 ALA B CB 1 ATOM 3385 N N . ASN B 1 71 ? -35.185 14.484 -15.812 1.00 5.40 ? 159 ASN B N 1 ATOM 3386 C CA . ASN B 1 71 ? -35.579 14.539 -14.413 1.00 6.52 ? 159 ASN B CA 1 ATOM 3387 C C . ASN B 1 71 ? -36.187 13.217 -13.946 1.00 6.84 ? 159 ASN B C 1 ATOM 3388 O O . ASN B 1 71 ? -35.896 12.742 -12.838 1.00 6.36 ? 159 ASN B O 1 ATOM 3389 C CB . ASN B 1 71 ? -36.532 15.725 -14.189 1.00 6.71 ? 159 ASN B CB 1 ATOM 3390 C CG . ASN B 1 71 ? -35.830 17.052 -14.259 1.00 7.80 ? 159 ASN B CG 1 ATOM 3391 O OD1 . ASN B 1 71 ? -34.584 17.130 -14.217 1.00 8.03 ? 159 ASN B OD1 1 ATOM 3392 N ND2 . ASN B 1 71 ? -36.617 18.115 -14.344 1.00 8.47 ? 159 ASN B ND2 1 ATOM 3393 N N . GLN B 1 72 ? -36.992 12.589 -14.781 1.00 6.27 ? 160 GLN B N 1 ATOM 3394 C CA . GLN B 1 72 ? -37.498 11.278 -14.431 1.00 6.49 ? 160 GLN B CA 1 ATOM 3395 C C . GLN B 1 72 ? -36.395 10.230 -14.286 1.00 6.51 ? 160 GLN B C 1 ATOM 3396 O O . GLN B 1 72 ? -36.547 9.285 -13.520 1.00 6.26 ? 160 GLN B O 1 ATOM 3397 C CB . GLN B 1 72 ? -38.497 10.793 -15.472 1.00 6.71 ? 160 GLN B CB 1 ATOM 3398 C CG . GLN B 1 72 ? -39.762 11.592 -15.530 1.00 6.88 ? 160 GLN B CG 1 ATOM 3399 C CD . GLN B 1 72 ? -40.601 11.220 -16.705 1.00 10.03 ? 160 GLN B CD 1 ATOM 3400 O OE1 . GLN B 1 72 ? -40.062 10.878 -17.776 1.00 10.58 ? 160 GLN B OE1 1 ATOM 3401 N NE2 . GLN B 1 72 ? -41.923 11.312 -16.548 1.00 8.07 ? 160 GLN B NE2 1 ATOM 3402 N N . ALA B 1 73 ? -35.289 10.408 -15.008 1.00 6.80 ? 161 ALA B N 1 ATOM 3403 C CA . ALA B 1 73 ? -34.129 9.503 -14.913 1.00 8.55 ? 161 ALA B CA 1 ATOM 3404 C C . ALA B 1 73 ? -33.290 9.729 -13.652 1.00 9.02 ? 161 ALA B C 1 ATOM 3405 O O . ALA B 1 73 ? -32.432 8.884 -13.282 1.00 10.98 ? 161 ALA B O 1 ATOM 3406 C CB . ALA B 1 73 ? -33.279 9.630 -16.165 1.00 8.59 ? 161 ALA B CB 1 ATOM 3407 N N . GLY B 1 74 ? -33.593 10.792 -12.920 1.00 8.93 ? 162 GLY B N 1 ATOM 3408 C CA . GLY B 1 74 ? -32.974 11.045 -11.644 1.00 9.58 ? 162 GLY B CA 1 ATOM 3409 C C . GLY B 1 74 ? -32.063 12.243 -11.497 1.00 9.50 ? 162 GLY B C 1 ATOM 3410 O O . GLY B 1 74 ? -31.359 12.350 -10.497 1.00 9.06 ? 162 GLY B O 1 ATOM 3411 N N . ALA B 1 75 ? -32.091 13.167 -12.454 1.00 10.12 ? 163 ALA B N 1 ATOM 3412 C CA . ALA B 1 75 ? -31.212 14.334 -12.385 1.00 10.62 ? 163 ALA B CA 1 ATOM 3413 C C . ALA B 1 75 ? -31.380 15.000 -11.037 1.00 10.67 ? 163 ALA B C 1 ATOM 3414 O O . ALA B 1 75 ? -32.505 15.269 -10.605 1.00 11.06 ? 163 ALA B O 1 ATOM 3415 C CB . ALA B 1 75 ? -31.476 15.335 -13.517 1.00 11.12 ? 163 ALA B CB 1 ATOM 3416 N N . ASN B 1 76 ? -30.252 15.272 -10.385 1.00 11.15 ? 164 ASN B N 1 ATOM 3417 C CA . ASN B 1 76 ? -30.278 15.831 -9.055 1.00 13.01 ? 164 ASN B CA 1 ATOM 3418 C C . ASN B 1 76 ? -29.104 16.828 -8.949 1.00 14.22 ? 164 ASN B C 1 ATOM 3419 O O . ASN B 1 76 ? -27.967 16.409 -9.104 1.00 14.93 ? 164 ASN B O 1 ATOM 3420 C CB . ASN B 1 76 ? -30.158 14.683 -8.054 1.00 13.32 ? 164 ASN B CB 1 ATOM 3421 C CG . ASN B 1 76 ? -30.219 15.137 -6.620 1.00 14.97 ? 164 ASN B CG 1 ATOM 3422 O OD1 . ASN B 1 76 ? -30.396 16.315 -6.332 1.00 18.01 ? 164 ASN B OD1 1 ATOM 3423 N ND2 . ASN B 1 76 ? -30.079 14.183 -5.699 1.00 13.86 ? 164 ASN B ND2 1 ATOM 3424 N N . PRO B 1 77 ? -29.351 18.134 -8.790 1.00 14.01 ? 165 PRO B N 1 ATOM 3425 C CA . PRO B 1 77 ? -30.683 18.737 -8.776 1.00 13.61 ? 165 PRO B CA 1 ATOM 3426 C C . PRO B 1 77 ? -31.424 18.563 -10.117 1.00 11.08 ? 165 PRO B C 1 ATOM 3427 O O . PRO B 1 77 ? -30.808 18.395 -11.197 1.00 11.35 ? 165 PRO B O 1 ATOM 3428 C CB . PRO B 1 77 ? -30.401 20.243 -8.554 1.00 13.33 ? 165 PRO B CB 1 ATOM 3429 C CG . PRO B 1 77 ? -28.964 20.331 -8.209 1.00 16.50 ? 165 PRO B CG 1 ATOM 3430 C CD . PRO B 1 77 ? -28.279 19.136 -8.670 1.00 14.65 ? 165 PRO B CD 1 ATOM 3431 N N . GLN B 1 78 ? -32.737 18.600 -10.036 1.00 9.74 ? 166 GLN B N 1 ATOM 3432 C CA . GLN B 1 78 ? -33.581 18.630 -11.241 1.00 9.80 ? 166 GLN B CA 1 ATOM 3433 C C . GLN B 1 78 ? -33.198 19.788 -12.159 1.00 7.59 ? 166 GLN B C 1 ATOM 3434 O O . GLN B 1 78 ? -32.806 20.874 -11.705 1.00 7.26 ? 166 GLN B O 1 ATOM 3435 C CB . GLN B 1 78 ? -35.053 18.809 -10.847 1.00 10.45 ? 166 GLN B CB 1 ATOM 3436 C CG . GLN B 1 78 ? -35.383 20.205 -10.212 1.00 14.82 ? 166 GLN B CG 1 ATOM 3437 C CD . GLN B 1 78 ? -36.814 20.313 -9.622 1.00 19.73 ? 166 GLN B CD 1 ATOM 3438 O OE1 . GLN B 1 78 ? -37.815 20.267 -10.365 1.00 21.44 ? 166 GLN B OE1 1 ATOM 3439 N NE2 . GLN B 1 78 ? -36.899 20.464 -8.297 1.00 18.63 ? 166 GLN B NE2 1 ATOM 3440 N N . TYR B 1 79 ? -33.408 19.577 -13.452 1.00 6.70 ? 167 TYR B N 1 ATOM 3441 C CA . TYR B 1 79 ? -33.241 20.608 -14.444 1.00 6.39 ? 167 TYR B CA 1 ATOM 3442 C C . TYR B 1 79 ? -34.452 21.518 -14.496 1.00 6.11 ? 167 TYR B C 1 ATOM 3443 O O . TYR B 1 79 ? -35.587 21.047 -14.352 1.00 6.62 ? 167 TYR B O 1 ATOM 3444 C CB . TYR B 1 79 ? -33.027 20.006 -15.819 1.00 7.16 ? 167 TYR B CB 1 ATOM 3445 C CG . TYR B 1 79 ? -31.646 19.439 -16.003 1.00 6.00 ? 167 TYR B CG 1 ATOM 3446 C CD1 . TYR B 1 79 ? -30.555 20.266 -16.241 1.00 9.20 ? 167 TYR B CD1 1 ATOM 3447 C CD2 . TYR B 1 79 ? -31.439 18.076 -15.933 1.00 7.76 ? 167 TYR B CD2 1 ATOM 3448 C CE1 . TYR B 1 79 ? -29.255 19.723 -16.381 1.00 9.07 ? 167 TYR B CE1 1 ATOM 3449 C CE2 . TYR B 1 79 ? -30.142 17.519 -16.057 1.00 9.16 ? 167 TYR B CE2 1 ATOM 3450 C CZ . TYR B 1 79 ? -29.074 18.355 -16.306 1.00 9.15 ? 167 TYR B CZ 1 ATOM 3451 O OH . TYR B 1 79 ? -27.826 17.801 -16.458 1.00 8.73 ? 167 TYR B OH 1 ATOM 3452 N N . ALA B 1 80 ? -34.186 22.793 -14.756 1.00 6.70 ? 168 ALA B N 1 ATOM 3453 C CA . ALA B 1 80 ? -35.215 23.818 -14.984 1.00 7.27 ? 168 ALA B CA 1 ATOM 3454 C C . ALA B 1 80 ? -35.054 24.501 -16.347 1.00 7.71 ? 168 ALA B C 1 ATOM 3455 O O . ALA B 1 80 ? -33.946 24.643 -16.860 1.00 6.93 ? 168 ALA B O 1 ATOM 3456 C CB . ALA B 1 80 ? -35.147 24.860 -13.898 1.00 7.78 ? 168 ALA B CB 1 ATOM 3457 N N . ALA B 1 81 ? -36.172 24.953 -16.891 1.00 7.73 ? 169 ALA B N 1 ATOM 3458 C CA . ALA B 1 81 ? -36.209 25.596 -18.212 1.00 7.74 ? 169 ALA B CA 1 ATOM 3459 C C . ALA B 1 81 ? -36.083 27.108 -18.063 1.00 7.43 ? 169 ALA B C 1 ATOM 3460 O O . ALA B 1 81 ? -36.585 27.671 -17.108 1.00 6.66 ? 169 ALA B O 1 ATOM 3461 C CB . ALA B 1 81 ? -37.480 25.258 -18.916 1.00 8.21 ? 169 ALA B CB 1 ATOM 3462 N N . GLN B 1 82 ? -35.438 27.752 -19.042 1.00 7.50 ? 170 GLN B N 1 ATOM 3463 C CA . GLN B 1 82 ? -35.328 29.224 -19.093 1.00 7.43 ? 170 GLN B CA 1 ATOM 3464 C C . GLN B 1 82 ? -35.838 29.672 -20.444 1.00 6.91 ? 170 GLN B C 1 ATOM 3465 O O . GLN B 1 82 ? -35.250 29.304 -21.468 1.00 8.49 ? 170 GLN B O 1 ATOM 3466 C CB . GLN B 1 82 ? -33.859 29.646 -18.968 1.00 7.67 ? 170 GLN B CB 1 ATOM 3467 C CG . GLN B 1 82 ? -33.252 29.448 -17.573 1.00 8.32 ? 170 GLN B CG 1 ATOM 3468 C CD . GLN B 1 82 ? -31.781 29.734 -17.588 1.00 10.39 ? 170 GLN B CD 1 ATOM 3469 O OE1 . GLN B 1 82 ? -31.330 30.757 -17.034 1.00 8.29 ? 170 GLN B OE1 1 ATOM 3470 N NE2 . GLN B 1 82 ? -31.019 28.875 -18.265 1.00 8.91 ? 170 GLN B NE2 1 ATOM 3471 N N . ILE B 1 83 ? -36.915 30.423 -20.466 1.00 7.02 ? 171 ILE B N 1 ATOM 3472 C CA . ILE B 1 83 ? -37.608 30.756 -21.713 1.00 6.64 ? 171 ILE B CA 1 ATOM 3473 C C . ILE B 1 83 ? -37.870 32.259 -21.797 1.00 7.08 ? 171 ILE B C 1 ATOM 3474 O O . ILE B 1 83 ? -38.292 32.863 -20.805 1.00 6.29 ? 171 ILE B O 1 ATOM 3475 C CB . ILE B 1 83 ? -38.964 29.997 -21.764 1.00 7.64 ? 171 ILE B CB 1 ATOM 3476 C CG1 . ILE B 1 83 ? -38.767 28.464 -21.631 1.00 9.94 ? 171 ILE B CG1 1 ATOM 3477 C CG2 . ILE B 1 83 ? -39.685 30.306 -23.050 1.00 10.99 ? 171 ILE B CG2 1 ATOM 3478 C CD1 . ILE B 1 83 ? -37.889 27.784 -22.652 1.00 13.06 ? 171 ILE B CD1 1 ATOM 3479 N N . VAL B 1 84 ? -37.650 32.853 -22.968 1.00 5.53 ? 172 VAL B N 1 ATOM 3480 C CA . VAL B 1 84 ? -38.039 34.250 -23.204 1.00 6.49 ? 172 VAL B CA 1 ATOM 3481 C C . VAL B 1 84 ? -39.327 34.272 -24.021 1.00 6.78 ? 172 VAL B C 1 ATOM 3482 O O . VAL B 1 84 ? -39.410 33.644 -25.108 1.00 6.62 ? 172 VAL B O 1 ATOM 3483 C CB . VAL B 1 84 ? -36.975 35.072 -23.924 1.00 7.76 ? 172 VAL B CB 1 ATOM 3484 C CG1 . VAL B 1 84 ? -37.369 36.525 -23.919 1.00 7.81 ? 172 VAL B CG1 1 ATOM 3485 C CG2 . VAL B 1 84 ? -35.582 34.859 -23.283 1.00 7.17 ? 172 VAL B CG2 1 ATOM 3486 N N . VAL B 1 85 ? -40.296 35.049 -23.554 1.00 7.42 ? 173 VAL B N 1 ATOM 3487 C CA . VAL B 1 85 ? -41.520 35.336 -24.299 1.00 7.33 ? 173 VAL B CA 1 ATOM 3488 C C . VAL B 1 85 ? -41.246 36.607 -25.095 1.00 6.74 ? 173 VAL B C 1 ATOM 3489 O O . VAL B 1 85 ? -40.949 37.643 -24.507 1.00 8.29 ? 173 VAL B O 1 ATOM 3490 C CB . VAL B 1 85 ? -42.730 35.515 -23.354 1.00 6.92 ? 173 VAL B CB 1 ATOM 3491 C CG1 . VAL B 1 85 ? -43.984 35.777 -24.139 1.00 8.16 ? 173 VAL B CG1 1 ATOM 3492 C CG2 . VAL B 1 85 ? -42.988 34.247 -22.522 1.00 8.57 ? 173 VAL B CG2 1 ATOM 3493 N N . TYR B 1 86 ? -41.267 36.522 -26.429 1.00 7.17 ? 174 TYR B N 1 ATOM 3494 C CA . TYR B 1 86 ? -40.823 37.648 -27.268 1.00 7.08 ? 174 TYR B CA 1 ATOM 3495 C C . TYR B 1 86 ? -41.523 37.702 -28.622 1.00 6.48 ? 174 TYR B C 1 ATOM 3496 O O . TYR B 1 86 ? -40.933 37.418 -29.655 1.00 7.47 ? 174 TYR B O 1 ATOM 3497 C CB . TYR B 1 86 ? -39.317 37.537 -27.492 1.00 6.66 ? 174 TYR B CB 1 ATOM 3498 C CG . TYR B 1 86 ? -38.681 38.734 -28.155 1.00 8.78 ? 174 TYR B CG 1 ATOM 3499 C CD1 . TYR B 1 86 ? -38.792 39.996 -27.580 1.00 9.72 ? 174 TYR B CD1 1 ATOM 3500 C CD2 . TYR B 1 86 ? -37.956 38.606 -29.337 1.00 7.08 ? 174 TYR B CD2 1 ATOM 3501 C CE1 . TYR B 1 86 ? -38.184 41.137 -28.175 1.00 8.41 ? 174 TYR B CE1 1 ATOM 3502 C CE2 . TYR B 1 86 ? -37.362 39.704 -29.944 1.00 8.38 ? 174 TYR B CE2 1 ATOM 3503 C CZ . TYR B 1 86 ? -37.461 40.950 -29.353 1.00 7.24 ? 174 TYR B CZ 1 ATOM 3504 O OH . TYR B 1 86 ? -36.922 42.031 -29.973 1.00 9.12 ? 174 TYR B OH 1 ATOM 3505 N N . ASP B 1 87 ? -42.793 38.080 -28.629 1.00 7.11 ? 175 ASP B N 1 ATOM 3506 C CA . ASP B 1 87 ? -43.488 38.143 -29.902 1.00 6.87 ? 175 ASP B CA 1 ATOM 3507 C C . ASP B 1 87 ? -44.636 39.126 -29.836 1.00 6.48 ? 175 ASP B C 1 ATOM 3508 O O . ASP B 1 87 ? -45.688 38.935 -30.484 1.00 6.63 ? 175 ASP B O 1 ATOM 3509 C CB . ASP B 1 87 ? -43.923 36.742 -30.321 1.00 7.54 ? 175 ASP B CB 1 ATOM 3510 C CG . ASP B 1 87 ? -44.176 36.600 -31.805 1.00 8.35 ? 175 ASP B CG 1 ATOM 3511 O OD1 . ASP B 1 87 ? -43.799 37.499 -32.612 1.00 8.65 ? 175 ASP B OD1 1 ATOM 3512 O OD2 . ASP B 1 87 ? -44.777 35.578 -32.248 1.00 8.81 ? 175 ASP B OD2 1 ATOM 3513 N N . LEU B 1 88 ? -44.445 40.217 -29.087 1.00 6.46 ? 176 LEU B N 1 ATOM 3514 C CA . LEU B 1 88 ? -45.457 41.261 -29.072 1.00 7.06 ? 176 LEU B CA 1 ATOM 3515 C C . LEU B 1 88 ? -45.744 41.730 -30.511 1.00 7.29 ? 176 LEU B C 1 ATOM 3516 O O . LEU B 1 88 ? -44.816 41.816 -31.342 1.00 6.63 ? 176 LEU B O 1 ATOM 3517 C CB . LEU B 1 88 ? -45.031 42.450 -28.195 1.00 6.89 ? 176 LEU B CB 1 ATOM 3518 C CG . LEU B 1 88 ? -45.287 42.294 -26.686 1.00 6.87 ? 176 LEU B CG 1 ATOM 3519 C CD1 . LEU B 1 88 ? -44.511 43.343 -25.880 1.00 10.58 ? 176 LEU B CD1 1 ATOM 3520 C CD2 . LEU B 1 88 ? -46.796 42.286 -26.353 1.00 7.64 ? 176 LEU B CD2 1 ATOM 3521 N N . PRO B 1 89 ? -46.975 42.142 -30.799 1.00 6.86 ? 177 PRO B N 1 ATOM 3522 C CA . PRO B 1 89 ? -47.204 42.815 -32.081 1.00 7.33 ? 177 PRO B CA 1 ATOM 3523 C C . PRO B 1 89 ? -46.566 44.228 -32.027 1.00 8.66 ? 177 PRO B C 1 ATOM 3524 O O . PRO B 1 89 ? -46.497 44.849 -30.945 1.00 8.32 ? 177 PRO B O 1 ATOM 3525 C CB . PRO B 1 89 ? -48.724 42.861 -32.175 1.00 7.57 ? 177 PRO B CB 1 ATOM 3526 C CG . PRO B 1 89 ? -49.156 43.018 -30.752 1.00 8.12 ? 177 PRO B CG 1 ATOM 3527 C CD . PRO B 1 89 ? -48.193 42.192 -29.961 1.00 7.83 ? 177 PRO B CD 1 ATOM 3528 N N . ASP B 1 90 ? -46.052 44.713 -33.169 1.00 7.97 ? 178 ASP B N 1 ATOM 3529 C CA . ASP B 1 90 ? -45.321 45.980 -33.228 1.00 8.40 ? 178 ASP B CA 1 ATOM 3530 C C . ASP B 1 90 ? -44.149 45.907 -32.245 1.00 7.45 ? 178 ASP B C 1 ATOM 3531 O O . ASP B 1 90 ? -43.927 46.807 -31.430 1.00 8.43 ? 178 ASP B O 1 ATOM 3532 C CB . ASP B 1 90 ? -46.204 47.200 -32.945 1.00 7.80 ? 178 ASP B CB 1 ATOM 3533 C CG . ASP B 1 90 ? -47.164 47.537 -34.096 1.00 11.46 ? 178 ASP B CG 1 ATOM 3534 O OD1 . ASP B 1 90 ? -47.448 46.678 -34.966 1.00 9.91 ? 178 ASP B OD1 1 ATOM 3535 O OD2 . ASP B 1 90 ? -47.687 48.664 -34.198 1.00 15.06 ? 178 ASP B OD2 1 ATOM 3536 N N . ARG B 1 91 ? -43.453 44.765 -32.275 1.00 7.65 ? 179 ARG B N 1 ATOM 3537 C CA . ARG B 1 91 ? -42.267 44.493 -31.480 1.00 8.53 ? 179 ARG B CA 1 ATOM 3538 C C . ARG B 1 91 ? -41.113 45.457 -31.802 1.00 8.37 ? 179 ARG B C 1 ATOM 3539 O O . ARG B 1 91 ? -41.053 46.029 -32.923 1.00 9.06 ? 179 ARG B O 1 ATOM 3540 C CB . ARG B 1 91 ? -41.810 43.055 -31.738 1.00 7.37 ? 179 ARG B CB 1 ATOM 3541 C CG . ARG B 1 91 ? -41.054 42.432 -30.606 1.00 8.14 ? 179 ARG B CG 1 ATOM 3542 C CD . ARG B 1 91 ? -40.733 40.943 -30.861 1.00 9.05 ? 179 ARG B CD 1 ATOM 3543 N NE . ARG B 1 91 ? -39.826 40.784 -32.007 1.00 8.59 ? 179 ARG B NE 1 ATOM 3544 C CZ . ARG B 1 91 ? -39.551 39.631 -32.610 1.00 8.08 ? 179 ARG B CZ 1 ATOM 3545 N NH1 . ARG B 1 91 ? -40.047 38.496 -32.167 1.00 6.38 ? 179 ARG B NH1 1 ATOM 3546 N NH2 . ARG B 1 91 ? -38.747 39.605 -33.655 1.00 9.36 ? 179 ARG B NH2 1 ATOM 3547 N N . ASP B 1 92 ? -40.290 45.693 -30.791 1.00 8.76 ? 180 ASP B N 1 ATOM 3548 C CA . ASP B 1 92 ? -39.016 46.432 -30.925 1.00 8.75 ? 180 ASP B CA 1 ATOM 3549 C C . ASP B 1 92 ? -39.342 47.816 -31.478 1.00 9.27 ? 180 ASP B C 1 ATOM 3550 O O . ASP B 1 92 ? -38.779 48.263 -32.485 1.00 9.68 ? 180 ASP B O 1 ATOM 3551 C CB . ASP B 1 92 ? -38.093 45.627 -31.826 1.00 9.40 ? 180 ASP B CB 1 ATOM 3552 C CG . ASP B 1 92 ? -36.679 46.104 -31.768 1.00 10.24 ? 180 ASP B CG 1 ATOM 3553 O OD1 . ASP B 1 92 ? -36.248 46.551 -30.670 1.00 9.63 ? 180 ASP B OD1 1 ATOM 3554 O OD2 . ASP B 1 92 ? -35.944 46.069 -32.763 1.00 13.01 ? 180 ASP B OD2 1 ATOM 3555 N N . CYS B 1 93 ? -40.303 48.484 -30.823 1.00 8.49 ? 181 CYS B N 1 ATOM 3556 C CA . CYS B 1 93 ? -40.965 49.645 -31.411 1.00 8.68 ? 181 CYS B CA 1 ATOM 3557 C C . CYS B 1 93 ? -40.042 50.840 -31.658 1.00 7.51 ? 181 CYS B C 1 ATOM 3558 O O . CYS B 1 93 ? -40.349 51.643 -32.532 1.00 8.75 ? 181 CYS B O 1 ATOM 3559 C CB . CYS B 1 93 ? -42.219 50.038 -30.593 1.00 8.97 ? 181 CYS B CB 1 ATOM 3560 S SG . CYS B 1 93 ? -41.830 50.633 -28.929 1.00 11.31 ? 181 CYS B SG 1 ATOM 3561 N N . ALA B 1 94 ? -38.913 50.934 -30.944 1.00 7.44 ? 182 ALA B N 1 ATOM 3562 C CA . ALA B 1 94 ? -37.953 52.027 -31.123 1.00 8.15 ? 182 ALA B CA 1 ATOM 3563 C C . ALA B 1 94 ? -36.829 51.756 -32.132 1.00 8.38 ? 182 ALA B C 1 ATOM 3564 O O . ALA B 1 94 ? -35.997 52.617 -32.345 1.00 11.67 ? 182 ALA B O 1 ATOM 3565 C CB . ALA B 1 94 ? -37.334 52.479 -29.766 1.00 8.33 ? 182 ALA B CB 1 ATOM 3566 N N . ALA B 1 95 ? -36.826 50.590 -32.753 1.00 8.58 ? 183 ALA B N 1 ATOM 3567 C CA . ALA B 1 95 ? -35.747 50.155 -33.665 1.00 8.86 ? 183 ALA B CA 1 ATOM 3568 C C . ALA B 1 95 ? -36.381 49.379 -34.831 1.00 9.53 ? 183 ALA B C 1 ATOM 3569 O O . ALA B 1 95 ? -37.587 49.086 -34.845 1.00 10.59 ? 183 ALA B O 1 ATOM 3570 C CB . ALA B 1 95 ? -34.722 49.283 -32.918 1.00 10.20 ? 183 ALA B CB 1 ATOM 3571 N N . ALA B 1 96 ? -35.568 49.087 -35.829 1.00 8.14 ? 184 ALA B N 1 ATOM 3572 C CA . ALA B 1 96 ? -35.979 48.326 -37.001 1.00 7.64 ? 184 ALA B CA 1 ATOM 3573 C C . ALA B 1 96 ? -35.502 46.864 -36.970 1.00 7.03 ? 184 ALA B C 1 ATOM 3574 O O . ALA B 1 96 ? -36.120 46.005 -37.580 1.00 7.31 ? 184 ALA B O 1 ATOM 3575 C CB . ALA B 1 96 ? -35.503 49.022 -38.237 1.00 7.97 ? 184 ALA B CB 1 ATOM 3576 N N . ALA B 1 97 ? -34.397 46.579 -36.260 1.00 6.26 ? 185 ALA B N 1 ATOM 3577 C CA . ALA B 1 97 ? -33.672 45.327 -36.397 1.00 6.25 ? 185 ALA B CA 1 ATOM 3578 C C . ALA B 1 97 ? -34.405 44.067 -36.001 1.00 7.23 ? 185 ALA B C 1 ATOM 3579 O O . ALA B 1 97 ? -34.263 43.029 -36.681 1.00 8.35 ? 185 ALA B O 1 ATOM 3580 C CB . ALA B 1 97 ? -32.339 45.411 -35.625 1.00 7.25 ? 185 ALA B CB 1 ATOM 3581 N N . SER B 1 98 ? -35.241 44.154 -34.947 1.00 7.53 ? 186 SER B N 1 ATOM 3582 C CA . SER B 1 98 ? -35.964 42.978 -34.441 1.00 7.69 ? 186 SER B CA 1 ATOM 3583 C C . SER B 1 98 ? -37.485 43.117 -34.546 1.00 7.74 ? 186 SER B C 1 ATOM 3584 O O . SER B 1 98 ? -38.180 42.511 -33.773 1.00 8.79 ? 186 SER B O 1 ATOM 3585 C CB . SER B 1 98 ? -35.543 42.609 -33.031 1.00 8.11 ? 186 SER B CB 1 ATOM 3586 O OG . SER B 1 98 ? -34.251 42.043 -33.044 1.00 10.34 ? 186 SER B OG 1 ATOM 3587 N N . ASN B 1 99 ? -37.970 43.879 -35.522 1.00 7.31 ? 187 ASN B N 1 ATOM 3588 C CA . ASN B 1 99 ? -39.410 43.876 -35.857 1.00 7.78 ? 187 ASN B CA 1 ATOM 3589 C C . ASN B 1 99 ? -39.852 42.411 -36.013 1.00 7.96 ? 187 ASN B C 1 ATOM 3590 O O . ASN B 1 99 ? -39.122 41.552 -36.573 1.00 8.29 ? 187 ASN B O 1 ATOM 3591 C CB . ASN B 1 99 ? -39.690 44.677 -37.116 1.00 8.48 ? 187 ASN B CB 1 ATOM 3592 C CG . ASN B 1 99 ? -41.173 44.944 -37.338 1.00 9.65 ? 187 ASN B CG 1 ATOM 3593 O OD1 . ASN B 1 99 ? -41.960 44.946 -36.394 1.00 10.34 ? 187 ASN B OD1 1 ATOM 3594 N ND2 . ASN B 1 99 ? -41.549 45.165 -38.606 1.00 12.70 ? 187 ASN B ND2 1 ATOM 3595 N N . GLY B 1 100 ? -41.024 42.130 -35.468 1.00 7.84 ? 188 GLY B N 1 ATOM 3596 C CA . GLY B 1 100 ? -41.585 40.795 -35.420 1.00 7.12 ? 188 GLY B CA 1 ATOM 3597 C C . GLY B 1 100 ? -42.581 40.489 -36.505 1.00 7.54 ? 188 GLY B C 1 ATOM 3598 O O . GLY B 1 100 ? -42.868 41.300 -37.393 1.00 7.54 ? 188 GLY B O 1 ATOM 3599 N N . GLU B 1 101 ? -43.168 39.304 -36.388 1.00 6.74 ? 189 GLU B N 1 ATOM 3600 C CA . GLU B 1 101 ? -44.000 38.763 -37.413 1.00 7.46 ? 189 GLU B CA 1 ATOM 3601 C C . GLU B 1 101 ? -45.422 39.317 -37.363 1.00 7.96 ? 189 GLU B C 1 ATOM 3602 O O . GLU B 1 101 ? -46.114 39.256 -38.369 1.00 7.07 ? 189 GLU B O 1 ATOM 3603 C CB . GLU B 1 101 ? -44.021 37.221 -37.290 1.00 7.58 ? 189 GLU B CB 1 ATOM 3604 C CG . GLU B 1 101 ? -44.717 36.735 -36.013 1.00 9.01 ? 189 GLU B CG 1 ATOM 3605 C CD . GLU B 1 101 ? -44.578 35.259 -35.795 1.00 9.78 ? 189 GLU B CD 1 ATOM 3606 O OE1 . GLU B 1 101 ? -44.378 34.495 -36.789 1.00 12.33 ? 189 GLU B OE1 1 ATOM 3607 O OE2 . GLU B 1 101 ? -44.757 34.847 -34.632 1.00 8.82 ? 189 GLU B OE2 1 ATOM 3608 N N . TRP B 1 102 ? -45.821 39.902 -36.212 1.00 7.14 ? 190 TRP B N 1 ATOM 3609 C CA . TRP B 1 102 ? -47.156 40.479 -36.027 1.00 8.08 ? 190 TRP B CA 1 ATOM 3610 C C . TRP B 1 102 ? -47.212 41.993 -35.838 1.00 7.85 ? 190 TRP B C 1 ATOM 3611 O O . TRP B 1 102 ? -46.312 42.622 -35.210 1.00 7.09 ? 190 TRP B O 1 ATOM 3612 C CB . TRP B 1 102 ? -47.857 39.784 -34.865 1.00 8.08 ? 190 TRP B CB 1 ATOM 3613 C CG . TRP B 1 102 ? -48.082 38.335 -35.082 1.00 6.86 ? 190 TRP B CG 1 ATOM 3614 C CD1 . TRP B 1 102 ? -48.287 37.709 -36.264 1.00 8.95 ? 190 TRP B CD1 1 ATOM 3615 C CD2 . TRP B 1 102 ? -48.142 37.321 -34.074 1.00 7.10 ? 190 TRP B CD2 1 ATOM 3616 N NE1 . TRP B 1 102 ? -48.493 36.366 -36.065 1.00 9.42 ? 190 TRP B NE1 1 ATOM 3617 C CE2 . TRP B 1 102 ? -48.368 36.094 -34.726 1.00 7.38 ? 190 TRP B CE2 1 ATOM 3618 C CE3 . TRP B 1 102 ? -48.004 37.324 -32.695 1.00 8.81 ? 190 TRP B CE3 1 ATOM 3619 C CZ2 . TRP B 1 102 ? -48.510 34.893 -34.047 1.00 7.61 ? 190 TRP B CZ2 1 ATOM 3620 C CZ3 . TRP B 1 102 ? -48.138 36.108 -32.006 1.00 8.51 ? 190 TRP B CZ3 1 ATOM 3621 C CH2 . TRP B 1 102 ? -48.383 34.920 -32.690 1.00 9.67 ? 190 TRP B CH2 1 ATOM 3622 N N . ALA B 1 103 ? -48.286 42.552 -36.390 1.00 8.55 ? 191 ALA B N 1 ATOM 3623 C CA . ALA B 1 103 ? -48.590 43.978 -36.301 1.00 9.18 ? 191 ALA B CA 1 ATOM 3624 C C . ALA B 1 103 ? -49.933 44.176 -35.624 1.00 9.08 ? 191 ALA B C 1 ATOM 3625 O O . ALA B 1 103 ? -50.881 43.447 -35.889 1.00 9.18 ? 191 ALA B O 1 ATOM 3626 C CB . ALA B 1 103 ? -48.636 44.633 -37.723 1.00 10.25 ? 191 ALA B CB 1 ATOM 3627 N N . ILE B 1 104 ? -50.033 45.229 -34.820 1.00 9.37 ? 192 ILE B N 1 ATOM 3628 C CA . ILE B 1 104 ? -51.322 45.617 -34.208 1.00 9.70 ? 192 ILE B CA 1 ATOM 3629 C C . ILE B 1 104 ? -52.389 45.823 -35.284 1.00 11.32 ? 192 ILE B C 1 ATOM 3630 O O . ILE B 1 104 ? -53.538 45.357 -35.139 1.00 11.53 ? 192 ILE B O 1 ATOM 3631 C CB . ILE B 1 104 ? -51.121 46.886 -33.325 1.00 9.75 ? 192 ILE B CB 1 ATOM 3632 C CG1 . ILE B 1 104 ? -50.157 46.560 -32.163 1.00 9.28 ? 192 ILE B CG1 1 ATOM 3633 C CG2 . ILE B 1 104 ? -52.388 47.338 -32.734 1.00 9.98 ? 192 ILE B CG2 1 ATOM 3634 C CD1 . ILE B 1 104 ? -49.836 47.762 -31.279 1.00 11.21 ? 192 ILE B CD1 1 ATOM 3635 N N . ALA B 1 105 ? -52.000 46.490 -36.378 1.00 11.82 ? 193 ALA B N 1 ATOM 3636 C CA . ALA B 1 105 ? -52.896 46.775 -37.505 1.00 12.59 ? 193 ALA B CA 1 ATOM 3637 C C . ALA B 1 105 ? -53.424 45.518 -38.190 1.00 12.72 ? 193 ALA B C 1 ATOM 3638 O O . ALA B 1 105 ? -54.391 45.597 -38.908 1.00 12.73 ? 193 ALA B O 1 ATOM 3639 C CB . ALA B 1 105 ? -52.175 47.646 -38.554 1.00 12.07 ? 193 ALA B CB 1 ATOM 3640 N N . ASN B 1 106 ? -52.779 44.373 -37.990 1.00 12.09 ? 194 ASN B N 1 ATOM 3641 C CA . ASN B 1 106 ? -53.169 43.140 -38.687 1.00 12.44 ? 194 ASN B CA 1 ATOM 3642 C C . ASN B 1 106 ? -53.406 41.985 -37.726 1.00 11.18 ? 194 ASN B C 1 ATOM 3643 O O . ASN B 1 106 ? -52.710 40.971 -37.763 1.00 11.59 ? 194 ASN B O 1 ATOM 3644 C CB . ASN B 1 106 ? -52.125 42.774 -39.751 1.00 13.55 ? 194 ASN B CB 1 ATOM 3645 C CG . ASN B 1 106 ? -52.574 41.629 -40.674 1.00 17.52 ? 194 ASN B CG 1 ATOM 3646 O OD1 . ASN B 1 106 ? -53.784 41.380 -40.874 1.00 22.74 ? 194 ASN B OD1 1 ATOM 3647 N ND2 . ASN B 1 106 ? -51.581 40.928 -41.253 1.00 22.90 ? 194 ASN B ND2 1 ATOM 3648 N N . ASN B 1 107 ? -54.397 42.177 -36.865 1.00 11.08 ? 195 ASN B N 1 ATOM 3649 C CA . ASN B 1 107 ? -54.856 41.182 -35.883 1.00 11.35 ? 195 ASN B CA 1 ATOM 3650 C C . ASN B 1 107 ? -53.790 40.799 -34.849 1.00 9.61 ? 195 ASN B C 1 ATOM 3651 O O . ASN B 1 107 ? -53.845 39.713 -34.253 1.00 8.42 ? 195 ASN B O 1 ATOM 3652 C CB . ASN B 1 107 ? -55.384 39.906 -36.562 1.00 12.55 ? 195 ASN B CB 1 ATOM 3653 C CG . ASN B 1 107 ? -56.660 39.361 -35.888 1.00 17.23 ? 195 ASN B CG 1 ATOM 3654 O OD1 . ASN B 1 107 ? -57.421 40.115 -35.254 1.00 21.71 ? 195 ASN B OD1 1 ATOM 3655 N ND2 . ASN B 1 107 ? -56.913 38.054 -36.046 1.00 22.53 ? 195 ASN B ND2 1 ATOM 3656 N N . GLY B 1 108 ? -52.852 41.706 -34.599 1.00 8.13 ? 196 GLY B N 1 ATOM 3657 C CA . GLY B 1 108 ? -51.763 41.420 -33.678 1.00 7.55 ? 196 GLY B CA 1 ATOM 3658 C C . GLY B 1 108 ? -52.183 41.085 -32.258 1.00 6.96 ? 196 GLY B C 1 ATOM 3659 O O . GLY B 1 108 ? -51.645 40.168 -31.633 1.00 6.18 ? 196 GLY B O 1 ATOM 3660 N N . VAL B 1 109 ? -53.162 41.804 -31.742 1.00 7.91 ? 197 VAL B N 1 ATOM 3661 C CA . VAL B 1 109 ? -53.650 41.519 -30.389 1.00 7.52 ? 197 VAL B CA 1 ATOM 3662 C C . VAL B 1 109 ? -54.227 40.093 -30.287 1.00 6.34 ? 197 VAL B C 1 ATOM 3663 O O . VAL B 1 109 ? -53.866 39.343 -29.396 1.00 5.14 ? 197 VAL B O 1 ATOM 3664 C CB . VAL B 1 109 ? -54.656 42.576 -29.938 1.00 7.66 ? 197 VAL B CB 1 ATOM 3665 C CG1 . VAL B 1 109 ? -55.510 42.115 -28.708 1.00 7.75 ? 197 VAL B CG1 1 ATOM 3666 C CG2 . VAL B 1 109 ? -53.945 43.897 -29.671 1.00 8.73 ? 197 VAL B CG2 1 ATOM 3667 N N . ASN B 1 110 ? -55.156 39.742 -31.186 1.00 6.36 ? 198 ASN B N 1 ATOM 3668 C CA . ASN B 1 110 ? -55.706 38.392 -31.190 1.00 5.51 ? 198 ASN B CA 1 ATOM 3669 C C . ASN B 1 110 ? -54.651 37.300 -31.319 1.00 5.75 ? 198 ASN B C 1 ATOM 3670 O O . ASN B 1 110 ? -54.669 36.263 -30.589 1.00 4.17 ? 198 ASN B O 1 ATOM 3671 C CB . ASN B 1 110 ? -56.750 38.269 -32.278 1.00 6.14 ? 198 ASN B CB 1 ATOM 3672 C CG . ASN B 1 110 ? -57.992 39.106 -31.966 1.00 6.41 ? 198 ASN B CG 1 ATOM 3673 O OD1 . ASN B 1 110 ? -58.268 39.378 -30.793 1.00 8.61 ? 198 ASN B OD1 1 ATOM 3674 N ND2 . ASN B 1 110 ? -58.755 39.503 -33.001 1.00 9.43 ? 198 ASN B ND2 1 ATOM 3675 N N . ASN B 1 111 ? -53.719 37.510 -32.252 1.00 5.58 ? 199 ASN B N 1 ATOM 3676 C CA . ASN B 1 111 ? -52.631 36.554 -32.431 1.00 6.83 ? 199 ASN B CA 1 ATOM 3677 C C . ASN B 1 111 ? -51.809 36.338 -31.178 1.00 6.52 ? 199 ASN B C 1 ATOM 3678 O O . ASN B 1 111 ? -51.475 35.200 -30.836 1.00 7.46 ? 199 ASN B O 1 ATOM 3679 C CB . ASN B 1 111 ? -51.694 37.026 -33.514 1.00 6.26 ? 199 ASN B CB 1 ATOM 3680 C CG . ASN B 1 111 ? -52.332 37.049 -34.851 1.00 9.13 ? 199 ASN B CG 1 ATOM 3681 O OD1 . ASN B 1 111 ? -53.465 36.533 -35.034 1.00 8.22 ? 199 ASN B OD1 1 ATOM 3682 N ND2 . ASN B 1 111 ? -51.652 37.693 -35.812 1.00 8.12 ? 199 ASN B ND2 1 ATOM 3683 N N . TYR B 1 112 ? -51.413 37.443 -30.533 1.00 5.98 ? 200 TYR B N 1 ATOM 3684 C CA . TYR B 1 112 ? -50.639 37.379 -29.285 1.00 5.87 ? 200 TYR B CA 1 ATOM 3685 C C . TYR B 1 112 ? -51.350 36.718 -28.113 1.00 6.72 ? 200 TYR B C 1 ATOM 3686 O O . TYR B 1 112 ? -50.757 35.940 -27.348 1.00 6.17 ? 200 TYR B O 1 ATOM 3687 C CB . TYR B 1 112 ? -50.219 38.790 -28.841 1.00 5.63 ? 200 TYR B CB 1 ATOM 3688 C CG . TYR B 1 112 ? -49.130 38.774 -27.787 1.00 7.09 ? 200 TYR B CG 1 ATOM 3689 C CD1 . TYR B 1 112 ? -47.823 38.477 -28.119 1.00 7.07 ? 200 TYR B CD1 1 ATOM 3690 C CD2 . TYR B 1 112 ? -49.442 38.973 -26.442 1.00 8.57 ? 200 TYR B CD2 1 ATOM 3691 C CE1 . TYR B 1 112 ? -46.821 38.418 -27.132 1.00 6.10 ? 200 TYR B CE1 1 ATOM 3692 C CE2 . TYR B 1 112 ? -48.460 38.939 -25.467 1.00 5.66 ? 200 TYR B CE2 1 ATOM 3693 C CZ . TYR B 1 112 ? -47.144 38.674 -25.817 1.00 7.54 ? 200 TYR B CZ 1 ATOM 3694 O OH . TYR B 1 112 ? -46.209 38.678 -24.828 1.00 9.06 ? 200 TYR B OH 1 ATOM 3695 N N . LYS B 1 113 ? -52.608 37.056 -27.927 1.00 6.98 ? 201 LYS B N 1 ATOM 3696 C CA . LYS B 1 113 ? -53.394 36.468 -26.864 1.00 7.04 ? 201 LYS B CA 1 ATOM 3697 C C . LYS B 1 113 ? -53.475 34.951 -27.079 1.00 6.29 ? 201 LYS B C 1 ATOM 3698 O O . LYS B 1 113 ? -53.337 34.196 -26.134 1.00 5.72 ? 201 LYS B O 1 ATOM 3699 C CB . LYS B 1 113 ? -54.761 37.128 -26.737 1.00 8.18 ? 201 LYS B CB 1 ATOM 3700 C CG . LYS B 1 113 ? -54.734 38.514 -26.058 1.00 10.26 ? 201 LYS B CG 1 ATOM 3701 C CD . LYS B 1 113 ? -56.111 39.180 -26.185 1.00 13.53 ? 201 LYS B CD 1 ATOM 3702 C CE . LYS B 1 113 ? -56.515 39.987 -24.935 1.00 17.91 ? 201 LYS B CE 1 ATOM 3703 N NZ . LYS B 1 113 ? -57.999 40.333 -24.946 1.00 19.82 ? 201 LYS B NZ 1 ATOM 3704 N N . ALA B 1 114 ? -53.617 34.495 -28.323 1.00 5.99 ? 202 ALA B N 1 ATOM 3705 C CA . ALA B 1 114 ? -53.655 33.060 -28.587 1.00 5.96 ? 202 ALA B CA 1 ATOM 3706 C C . ALA B 1 114 ? -52.323 32.399 -28.324 1.00 5.72 ? 202 ALA B C 1 ATOM 3707 O O . ALA B 1 114 ? -52.264 31.258 -27.802 1.00 6.11 ? 202 ALA B O 1 ATOM 3708 C CB . ALA B 1 114 ? -54.124 32.776 -30.037 1.00 6.93 ? 202 ALA B CB 1 ATOM 3709 N N . TYR B 1 115 ? -51.244 33.126 -28.671 1.00 5.91 ? 203 TYR B N 1 ATOM 3710 C CA . TYR B 1 115 ? -49.876 32.709 -28.414 1.00 5.68 ? 203 TYR B CA 1 ATOM 3711 C C . TYR B 1 115 ? -49.668 32.504 -26.909 1.00 5.03 ? 203 TYR B C 1 ATOM 3712 O O . TYR B 1 115 ? -49.185 31.459 -26.483 1.00 6.78 ? 203 TYR B O 1 ATOM 3713 C CB . TYR B 1 115 ? -48.963 33.789 -28.976 1.00 4.95 ? 203 TYR B CB 1 ATOM 3714 C CG . TYR B 1 115 ? -47.524 33.862 -28.566 1.00 5.16 ? 203 TYR B CG 1 ATOM 3715 C CD1 . TYR B 1 115 ? -46.591 33.138 -29.249 1.00 5.32 ? 203 TYR B CD1 1 ATOM 3716 C CD2 . TYR B 1 115 ? -47.091 34.784 -27.645 1.00 7.98 ? 203 TYR B CD2 1 ATOM 3717 C CE1 . TYR B 1 115 ? -45.163 33.256 -28.947 1.00 5.89 ? 203 TYR B CE1 1 ATOM 3718 C CE2 . TYR B 1 115 ? -45.756 34.923 -27.326 1.00 7.29 ? 203 TYR B CE2 1 ATOM 3719 C CZ . TYR B 1 115 ? -44.799 34.175 -28.001 1.00 6.62 ? 203 TYR B CZ 1 ATOM 3720 O OH . TYR B 1 115 ? -43.503 34.399 -27.621 1.00 10.31 ? 203 TYR B OH 1 ATOM 3721 N N . ILE B 1 116 ? -50.040 33.493 -26.107 1.00 4.97 ? 204 ILE B N 1 ATOM 3722 C CA . ILE B 1 116 ? -49.966 33.378 -24.642 1.00 5.49 ? 204 ILE B CA 1 ATOM 3723 C C . ILE B 1 116 ? -50.772 32.219 -24.137 1.00 6.36 ? 204 ILE B C 1 ATOM 3724 O O . ILE B 1 116 ? -50.326 31.472 -23.281 1.00 6.30 ? 204 ILE B O 1 ATOM 3725 C CB . ILE B 1 116 ? -50.419 34.666 -23.955 1.00 6.61 ? 204 ILE B CB 1 ATOM 3726 C CG1 . ILE B 1 116 ? -49.436 35.828 -24.239 1.00 5.43 ? 204 ILE B CG1 1 ATOM 3727 C CG2 . ILE B 1 116 ? -50.593 34.487 -22.465 1.00 5.54 ? 204 ILE B CG2 1 ATOM 3728 C CD1 . ILE B 1 116 ? -47.971 35.670 -23.852 1.00 5.59 ? 204 ILE B CD1 1 ATOM 3729 N N . ASN B 1 117 ? -52.000 32.085 -24.640 1.00 6.25 ? 205 ASN B N 1 ATOM 3730 C CA . ASN B 1 117 ? -52.890 31.032 -24.193 1.00 7.04 ? 205 ASN B CA 1 ATOM 3731 C C . ASN B 1 117 ? -52.302 29.645 -24.482 1.00 7.38 ? 205 ASN B C 1 ATOM 3732 O O . ASN B 1 117 ? -52.462 28.709 -23.702 1.00 6.10 ? 205 ASN B O 1 ATOM 3733 C CB . ASN B 1 117 ? -54.237 31.175 -24.892 1.00 6.59 ? 205 ASN B CB 1 ATOM 3734 C CG . ASN B 1 117 ? -55.053 32.345 -24.370 1.00 10.79 ? 205 ASN B CG 1 ATOM 3735 O OD1 . ASN B 1 117 ? -54.676 32.962 -23.374 1.00 15.82 ? 205 ASN B OD1 1 ATOM 3736 N ND2 . ASN B 1 117 ? -56.201 32.663 -25.044 1.00 10.72 ? 205 ASN B ND2 1 ATOM 3737 N N . ARG B 1 118 ? -51.625 29.519 -25.620 1.00 6.77 ? 206 ARG B N 1 ATOM 3738 C CA . ARG B 1 118 ? -51.059 28.228 -25.994 1.00 6.78 ? 206 ARG B CA 1 ATOM 3739 C C . ARG B 1 118 ? -49.828 27.914 -25.161 1.00 6.51 ? 206 ARG B C 1 ATOM 3740 O O . ARG B 1 118 ? -49.648 26.785 -24.717 1.00 6.54 ? 206 ARG B O 1 ATOM 3741 C CB . ARG B 1 118 ? -50.775 28.119 -27.499 1.00 7.29 ? 206 ARG B CB 1 ATOM 3742 C CG . ARG B 1 118 ? -50.205 26.755 -27.905 1.00 7.85 ? 206 ARG B CG 1 ATOM 3743 C CD . ARG B 1 118 ? -51.251 25.601 -27.780 1.00 10.79 ? 206 ARG B CD 1 ATOM 3744 N NE . ARG B 1 118 ? -50.578 24.329 -28.027 1.00 12.36 ? 206 ARG B NE 1 ATOM 3745 C CZ . ARG B 1 118 ? -50.811 23.208 -27.359 1.00 13.70 ? 206 ARG B CZ 1 ATOM 3746 N NH1 . ARG B 1 118 ? -51.710 23.148 -26.394 1.00 14.81 ? 206 ARG B NH1 1 ATOM 3747 N NH2 . ARG B 1 118 ? -50.122 22.133 -27.651 1.00 15.17 ? 206 ARG B NH2 1 ATOM 3748 N N . ILE B 1 119 ? -48.990 28.916 -24.909 1.00 6.47 ? 207 ILE B N 1 ATOM 3749 C CA . ILE B 1 119 ? -47.878 28.735 -23.975 1.00 6.98 ? 207 ILE B CA 1 ATOM 3750 C C . ILE B 1 119 ? -48.412 28.312 -22.587 1.00 6.54 ? 207 ILE B C 1 ATOM 3751 O O . ILE B 1 119 ? -47.857 27.418 -21.988 1.00 5.70 ? 207 ILE B O 1 ATOM 3752 C CB . ILE B 1 119 ? -47.063 30.028 -23.881 1.00 6.21 ? 207 ILE B CB 1 ATOM 3753 C CG1 . ILE B 1 119 ? -46.370 30.307 -25.209 1.00 6.14 ? 207 ILE B CG1 1 ATOM 3754 C CG2 . ILE B 1 119 ? -45.998 30.022 -22.743 1.00 6.92 ? 207 ILE B CG2 1 ATOM 3755 C CD1 . ILE B 1 119 ? -45.778 31.724 -25.267 1.00 8.13 ? 207 ILE B CD1 1 ATOM 3756 N N . ARG B 1 120 ? -49.456 28.972 -22.070 1.00 6.36 ? 208 ARG B N 1 ATOM 3757 C CA . ARG B 1 120 ? -50.074 28.562 -20.816 1.00 6.51 ? 208 ARG B CA 1 ATOM 3758 C C . ARG B 1 120 ? -50.422 27.061 -20.833 1.00 6.28 ? 208 ARG B C 1 ATOM 3759 O O . ARG B 1 120 ? -50.129 26.348 -19.877 1.00 6.12 ? 208 ARG B O 1 ATOM 3760 C CB . ARG B 1 120 ? -51.340 29.397 -20.573 1.00 5.76 ? 208 ARG B CB 1 ATOM 3761 C CG . ARG B 1 120 ? -52.181 28.975 -19.346 1.00 8.18 ? 208 ARG B CG 1 ATOM 3762 C CD . ARG B 1 120 ? -53.525 29.699 -19.209 1.00 8.55 ? 208 ARG B CD 1 ATOM 3763 N NE . ARG B 1 120 ? -54.321 29.045 -18.159 1.00 11.07 ? 208 ARG B NE 1 ATOM 3764 C CZ . ARG B 1 120 ? -54.248 29.363 -16.858 1.00 11.80 ? 208 ARG B CZ 1 ATOM 3765 N NH1 . ARG B 1 120 ? -53.439 30.328 -16.431 1.00 11.93 ? 208 ARG B NH1 1 ATOM 3766 N NH2 . ARG B 1 120 ? -54.981 28.720 -15.970 1.00 12.66 ? 208 ARG B NH2 1 ATOM 3767 N N . GLU B 1 121 ? -51.105 26.604 -21.903 1.00 6.02 ? 209 GLU B N 1 ATOM 3768 C CA . GLU B 1 121 ? -51.510 25.216 -22.028 1.00 6.64 ? 209 GLU B CA 1 ATOM 3769 C C . GLU B 1 121 ? -50.325 24.242 -21.927 1.00 5.62 ? 209 GLU B C 1 ATOM 3770 O O . GLU B 1 121 ? -50.427 23.192 -21.257 1.00 5.78 ? 209 GLU B O 1 ATOM 3771 C CB . GLU B 1 121 ? -52.184 24.953 -23.358 1.00 7.50 ? 209 GLU B CB 1 ATOM 3772 C CG . GLU B 1 121 ? -53.627 25.380 -23.440 1.00 11.77 ? 209 GLU B CG 1 ATOM 3773 C CD . GLU B 1 121 ? -54.323 24.766 -24.658 1.00 20.22 ? 209 GLU B CD 1 ATOM 3774 O OE1 . GLU B 1 121 ? -53.910 25.051 -25.820 1.00 18.91 ? 209 GLU B OE1 1 ATOM 3775 O OE2 . GLU B 1 121 ? -55.262 23.957 -24.442 1.00 27.63 ? 209 GLU B OE2 1 ATOM 3776 N N . ILE B 1 122 ? -49.266 24.588 -22.639 1.00 6.26 ? 210 ILE B N 1 ATOM 3777 C CA . ILE B 1 122 ? -48.048 23.788 -22.692 1.00 6.52 ? 210 ILE B CA 1 ATOM 3778 C C . ILE B 1 122 ? -47.372 23.762 -21.328 1.00 5.33 ? 210 ILE B C 1 ATOM 3779 O O . ILE B 1 122 ? -46.993 22.695 -20.832 1.00 5.80 ? 210 ILE B O 1 ATOM 3780 C CB . ILE B 1 122 ? -47.131 24.250 -23.781 1.00 6.65 ? 210 ILE B CB 1 ATOM 3781 C CG1 . ILE B 1 122 ? -47.767 23.939 -25.135 1.00 10.06 ? 210 ILE B CG1 1 ATOM 3782 C CG2 . ILE B 1 122 ? -45.717 23.604 -23.657 1.00 9.18 ? 210 ILE B CG2 1 ATOM 3783 C CD1 . ILE B 1 122 ? -47.070 24.596 -26.240 1.00 12.39 ? 210 ILE B CD1 1 ATOM 3784 N N . LEU B 1 123 ? -47.277 24.914 -20.691 1.00 6.24 ? 211 LEU B N 1 ATOM 3785 C CA . LEU B 1 123 ? -46.640 24.970 -19.349 1.00 6.88 ? 211 LEU B CA 1 ATOM 3786 C C . LEU B 1 123 ? -47.447 24.186 -18.299 1.00 7.18 ? 211 LEU B C 1 ATOM 3787 O O . LEU B 1 123 ? -46.864 23.530 -17.434 1.00 7.67 ? 211 LEU B O 1 ATOM 3788 C CB . LEU B 1 123 ? -46.455 26.415 -18.894 1.00 7.17 ? 211 LEU B CB 1 ATOM 3789 C CG . LEU B 1 123 ? -45.566 27.257 -19.784 1.00 9.07 ? 211 LEU B CG 1 ATOM 3790 C CD1 . LEU B 1 123 ? -45.424 28.621 -19.145 1.00 12.13 ? 211 LEU B CD1 1 ATOM 3791 C CD2 . LEU B 1 123 ? -44.177 26.668 -20.011 1.00 10.05 ? 211 LEU B CD2 1 ATOM 3792 N N . ILE B 1 124 ? -48.781 24.202 -18.431 1.00 6.83 ? 212 ILE B N 1 ATOM 3793 C CA . ILE B 1 124 ? -49.652 23.447 -17.513 1.00 7.75 ? 212 ILE B CA 1 ATOM 3794 C C . ILE B 1 124 ? -49.368 21.965 -17.726 1.00 7.27 ? 212 ILE B C 1 ATOM 3795 O O . ILE B 1 124 ? -49.294 21.189 -16.756 1.00 7.87 ? 212 ILE B O 1 ATOM 3796 C CB . ILE B 1 124 ? -51.129 23.789 -17.737 1.00 8.00 ? 212 ILE B CB 1 ATOM 3797 C CG1 . ILE B 1 124 ? -51.444 25.140 -17.093 1.00 9.14 ? 212 ILE B CG1 1 ATOM 3798 C CG2 . ILE B 1 124 ? -52.067 22.697 -17.180 1.00 9.16 ? 212 ILE B CG2 1 ATOM 3799 C CD1 . ILE B 1 124 ? -52.829 25.663 -17.442 1.00 9.19 ? 212 ILE B CD1 1 ATOM 3800 N N . SER B 1 125 ? -49.245 21.569 -18.987 1.00 7.69 ? 213 SER B N 1 ATOM 3801 C CA . SER B 1 125 ? -49.044 20.175 -19.314 1.00 8.80 ? 213 SER B CA 1 ATOM 3802 C C . SER B 1 125 ? -47.692 19.708 -18.796 1.00 7.55 ? 213 SER B C 1 ATOM 3803 O O . SER B 1 125 ? -47.550 18.498 -18.468 1.00 7.56 ? 213 SER B O 1 ATOM 3804 C CB . SER B 1 125 ? -49.218 19.896 -20.820 1.00 8.49 ? 213 SER B CB 1 ATOM 3805 O OG . SER B 1 125 ? -48.157 20.419 -21.576 1.00 17.87 ? 213 SER B OG 1 ATOM 3806 N N . PHE B 1 126 ? -46.722 20.638 -18.742 1.00 6.83 ? 214 PHE B N 1 ATOM 3807 C CA . PHE B 1 126 ? -45.399 20.426 -18.154 1.00 7.33 ? 214 PHE B CA 1 ATOM 3808 C C . PHE B 1 126 ? -45.171 21.088 -16.785 1.00 6.82 ? 214 PHE B C 1 ATOM 3809 O O . PHE B 1 126 ? -44.052 21.562 -16.492 1.00 7.24 ? 214 PHE B O 1 ATOM 3810 C CB . PHE B 1 126 ? -44.306 20.836 -19.139 1.00 6.76 ? 214 PHE B CB 1 ATOM 3811 C CG . PHE B 1 126 ? -44.207 19.950 -20.336 1.00 7.87 ? 214 PHE B CG 1 ATOM 3812 C CD1 . PHE B 1 126 ? -43.412 18.792 -20.296 1.00 7.05 ? 214 PHE B CD1 1 ATOM 3813 C CD2 . PHE B 1 126 ? -44.851 20.278 -21.517 1.00 7.25 ? 214 PHE B CD2 1 ATOM 3814 C CE1 . PHE B 1 126 ? -43.296 17.987 -21.383 1.00 8.55 ? 214 PHE B CE1 1 ATOM 3815 C CE2 . PHE B 1 126 ? -44.725 19.456 -22.648 1.00 11.23 ? 214 PHE B CE2 1 ATOM 3816 C CZ . PHE B 1 126 ? -43.958 18.311 -22.570 1.00 10.08 ? 214 PHE B CZ 1 ATOM 3817 N N . SER B 1 127 ? -46.185 21.026 -15.915 1.00 8.03 ? 215 SER B N 1 ATOM 3818 C CA . SER B 1 127 ? -46.114 21.588 -14.543 1.00 8.59 ? 215 SER B CA 1 ATOM 3819 C C . SER B 1 127 ? -45.072 20.913 -13.663 1.00 9.05 ? 215 SER B C 1 ATOM 3820 O O . SER B 1 127 ? -44.608 21.474 -12.664 1.00 8.95 ? 215 SER B O 1 ATOM 3821 C CB . SER B 1 127 ? -47.462 21.494 -13.861 1.00 11.00 ? 215 SER B CB 1 ATOM 3822 O OG . SER B 1 127 ? -48.276 22.426 -14.490 1.00 15.27 ? 215 SER B OG 1 ATOM 3823 N N . ASP B 1 128 ? -44.689 19.705 -14.061 1.00 7.03 ? 216 ASP B N 1 ATOM 3824 C CA . ASP B 1 128 ? -43.614 19.007 -13.384 1.00 7.11 ? 216 ASP B CA 1 ATOM 3825 C C . ASP B 1 128 ? -42.218 19.572 -13.669 1.00 7.81 ? 216 ASP B C 1 ATOM 3826 O O . ASP B 1 128 ? -41.232 19.150 -13.053 1.00 7.10 ? 216 ASP B O 1 ATOM 3827 C CB . ASP B 1 128 ? -43.665 17.519 -13.731 1.00 7.51 ? 216 ASP B CB 1 ATOM 3828 C CG . ASP B 1 128 ? -43.564 17.242 -15.218 1.00 8.68 ? 216 ASP B CG 1 ATOM 3829 O OD1 . ASP B 1 128 ? -44.132 17.980 -16.054 1.00 8.75 ? 216 ASP B OD1 1 ATOM 3830 O OD2 . ASP B 1 128 ? -42.993 16.236 -15.637 1.00 9.67 ? 216 ASP B OD2 1 ATOM 3831 N N . VAL B 1 129 ? -42.120 20.496 -14.610 1.00 6.90 ? 217 VAL B N 1 ATOM 3832 C CA . VAL B 1 129 ? -40.845 21.099 -14.957 1.00 7.29 ? 217 VAL B CA 1 ATOM 3833 C C . VAL B 1 129 ? -40.820 22.551 -14.488 1.00 7.56 ? 217 VAL B C 1 ATOM 3834 O O . VAL B 1 129 ? -41.575 23.363 -14.992 1.00 9.19 ? 217 VAL B O 1 ATOM 3835 C CB . VAL B 1 129 ? -40.638 21.081 -16.454 1.00 7.10 ? 217 VAL B CB 1 ATOM 3836 C CG1 . VAL B 1 129 ? -39.322 21.808 -16.810 1.00 7.12 ? 217 VAL B CG1 1 ATOM 3837 C CG2 . VAL B 1 129 ? -40.649 19.637 -16.954 1.00 6.83 ? 217 VAL B CG2 1 ATOM 3838 N N . ARG B 1 130 ? -39.922 22.894 -13.586 1.00 7.11 ? 218 ARG B N 1 ATOM 3839 C CA . ARG B 1 130 ? -39.763 24.294 -13.174 1.00 7.61 ? 218 ARG B CA 1 ATOM 3840 C C . ARG B 1 130 ? -39.335 25.133 -14.367 1.00 8.09 ? 218 ARG B C 1 ATOM 3841 O O . ARG B 1 130 ? -38.378 24.788 -15.048 1.00 7.99 ? 218 ARG B O 1 ATOM 3842 C CB . ARG B 1 130 ? -38.749 24.421 -12.045 1.00 8.17 ? 218 ARG B CB 1 ATOM 3843 C CG . ARG B 1 130 ? -38.765 25.835 -11.435 1.00 13.36 ? 218 ARG B CG 1 ATOM 3844 C CD . ARG B 1 130 ? -37.644 26.060 -10.427 1.00 16.68 ? 218 ARG B CD 1 ATOM 3845 N NE . ARG B 1 130 ? -37.734 25.096 -9.310 1.00 16.70 ? 218 ARG B NE 1 ATOM 3846 C CZ . ARG B 1 130 ? -37.081 25.242 -8.170 1.00 15.18 ? 218 ARG B CZ 1 ATOM 3847 N NH1 . ARG B 1 130 ? -36.264 26.252 -8.024 1.00 11.42 ? 218 ARG B NH1 1 ATOM 3848 N NH2 . ARG B 1 130 ? -37.207 24.356 -7.179 1.00 16.34 ? 218 ARG B NH2 1 ATOM 3849 N N . THR B 1 131 ? -40.034 26.255 -14.564 1.00 9.05 ? 219 THR B N 1 ATOM 3850 C CA . THR B 1 131 ? -39.867 27.076 -15.741 1.00 8.76 ? 219 THR B CA 1 ATOM 3851 C C . THR B 1 131 ? -39.697 28.535 -15.325 1.00 9.61 ? 219 THR B C 1 ATOM 3852 O O . THR B 1 131 ? -40.499 29.057 -14.562 1.00 9.59 ? 219 THR B O 1 ATOM 3853 C CB . THR B 1 131 ? -41.077 26.897 -16.686 1.00 10.91 ? 219 THR B CB 1 ATOM 3854 O OG1 . THR B 1 131 ? -41.133 25.530 -17.119 1.00 10.97 ? 219 THR B OG1 1 ATOM 3855 C CG2 . THR B 1 131 ? -40.890 27.704 -17.972 1.00 10.88 ? 219 THR B CG2 1 ATOM 3856 N N . ILE B 1 132 ? -38.624 29.156 -15.807 1.00 8.40 ? 220 ILE B N 1 ATOM 3857 C CA . ILE B 1 132 ? -38.337 30.553 -15.558 1.00 8.45 ? 220 ILE B CA 1 ATOM 3858 C C . ILE B 1 132 ? -38.513 31.302 -16.865 1.00 8.49 ? 220 ILE B C 1 ATOM 3859 O O . ILE B 1 132 ? -37.909 30.925 -17.881 1.00 7.78 ? 220 ILE B O 1 ATOM 3860 C CB . ILE B 1 132 ? -36.888 30.690 -15.031 1.00 8.42 ? 220 ILE B CB 1 ATOM 3861 C CG1 . ILE B 1 132 ? -36.737 29.900 -13.719 1.00 10.54 ? 220 ILE B CG1 1 ATOM 3862 C CG2 . ILE B 1 132 ? -36.569 32.145 -14.854 1.00 10.37 ? 220 ILE B CG2 1 ATOM 3863 C CD1 . ILE B 1 132 ? -35.313 29.498 -13.353 1.00 9.76 ? 220 ILE B CD1 1 ATOM 3864 N N . LEU B 1 133 ? -39.320 32.356 -16.821 1.00 7.96 ? 221 LEU B N 1 ATOM 3865 C CA . LEU B 1 133 ? -39.640 33.160 -17.977 1.00 8.33 ? 221 LEU B CA 1 ATOM 3866 C C . LEU B 1 133 ? -39.138 34.560 -17.850 1.00 7.92 ? 221 LEU B C 1 ATOM 3867 O O . LEU B 1 133 ? -39.298 35.170 -16.791 1.00 9.76 ? 221 LEU B O 1 ATOM 3868 C CB . LEU B 1 133 ? -41.149 33.275 -18.132 1.00 9.04 ? 221 LEU B CB 1 ATOM 3869 C CG . LEU B 1 133 ? -41.967 31.975 -18.215 1.00 8.89 ? 221 LEU B CG 1 ATOM 3870 C CD1 . LEU B 1 133 ? -43.395 32.284 -18.494 1.00 9.34 ? 221 LEU B CD1 1 ATOM 3871 C CD2 . LEU B 1 133 ? -41.479 31.100 -19.326 1.00 9.34 ? 221 LEU B CD2 1 ATOM 3872 N N . VAL B 1 134 ? -38.621 35.105 -18.947 1.00 6.75 ? 222 VAL B N 1 ATOM 3873 C CA . VAL B 1 134 ? -38.446 36.542 -19.109 1.00 7.70 ? 222 VAL B CA 1 ATOM 3874 C C . VAL B 1 134 ? -39.522 37.036 -20.060 1.00 8.76 ? 222 VAL B C 1 ATOM 3875 O O . VAL B 1 134 ? -39.671 36.495 -21.147 1.00 8.57 ? 222 VAL B O 1 ATOM 3876 C CB . VAL B 1 134 ? -37.043 36.893 -19.664 1.00 8.67 ? 222 VAL B CB 1 ATOM 3877 C CG1 . VAL B 1 134 ? -36.903 38.338 -20.034 1.00 10.16 ? 222 VAL B CG1 1 ATOM 3878 C CG2 . VAL B 1 134 ? -35.984 36.585 -18.621 1.00 9.55 ? 222 VAL B CG2 1 ATOM 3879 N N . ILE B 1 135 ? -40.227 38.079 -19.661 1.00 8.01 ? 223 ILE B N 1 ATOM 3880 C CA . ILE B 1 135 ? -41.383 38.570 -20.397 1.00 7.38 ? 223 ILE B CA 1 ATOM 3881 C C . ILE B 1 135 ? -40.999 39.804 -21.202 1.00 8.84 ? 223 ILE B C 1 ATOM 3882 O O . ILE B 1 135 ? -40.705 40.864 -20.638 1.00 8.32 ? 223 ILE B O 1 ATOM 3883 C CB . ILE B 1 135 ? -42.552 38.903 -19.452 1.00 8.23 ? 223 ILE B CB 1 ATOM 3884 C CG1 . ILE B 1 135 ? -42.958 37.679 -18.621 1.00 7.76 ? 223 ILE B CG1 1 ATOM 3885 C CG2 . ILE B 1 135 ? -43.777 39.320 -20.272 1.00 8.85 ? 223 ILE B CG2 1 ATOM 3886 C CD1 . ILE B 1 135 ? -43.259 36.424 -19.421 1.00 8.63 ? 223 ILE B CD1 1 ATOM 3887 N N . GLU B 1 136 ? -41.003 39.616 -22.527 1.00 7.79 ? 224 GLU B N 1 ATOM 3888 C CA . GLU B 1 136 ? -40.936 40.684 -23.545 1.00 7.54 ? 224 GLU B CA 1 ATOM 3889 C C . GLU B 1 136 ? -39.819 41.768 -23.379 1.00 8.23 ? 224 GLU B C 1 ATOM 3890 O O . GLU B 1 136 ? -40.084 42.926 -23.027 1.00 8.01 ? 224 GLU B O 1 ATOM 3891 C CB . GLU B 1 136 ? -42.295 41.309 -23.692 1.00 7.72 ? 224 GLU B CB 1 ATOM 3892 C CG . GLU B 1 136 ? -43.342 40.334 -24.236 1.00 6.77 ? 224 GLU B CG 1 ATOM 3893 C CD . GLU B 1 136 ? -43.110 39.908 -25.682 1.00 8.15 ? 224 GLU B CD 1 ATOM 3894 O OE1 . GLU B 1 136 ? -42.269 40.541 -26.423 1.00 9.47 ? 224 GLU B OE1 1 ATOM 3895 O OE2 . GLU B 1 136 ? -43.776 38.930 -26.113 1.00 8.64 ? 224 GLU B OE2 1 ATOM 3896 N N . PRO B 1 137 ? -38.574 41.396 -23.628 1.00 8.51 ? 225 PRO B N 1 ATOM 3897 C CA . PRO B 1 137 ? -37.468 42.368 -23.617 1.00 8.96 ? 225 PRO B CA 1 ATOM 3898 C C . PRO B 1 137 ? -37.791 43.616 -24.411 1.00 8.94 ? 225 PRO B C 1 ATOM 3899 O O . PRO B 1 137 ? -38.411 43.555 -25.470 1.00 9.59 ? 225 PRO B O 1 ATOM 3900 C CB . PRO B 1 137 ? -36.294 41.583 -24.194 1.00 8.33 ? 225 PRO B CB 1 ATOM 3901 C CG . PRO B 1 137 ? -36.582 40.204 -23.719 1.00 8.86 ? 225 PRO B CG 1 ATOM 3902 C CD . PRO B 1 137 ? -38.069 40.015 -23.815 1.00 8.28 ? 225 PRO B CD 1 ATOM 3903 N N . ASP B 1 138 ? -37.426 44.748 -23.794 1.00 9.50 ? 226 ASP B N 1 ATOM 3904 C CA . ASP B 1 138 ? -37.502 46.099 -24.357 1.00 8.62 ? 226 ASP B CA 1 ATOM 3905 C C . ASP B 1 138 ? -38.873 46.760 -24.299 1.00 9.61 ? 226 ASP B C 1 ATOM 3906 O O . ASP B 1 138 ? -38.941 47.990 -24.372 1.00 9.23 ? 226 ASP B O 1 ATOM 3907 C CB . ASP B 1 138 ? -37.004 46.157 -25.807 1.00 8.80 ? 226 ASP B CB 1 ATOM 3908 C CG . ASP B 1 138 ? -35.676 45.623 -25.978 1.00 8.35 ? 226 ASP B CG 1 ATOM 3909 O OD1 . ASP B 1 138 ? -34.792 45.762 -25.074 1.00 11.05 ? 226 ASP B OD1 1 ATOM 3910 O OD2 . ASP B 1 138 ? -35.374 45.088 -27.074 1.00 12.98 ? 226 ASP B OD2 1 ATOM 3911 N N . SER B 1 139 ? -39.929 45.983 -24.137 1.00 8.17 ? 227 SER B N 1 ATOM 3912 C CA . SER B 1 139 ? -41.289 46.514 -24.309 1.00 9.18 ? 227 SER B CA 1 ATOM 3913 C C . SER B 1 139 ? -41.631 47.615 -23.311 1.00 8.92 ? 227 SER B C 1 ATOM 3914 O O . SER B 1 139 ? -41.924 48.725 -23.685 1.00 7.96 ? 227 SER B O 1 ATOM 3915 C CB . SER B 1 139 ? -42.329 45.394 -24.215 1.00 9.22 ? 227 SER B CB 1 ATOM 3916 O OG . SER B 1 139 ? -42.134 44.657 -23.026 1.00 10.52 ? 227 SER B OG 1 ATOM 3917 N N . LEU B 1 140 ? -41.550 47.329 -22.024 1.00 8.64 ? 228 LEU B N 1 ATOM 3918 C CA . LEU B 1 140 ? -41.908 48.348 -21.030 1.00 9.01 ? 228 LEU B CA 1 ATOM 3919 C C . LEU B 1 140 ? -40.851 49.454 -20.928 1.00 8.65 ? 228 LEU B C 1 ATOM 3920 O O . LEU B 1 140 ? -41.175 50.601 -20.664 1.00 7.34 ? 228 LEU B O 1 ATOM 3921 C CB . LEU B 1 140 ? -42.196 47.691 -19.688 1.00 10.06 ? 228 LEU B CB 1 ATOM 3922 C CG . LEU B 1 140 ? -43.383 46.731 -19.758 1.00 12.56 ? 228 LEU B CG 1 ATOM 3923 C CD1 . LEU B 1 140 ? -43.697 46.194 -18.361 1.00 15.41 ? 228 LEU B CD1 1 ATOM 3924 C CD2 . LEU B 1 140 ? -44.585 47.354 -20.382 1.00 12.05 ? 228 LEU B CD2 1 ATOM 3925 N N . ALA B 1 141 ? -39.589 49.122 -21.182 1.00 6.95 ? 229 ALA B N 1 ATOM 3926 C CA . ALA B 1 141 ? -38.553 50.167 -21.179 1.00 6.82 ? 229 ALA B CA 1 ATOM 3927 C C . ALA B 1 141 ? -38.853 51.214 -22.278 1.00 7.33 ? 229 ALA B C 1 ATOM 3928 O O . ALA B 1 141 ? -38.749 52.430 -22.040 1.00 5.25 ? 229 ALA B O 1 ATOM 3929 C CB . ALA B 1 141 ? -37.214 49.562 -21.345 1.00 7.83 ? 229 ALA B CB 1 ATOM 3930 N N . ASN B 1 142 ? -39.325 50.756 -23.434 1.00 6.41 ? 230 ASN B N 1 ATOM 3931 C CA . ASN B 1 142 ? -39.733 51.673 -24.504 1.00 6.48 ? 230 ASN B CA 1 ATOM 3932 C C . ASN B 1 142 ? -40.917 52.557 -24.110 1.00 6.68 ? 230 ASN B C 1 ATOM 3933 O O . ASN B 1 142 ? -41.003 53.713 -24.523 1.00 7.60 ? 230 ASN B O 1 ATOM 3934 C CB . ASN B 1 142 ? -40.015 50.914 -25.807 1.00 5.55 ? 230 ASN B CB 1 ATOM 3935 C CG . ASN B 1 142 ? -38.733 50.601 -26.593 1.00 6.25 ? 230 ASN B CG 1 ATOM 3936 O OD1 . ASN B 1 142 ? -37.818 51.420 -26.627 1.00 9.25 ? 230 ASN B OD1 1 ATOM 3937 N ND2 . ASN B 1 142 ? -38.710 49.450 -27.296 1.00 5.96 ? 230 ASN B ND2 1 ATOM 3938 N N . MET B 1 143 ? -41.828 52.003 -23.312 1.00 7.52 ? 231 MET B N 1 ATOM 3939 C CA . MET B 1 143 ? -42.974 52.774 -22.832 1.00 7.77 ? 231 MET B CA 1 ATOM 3940 C C . MET B 1 143 ? -42.546 53.873 -21.895 1.00 8.33 ? 231 MET B C 1 ATOM 3941 O O . MET B 1 143 ? -43.213 54.895 -21.769 1.00 8.11 ? 231 MET B O 1 ATOM 3942 C CB . MET B 1 143 ? -44.018 51.880 -22.141 1.00 8.69 ? 231 MET B CB 1 ATOM 3943 C CG . MET B 1 143 ? -44.578 50.773 -23.000 1.00 10.56 ? 231 MET B CG 1 ATOM 3944 S SD . MET B 1 143 ? -45.393 51.359 -24.447 1.00 17.11 ? 231 MET B SD 1 ATOM 3945 C CE . MET B 1 143 ? -44.009 51.332 -25.729 1.00 14.95 ? 231 MET B CE 1 ATOM 3946 N N . VAL B 1 144 ? -41.435 53.685 -21.212 1.00 6.42 ? 232 VAL B N 1 ATOM 3947 C CA . VAL B 1 144 ? -40.943 54.726 -20.350 1.00 7.09 ? 232 VAL B CA 1 ATOM 3948 C C . VAL B 1 144 ? -40.265 55.858 -21.134 1.00 6.56 ? 232 VAL B C 1 ATOM 3949 O O . VAL B 1 144 ? -40.506 57.017 -20.861 1.00 5.95 ? 232 VAL B O 1 ATOM 3950 C CB . VAL B 1 144 ? -39.950 54.181 -19.288 1.00 5.67 ? 232 VAL B CB 1 ATOM 3951 C CG1 . VAL B 1 144 ? -39.425 55.320 -18.412 1.00 9.01 ? 232 VAL B CG1 1 ATOM 3952 C CG2 . VAL B 1 144 ? -40.576 53.117 -18.446 1.00 7.74 ? 232 VAL B CG2 1 ATOM 3953 N N . THR B 1 145 ? -39.356 55.541 -22.063 1.00 7.42 ? 233 THR B N 1 ATOM 3954 C CA . THR B 1 145 ? -38.527 56.581 -22.662 1.00 7.36 ? 233 THR B CA 1 ATOM 3955 C C . THR B 1 145 ? -38.852 56.982 -24.084 1.00 8.23 ? 233 THR B C 1 ATOM 3956 O O . THR B 1 145 ? -38.322 57.981 -24.577 1.00 7.19 ? 233 THR B O 1 ATOM 3957 C CB . THR B 1 145 ? -37.046 56.176 -22.630 1.00 8.24 ? 233 THR B CB 1 ATOM 3958 O OG1 . THR B 1 145 ? -36.825 55.087 -23.525 1.00 6.72 ? 233 THR B OG1 1 ATOM 3959 C CG2 . THR B 1 145 ? -36.655 55.687 -21.226 1.00 8.79 ? 233 THR B CG2 1 ATOM 3960 N N . ASN B 1 146 ? -39.656 56.196 -24.764 1.00 6.72 ? 234 ASN B N 1 ATOM 3961 C CA . ASN B 1 146 ? -39.823 56.353 -26.209 1.00 7.55 ? 234 ASN B CA 1 ATOM 3962 C C . ASN B 1 146 ? -41.257 56.678 -26.595 1.00 8.04 ? 234 ASN B C 1 ATOM 3963 O O . ASN B 1 146 ? -41.685 56.370 -27.716 1.00 8.23 ? 234 ASN B O 1 ATOM 3964 C CB . ASN B 1 146 ? -39.288 55.124 -26.957 1.00 6.59 ? 234 ASN B CB 1 ATOM 3965 C CG . ASN B 1 146 ? -37.774 55.187 -27.146 1.00 8.09 ? 234 ASN B CG 1 ATOM 3966 O OD1 . ASN B 1 146 ? -37.237 56.282 -27.465 1.00 9.13 ? 234 ASN B OD1 1 ATOM 3967 N ND2 . ASN B 1 146 ? -37.068 54.060 -26.906 1.00 7.13 ? 234 ASN B ND2 1 ATOM 3968 N N . MET B 1 147 ? -41.982 57.398 -25.744 1.00 8.39 ? 235 MET B N 1 ATOM 3969 C CA . MET B 1 147 ? -43.322 57.866 -26.175 1.00 10.22 ? 235 MET B CA 1 ATOM 3970 C C . MET B 1 147 ? -43.251 58.875 -27.319 1.00 10.79 ? 235 MET B C 1 ATOM 3971 O O . MET B 1 147 ? -44.249 59.152 -27.984 1.00 10.30 ? 235 MET B O 1 ATOM 3972 C CB . MET B 1 147 ? -44.122 58.453 -25.017 1.00 11.16 ? 235 MET B CB 1 ATOM 3973 C CG . MET B 1 147 ? -44.556 57.402 -24.012 1.00 12.92 ? 235 MET B CG 1 ATOM 3974 S SD . MET B 1 147 ? -45.579 55.984 -24.719 1.00 14.31 ? 235 MET B SD 1 ATOM 3975 C CE . MET B 1 147 ? -47.076 56.691 -25.060 1.00 16.02 ? 235 MET B CE 1 ATOM 3976 N N . ASN B 1 148 ? -42.082 59.467 -27.515 1.00 11.40 ? 236 ASN B N 1 ATOM 3977 C CA . ASN B 1 148 ? -41.830 60.354 -28.665 1.00 12.86 ? 236 ASN B CA 1 ATOM 3978 C C . ASN B 1 148 ? -41.697 59.597 -30.015 1.00 12.76 ? 236 ASN B C 1 ATOM 3979 O O . ASN B 1 148 ? -41.654 60.232 -31.086 1.00 13.62 ? 236 ASN B O 1 ATOM 3980 C CB . ASN B 1 148 ? -40.518 61.120 -28.432 1.00 14.54 ? 236 ASN B CB 1 ATOM 3981 C CG . ASN B 1 148 ? -39.344 60.173 -28.091 1.00 18.26 ? 236 ASN B CG 1 ATOM 3982 O OD1 . ASN B 1 148 ? -38.417 59.902 -28.921 1.00 25.44 ? 236 ASN B OD1 1 ATOM 3983 N ND2 . ASN B 1 148 ? -39.362 59.664 -26.867 1.00 21.70 ? 236 ASN B ND2 1 ATOM 3984 N N . VAL B 1 149 ? -41.547 58.268 -29.970 1.00 11.40 ? 237 VAL B N 1 ATOM 3985 C CA . VAL B 1 149 ? -41.423 57.481 -31.190 1.00 11.66 ? 237 VAL B CA 1 ATOM 3986 C C . VAL B 1 149 ? -42.819 57.033 -31.554 1.00 11.07 ? 237 VAL B C 1 ATOM 3987 O O . VAL B 1 149 ? -43.416 56.307 -30.782 1.00 11.20 ? 237 VAL B O 1 ATOM 3988 C CB . VAL B 1 149 ? -40.560 56.230 -30.977 1.00 10.96 ? 237 VAL B CB 1 ATOM 3989 C CG1 . VAL B 1 149 ? -40.506 55.365 -32.234 1.00 12.74 ? 237 VAL B CG1 1 ATOM 3990 C CG2 . VAL B 1 149 ? -39.126 56.602 -30.550 1.00 11.95 ? 237 VAL B CG2 1 ATOM 3991 N N . PRO B 1 150 ? -43.339 57.431 -32.716 1.00 11.35 ? 238 PRO B N 1 ATOM 3992 C CA . PRO B 1 150 ? -44.693 57.052 -33.125 1.00 10.36 ? 238 PRO B CA 1 ATOM 3993 C C . PRO B 1 150 ? -45.075 55.568 -32.971 1.00 10.40 ? 238 PRO B C 1 ATOM 3994 O O . PRO B 1 150 ? -46.164 55.264 -32.449 1.00 9.38 ? 238 PRO B O 1 ATOM 3995 C CB . PRO B 1 150 ? -44.735 57.468 -34.589 1.00 10.98 ? 238 PRO B CB 1 ATOM 3996 C CG . PRO B 1 150 ? -43.842 58.679 -34.637 1.00 12.10 ? 238 PRO B CG 1 ATOM 3997 C CD . PRO B 1 150 ? -42.687 58.276 -33.740 1.00 11.31 ? 238 PRO B CD 1 ATOM 3998 N N . LYS B 1 151 ? -44.222 54.637 -33.395 1.00 10.07 ? 239 LYS B N 1 ATOM 3999 C CA . LYS B 1 151 ? -44.555 53.228 -33.264 1.00 9.50 ? 239 LYS B CA 1 ATOM 4000 C C . LYS B 1 151 ? -44.736 52.822 -31.785 1.00 9.64 ? 239 LYS B C 1 ATOM 4001 O O . LYS B 1 151 ? -45.661 52.048 -31.464 1.00 9.95 ? 239 LYS B O 1 ATOM 4002 C CB . LYS B 1 151 ? -43.530 52.334 -33.952 1.00 9.41 ? 239 LYS B CB 1 ATOM 4003 C CG . LYS B 1 151 ? -43.929 50.862 -34.053 1.00 10.03 ? 239 LYS B CG 1 ATOM 4004 C CD . LYS B 1 151 ? -42.953 50.082 -34.938 1.00 12.61 ? 239 LYS B CD 1 ATOM 4005 C CE . LYS B 1 151 ? -43.229 48.582 -34.972 1.00 15.35 ? 239 LYS B CE 1 ATOM 4006 N NZ . LYS B 1 151 ? -42.226 47.901 -35.903 1.00 15.03 ? 239 LYS B NZ 1 ATOM 4007 N N . CYS B 1 152 ? -43.925 53.380 -30.898 1.00 8.58 ? 240 CYS B N 1 ATOM 4008 C CA . CYS B 1 152 ? -44.039 53.073 -29.467 1.00 8.86 ? 240 CYS B CA 1 ATOM 4009 C C . CYS B 1 152 ? -45.278 53.707 -28.873 1.00 9.48 ? 240 CYS B C 1 ATOM 4010 O O . CYS B 1 152 ? -46.069 53.040 -28.203 1.00 9.28 ? 240 CYS B O 1 ATOM 4011 C CB . CYS B 1 152 ? -42.807 53.569 -28.703 1.00 8.75 ? 240 CYS B CB 1 ATOM 4012 S SG . CYS B 1 152 ? -41.301 52.651 -29.139 1.00 10.22 ? 240 CYS B SG 1 ATOM 4013 N N . SER B 1 153 ? -45.490 54.986 -29.151 1.00 9.10 ? 241 SER B N 1 ATOM 4014 C CA . SER B 1 153 ? -46.668 55.659 -28.602 1.00 10.32 ? 241 SER B CA 1 ATOM 4015 C C . SER B 1 153 ? -47.950 54.980 -29.109 1.00 9.50 ? 241 SER B C 1 ATOM 4016 O O . SER B 1 153 ? -48.933 54.841 -28.375 1.00 9.96 ? 241 SER B O 1 ATOM 4017 C CB . SER B 1 153 ? -46.633 57.146 -28.929 1.00 11.58 ? 241 SER B CB 1 ATOM 4018 O OG . SER B 1 153 ? -46.682 57.401 -30.314 1.00 15.59 ? 241 SER B OG 1 ATOM 4019 N N . GLY B 1 154 ? -47.920 54.533 -30.364 1.00 9.62 ? 242 GLY B N 1 ATOM 4020 C CA . GLY B 1 154 ? -49.030 53.809 -30.971 1.00 10.02 ? 242 GLY B CA 1 ATOM 4021 C C . GLY B 1 154 ? -49.307 52.450 -30.335 1.00 10.15 ? 242 GLY B C 1 ATOM 4022 O O . GLY B 1 154 ? -50.449 51.995 -30.331 1.00 10.91 ? 242 GLY B O 1 ATOM 4023 N N . ALA B 1 155 ? -48.282 51.827 -29.789 1.00 10.53 ? 243 ALA B N 1 ATOM 4024 C CA . ALA B 1 155 ? -48.368 50.493 -29.202 1.00 11.06 ? 243 ALA B CA 1 ATOM 4025 C C . ALA B 1 155 ? -48.539 50.508 -27.672 1.00 11.37 ? 243 ALA B C 1 ATOM 4026 O O . ALA B 1 155 ? -48.780 49.457 -27.085 1.00 9.60 ? 243 ALA B O 1 ATOM 4027 C CB . ALA B 1 155 ? -47.121 49.681 -29.563 1.00 10.88 ? 243 ALA B CB 1 ATOM 4028 N N . ALA B 1 156 ? -48.410 51.680 -27.040 1.00 12.56 ? 244 ALA B N 1 ATOM 4029 C CA . ALA B 1 156 ? -48.398 51.776 -25.573 1.00 13.40 ? 244 ALA B CA 1 ATOM 4030 C C . ALA B 1 156 ? -49.587 51.041 -24.926 1.00 13.62 ? 244 ALA B C 1 ATOM 4031 O O . ALA B 1 156 ? -49.380 50.190 -24.059 1.00 14.25 ? 244 ALA B O 1 ATOM 4032 C CB . ALA B 1 156 ? -48.393 53.229 -25.122 1.00 14.37 ? 244 ALA B CB 1 ATOM 4033 N N . SER B 1 157 ? -50.807 51.341 -25.356 1.00 13.14 ? 245 SER B N 1 ATOM 4034 C CA . SER B 1 157 ? -51.987 50.829 -24.644 1.00 13.30 ? 245 SER B CA 1 ATOM 4035 C C . SER B 1 157 ? -52.065 49.303 -24.865 1.00 12.10 ? 245 SER B C 1 ATOM 4036 O O . SER B 1 157 ? -52.484 48.551 -23.987 1.00 10.85 ? 245 SER B O 1 ATOM 4037 C CB . SER B 1 157 ? -53.261 51.539 -25.066 1.00 13.77 ? 245 SER B CB 1 ATOM 4038 O OG . SER B 1 157 ? -53.515 51.385 -26.452 1.00 17.40 ? 245 SER B OG 1 ATOM 4039 N N . THR B 1 158 ? -51.576 48.870 -26.025 1.00 10.83 ? 246 THR B N 1 ATOM 4040 C CA . THR B 1 158 ? -51.589 47.473 -26.424 1.00 9.92 ? 246 THR B CA 1 ATOM 4041 C C . THR B 1 158 ? -50.582 46.710 -25.627 1.00 10.19 ? 246 THR B C 1 ATOM 4042 O O . THR B 1 158 ? -50.892 45.675 -25.067 1.00 9.89 ? 246 THR B O 1 ATOM 4043 C CB . THR B 1 158 ? -51.286 47.363 -27.914 1.00 9.49 ? 246 THR B CB 1 ATOM 4044 O OG1 . THR B 1 158 ? -52.393 47.898 -28.636 1.00 8.61 ? 246 THR B OG1 1 ATOM 4045 C CG2 . THR B 1 158 ? -51.192 45.905 -28.378 1.00 10.23 ? 246 THR B CG2 1 ATOM 4046 N N . TYR B 1 159 ? -49.373 47.244 -25.559 1.00 9.15 ? 247 TYR B N 1 ATOM 4047 C CA . TYR B 1 159 ? -48.337 46.644 -24.729 1.00 9.73 ? 247 TYR B CA 1 ATOM 4048 C C . TYR B 1 159 ? -48.834 46.489 -23.305 1.00 9.92 ? 247 TYR B C 1 ATOM 4049 O O . TYR B 1 159 ? -48.632 45.457 -22.687 1.00 9.87 ? 247 TYR B O 1 ATOM 4050 C CB . TYR B 1 159 ? -47.099 47.532 -24.690 1.00 10.44 ? 247 TYR B CB 1 ATOM 4051 C CG . TYR B 1 159 ? -46.092 47.377 -25.841 1.00 9.51 ? 247 TYR B CG 1 ATOM 4052 C CD1 . TYR B 1 159 ? -46.432 46.777 -27.047 1.00 9.00 ? 247 TYR B CD1 1 ATOM 4053 C CD2 . TYR B 1 159 ? -44.837 47.906 -25.714 1.00 9.45 ? 247 TYR B CD2 1 ATOM 4054 C CE1 . TYR B 1 159 ? -45.522 46.688 -28.097 1.00 9.02 ? 247 TYR B CE1 1 ATOM 4055 C CE2 . TYR B 1 159 ? -43.889 47.804 -26.752 1.00 9.48 ? 247 TYR B CE2 1 ATOM 4056 C CZ . TYR B 1 159 ? -44.243 47.208 -27.944 1.00 10.90 ? 247 TYR B CZ 1 ATOM 4057 O OH . TYR B 1 159 ? -43.279 47.138 -28.938 1.00 13.21 ? 247 TYR B OH 1 ATOM 4058 N N . ARG B 1 160 ? -49.512 47.511 -22.796 1.00 10.88 ? 248 ARG B N 1 ATOM 4059 C CA . ARG B 1 160 ? -50.027 47.453 -21.443 1.00 11.33 ? 248 ARG B CA 1 ATOM 4060 C C . ARG B 1 160 ? -51.012 46.310 -21.246 1.00 10.62 ? 248 ARG B C 1 ATOM 4061 O O . ARG B 1 160 ? -50.863 45.465 -20.326 1.00 11.12 ? 248 ARG B O 1 ATOM 4062 C CB . ARG B 1 160 ? -50.675 48.777 -21.116 1.00 11.93 ? 248 ARG B CB 1 ATOM 4063 C CG . ARG B 1 160 ? -51.188 48.878 -19.742 1.00 15.91 ? 248 ARG B CG 1 ATOM 4064 C CD . ARG B 1 160 ? -51.308 50.347 -19.233 1.00 20.16 ? 248 ARG B CD 1 ATOM 4065 N NE . ARG B 1 160 ? -50.772 50.338 -17.886 1.00 23.26 ? 248 ARG B NE 1 ATOM 4066 C CZ . ARG B 1 160 ? -51.446 49.886 -16.834 1.00 21.43 ? 248 ARG B CZ 1 ATOM 4067 N NH1 . ARG B 1 160 ? -52.726 49.487 -16.950 1.00 22.79 ? 248 ARG B NH1 1 ATOM 4068 N NH2 . ARG B 1 160 ? -50.838 49.855 -15.660 1.00 22.09 ? 248 ARG B NH2 1 ATOM 4069 N N . GLU B 1 161 ? -52.005 46.252 -22.125 1.00 9.93 ? 249 GLU B N 1 ATOM 4070 C CA . GLU B 1 161 ? -53.075 45.268 -22.001 1.00 10.65 ? 249 GLU B CA 1 ATOM 4071 C C . GLU B 1 161 ? -52.466 43.859 -22.137 1.00 9.51 ? 249 GLU B C 1 ATOM 4072 O O . GLU B 1 161 ? -52.799 42.918 -21.363 1.00 8.71 ? 249 GLU B O 1 ATOM 4073 C CB . GLU B 1 161 ? -54.122 45.512 -23.096 1.00 10.67 ? 249 GLU B CB 1 ATOM 4074 C CG . GLU B 1 161 ? -55.263 44.509 -23.151 1.00 17.21 ? 249 GLU B CG 1 ATOM 4075 C CD . GLU B 1 161 ? -55.996 44.483 -24.521 1.00 24.50 ? 249 GLU B CD 1 ATOM 4076 O OE1 . GLU B 1 161 ? -55.663 45.327 -25.416 1.00 28.75 ? 249 GLU B OE1 1 ATOM 4077 O OE2 . GLU B 1 161 ? -56.891 43.595 -24.713 1.00 26.63 ? 249 GLU B OE2 1 ATOM 4078 N N . LEU B 1 162 ? -51.579 43.710 -23.116 1.00 8.55 ? 250 LEU B N 1 ATOM 4079 C CA . LEU B 1 162 ? -50.986 42.376 -23.407 1.00 8.75 ? 250 LEU B CA 1 ATOM 4080 C C . LEU B 1 162 ? -50.052 41.899 -22.329 1.00 7.85 ? 250 LEU B C 1 ATOM 4081 O O . LEU B 1 162 ? -49.952 40.694 -22.045 1.00 8.72 ? 250 LEU B O 1 ATOM 4082 C CB . LEU B 1 162 ? -50.332 42.337 -24.793 1.00 8.27 ? 250 LEU B CB 1 ATOM 4083 C CG . LEU B 1 162 ? -51.350 42.532 -25.936 1.00 9.19 ? 250 LEU B CG 1 ATOM 4084 C CD1 . LEU B 1 162 ? -50.617 42.570 -27.279 1.00 8.30 ? 250 LEU B CD1 1 ATOM 4085 C CD2 . LEU B 1 162 ? -52.407 41.458 -25.943 1.00 8.31 ? 250 LEU B CD2 1 ATOM 4086 N N . THR B 1 163 ? -49.296 42.817 -21.740 1.00 8.42 ? 251 THR B N 1 ATOM 4087 C CA . THR B 1 163 ? -48.391 42.470 -20.672 1.00 8.36 ? 251 THR B CA 1 ATOM 4088 C C . THR B 1 163 ? -49.203 41.978 -19.457 1.00 7.82 ? 251 THR B C 1 ATOM 4089 O O . THR B 1 163 ? -48.917 40.939 -18.893 1.00 8.52 ? 251 THR B O 1 ATOM 4090 C CB . THR B 1 163 ? -47.581 43.690 -20.294 1.00 9.37 ? 251 THR B CB 1 ATOM 4091 O OG1 . THR B 1 163 ? -46.668 44.009 -21.366 1.00 8.92 ? 251 THR B OG1 1 ATOM 4092 C CG2 . THR B 1 163 ? -46.675 43.403 -19.134 1.00 9.34 ? 251 THR B CG2 1 ATOM 4093 N N . ILE B 1 164 ? -50.205 42.731 -19.069 1.00 7.80 ? 252 ILE B N 1 ATOM 4094 C CA . ILE B 1 164 ? -51.087 42.304 -17.966 1.00 7.42 ? 252 ILE B CA 1 ATOM 4095 C C . ILE B 1 164 ? -51.677 40.923 -18.297 1.00 8.12 ? 252 ILE B C 1 ATOM 4096 O O . ILE B 1 164 ? -51.726 40.032 -17.446 1.00 8.87 ? 252 ILE B O 1 ATOM 4097 C CB . ILE B 1 164 ? -52.153 43.342 -17.712 1.00 8.67 ? 252 ILE B CB 1 ATOM 4098 C CG1 . ILE B 1 164 ? -51.517 44.608 -17.091 1.00 10.42 ? 252 ILE B CG1 1 ATOM 4099 C CG2 . ILE B 1 164 ? -53.204 42.798 -16.768 1.00 7.20 ? 252 ILE B CG2 1 ATOM 4100 C CD1 . ILE B 1 164 ? -52.506 45.705 -16.956 1.00 11.22 ? 252 ILE B CD1 1 ATOM 4101 N N . TYR B 1 165 ? -52.122 40.740 -19.531 1.00 8.37 ? 253 TYR B N 1 ATOM 4102 C CA . TYR B 1 165 ? -52.657 39.452 -19.966 1.00 9.02 ? 253 TYR B CA 1 ATOM 4103 C C . TYR B 1 165 ? -51.651 38.310 -19.780 1.00 8.72 ? 253 TYR B C 1 ATOM 4104 O O . TYR B 1 165 ? -51.971 37.244 -19.262 1.00 9.42 ? 253 TYR B O 1 ATOM 4105 C CB . TYR B 1 165 ? -53.075 39.524 -21.435 1.00 9.29 ? 253 TYR B CB 1 ATOM 4106 C CG . TYR B 1 165 ? -53.877 38.325 -21.886 1.00 7.44 ? 253 TYR B CG 1 ATOM 4107 C CD1 . TYR B 1 165 ? -55.206 38.190 -21.515 1.00 10.57 ? 253 TYR B CD1 1 ATOM 4108 C CD2 . TYR B 1 165 ? -53.321 37.352 -22.673 1.00 7.54 ? 253 TYR B CD2 1 ATOM 4109 C CE1 . TYR B 1 165 ? -55.943 37.106 -21.927 1.00 10.84 ? 253 TYR B CE1 1 ATOM 4110 C CE2 . TYR B 1 165 ? -54.014 36.286 -23.079 1.00 8.91 ? 253 TYR B CE2 1 ATOM 4111 C CZ . TYR B 1 165 ? -55.353 36.174 -22.734 1.00 10.67 ? 253 TYR B CZ 1 ATOM 4112 O OH . TYR B 1 165 ? -56.062 35.059 -23.116 1.00 15.07 ? 253 TYR B OH 1 ATOM 4113 N N . ALA B 1 166 ? -50.429 38.531 -20.214 1.00 8.74 ? 254 ALA B N 1 ATOM 4114 C CA . ALA B 1 166 ? -49.393 37.520 -20.077 1.00 9.46 ? 254 ALA B CA 1 ATOM 4115 C C . ALA B 1 166 ? -49.096 37.175 -18.619 1.00 8.02 ? 254 ALA B C 1 ATOM 4116 O O . ALA B 1 166 ? -48.976 36.017 -18.274 1.00 8.16 ? 254 ALA B O 1 ATOM 4117 C CB . ALA B 1 166 ? -48.153 37.990 -20.750 1.00 8.51 ? 254 ALA B CB 1 ATOM 4118 N N . LEU B 1 167 ? -49.001 38.187 -17.764 1.00 7.87 ? 255 LEU B N 1 ATOM 4119 C CA . LEU B 1 167 ? -48.672 37.975 -16.352 1.00 7.03 ? 255 LEU B CA 1 ATOM 4120 C C . LEU B 1 167 ? -49.778 37.201 -15.660 1.00 8.32 ? 255 LEU B C 1 ATOM 4121 O O . LEU B 1 167 ? -49.504 36.418 -14.784 1.00 9.22 ? 255 LEU B O 1 ATOM 4122 C CB . LEU B 1 167 ? -48.442 39.307 -15.623 1.00 7.97 ? 255 LEU B CB 1 ATOM 4123 C CG . LEU B 1 167 ? -47.382 40.263 -16.175 1.00 8.41 ? 255 LEU B CG 1 ATOM 4124 C CD1 . LEU B 1 167 ? -47.396 41.528 -15.372 1.00 10.69 ? 255 LEU B CD1 1 ATOM 4125 C CD2 . LEU B 1 167 ? -46.036 39.667 -16.108 1.00 9.72 ? 255 LEU B CD2 1 ATOM 4126 N N . LYS B 1 168 ? -51.039 37.433 -16.030 1.00 7.55 ? 256 LYS B N 1 ATOM 4127 C CA . LYS B 1 168 ? -52.116 36.667 -15.430 1.00 8.43 ? 256 LYS B CA 1 ATOM 4128 C C . LYS B 1 168 ? -52.204 35.251 -16.016 1.00 8.39 ? 256 LYS B C 1 ATOM 4129 O O . LYS B 1 168 ? -52.360 34.264 -15.274 1.00 7.83 ? 256 LYS B O 1 ATOM 4130 C CB . LYS B 1 168 ? -53.446 37.383 -15.602 1.00 9.11 ? 256 LYS B CB 1 ATOM 4131 C CG . LYS B 1 168 ? -53.543 38.657 -14.769 1.00 11.90 ? 256 LYS B CG 1 ATOM 4132 C CD . LYS B 1 168 ? -54.828 39.405 -15.049 1.00 15.20 ? 256 LYS B CD 1 ATOM 4133 C CE . LYS B 1 168 ? -55.916 39.091 -14.039 1.00 18.04 ? 256 LYS B CE 1 ATOM 4134 N NZ . LYS B 1 168 ? -56.889 40.252 -13.849 1.00 19.93 ? 256 LYS B NZ 1 ATOM 4135 N N . GLN B 1 169 ? -52.113 35.138 -17.338 1.00 7.78 ? 257 GLN B N 1 ATOM 4136 C CA . GLN B 1 169 ? -52.189 33.834 -17.971 1.00 9.47 ? 257 GLN B CA 1 ATOM 4137 C C . GLN B 1 169 ? -51.040 32.865 -17.633 1.00 8.40 ? 257 GLN B C 1 ATOM 4138 O O . GLN B 1 169 ? -51.243 31.643 -17.604 1.00 9.46 ? 257 GLN B O 1 ATOM 4139 C CB . GLN B 1 169 ? -52.342 33.979 -19.468 1.00 9.86 ? 257 GLN B CB 1 ATOM 4140 C CG . GLN B 1 169 ? -53.715 34.462 -19.878 1.00 10.09 ? 257 GLN B CG 1 ATOM 4141 C CD . GLN B 1 169 ? -54.772 33.401 -19.714 1.00 16.00 ? 257 GLN B CD 1 ATOM 4142 O OE1 . GLN B 1 169 ? -55.439 33.334 -18.679 1.00 13.29 ? 257 GLN B OE1 1 ATOM 4143 N NE2 . GLN B 1 169 ? -54.889 32.538 -20.705 1.00 17.15 ? 257 GLN B NE2 1 ATOM 4144 N N . LEU B 1 170 ? -49.866 33.393 -17.339 1.00 7.49 ? 258 LEU B N 1 ATOM 4145 C CA . LEU B 1 170 ? -48.686 32.533 -17.140 1.00 7.39 ? 258 LEU B CA 1 ATOM 4146 C C . LEU B 1 170 ? -48.361 32.431 -15.635 1.00 7.46 ? 258 LEU B C 1 ATOM 4147 O O . LEU B 1 170 ? -47.307 31.954 -15.239 1.00 8.80 ? 258 LEU B O 1 ATOM 4148 C CB . LEU B 1 170 ? -47.474 33.004 -17.960 1.00 8.32 ? 258 LEU B CB 1 ATOM 4149 C CG . LEU B 1 170 ? -47.714 33.140 -19.470 1.00 7.31 ? 258 LEU B CG 1 ATOM 4150 C CD1 . LEU B 1 170 ? -46.507 33.691 -20.127 1.00 9.18 ? 258 LEU B CD1 1 ATOM 4151 C CD2 . LEU B 1 170 ? -48.056 31.787 -20.044 1.00 10.31 ? 258 LEU B CD2 1 ATOM 4152 N N . ASP B 1 171 ? -49.282 32.934 -14.819 1.00 7.42 ? 259 ASP B N 1 ATOM 4153 C CA . ASP B 1 171 ? -49.228 32.809 -13.355 1.00 7.82 ? 259 ASP B CA 1 ATOM 4154 C C . ASP B 1 171 ? -49.663 31.414 -12.947 1.00 7.97 ? 259 ASP B C 1 ATOM 4155 O O . ASP B 1 171 ? -50.828 31.162 -12.576 1.00 8.53 ? 259 ASP B O 1 ATOM 4156 C CB . ASP B 1 171 ? -50.139 33.844 -12.730 1.00 7.68 ? 259 ASP B CB 1 ATOM 4157 C CG . ASP B 1 171 ? -50.172 33.793 -11.211 1.00 8.14 ? 259 ASP B CG 1 ATOM 4158 O OD1 . ASP B 1 171 ? -49.171 33.416 -10.552 1.00 8.29 ? 259 ASP B OD1 1 ATOM 4159 O OD2 . ASP B 1 171 ? -51.195 34.177 -10.592 1.00 8.00 ? 259 ASP B OD2 1 ATOM 4160 N N . LEU B 1 172 ? -48.683 30.525 -13.011 1.00 7.07 ? 260 LEU B N 1 ATOM 4161 C CA . LEU B 1 172 ? -48.871 29.120 -12.689 1.00 6.07 ? 260 LEU B CA 1 ATOM 4162 C C . LEU B 1 172 ? -47.945 28.705 -11.563 1.00 6.24 ? 260 LEU B C 1 ATOM 4163 O O . LEU B 1 172 ? -46.830 29.229 -11.424 1.00 5.20 ? 260 LEU B O 1 ATOM 4164 C CB . LEU B 1 172 ? -48.556 28.275 -13.935 1.00 5.26 ? 260 LEU B CB 1 ATOM 4165 C CG . LEU B 1 172 ? -49.319 28.663 -15.205 1.00 5.56 ? 260 LEU B CG 1 ATOM 4166 C CD1 . LEU B 1 172 ? -48.756 28.095 -16.480 1.00 7.28 ? 260 LEU B CD1 1 ATOM 4167 C CD2 . LEU B 1 172 ? -50.750 28.209 -15.059 1.00 5.76 ? 260 LEU B CD2 1 ATOM 4168 N N . PRO B 1 173 ? -48.348 27.696 -10.802 1.00 7.06 ? 261 PRO B N 1 ATOM 4169 C CA . PRO B 1 173 ? -47.572 27.258 -9.624 1.00 7.75 ? 261 PRO B CA 1 ATOM 4170 C C . PRO B 1 173 ? -46.091 26.937 -9.789 1.00 8.30 ? 261 PRO B C 1 ATOM 4171 O O . PRO B 1 173 ? -45.316 27.106 -8.830 1.00 9.16 ? 261 PRO B O 1 ATOM 4172 C CB . PRO B 1 173 ? -48.278 25.973 -9.207 1.00 8.02 ? 261 PRO B CB 1 ATOM 4173 C CG . PRO B 1 173 ? -49.652 26.161 -9.610 1.00 9.74 ? 261 PRO B CG 1 ATOM 4174 C CD . PRO B 1 173 ? -49.609 26.934 -10.946 1.00 8.45 ? 261 PRO B CD 1 ATOM 4175 N N . HIS B 1 174 ? -45.699 26.446 -10.961 1.00 7.27 ? 262 HIS B N 1 ATOM 4176 C CA . HIS B 1 174 ? -44.309 26.025 -11.196 1.00 7.37 ? 262 HIS B CA 1 ATOM 4177 C C . HIS B 1 174 ? -43.491 27.051 -12.015 1.00 7.07 ? 262 HIS B C 1 ATOM 4178 O O . HIS B 1 174 ? -42.334 26.787 -12.394 1.00 7.43 ? 262 HIS B O 1 ATOM 4179 C CB . HIS B 1 174 ? -44.295 24.710 -11.952 1.00 6.66 ? 262 HIS B CB 1 ATOM 4180 C CG . HIS B 1 174 ? -44.905 24.831 -13.318 1.00 10.67 ? 262 HIS B CG 1 ATOM 4181 N ND1 . HIS B 1 174 ? -46.231 25.187 -13.506 1.00 11.25 ? 262 HIS B ND1 1 ATOM 4182 C CD2 . HIS B 1 174 ? -44.372 24.691 -14.555 1.00 11.11 ? 262 HIS B CD2 1 ATOM 4183 C CE1 . HIS B 1 174 ? -46.474 25.245 -14.808 1.00 13.09 ? 262 HIS B CE1 1 ATOM 4184 N NE2 . HIS B 1 174 ? -45.370 24.950 -15.462 1.00 12.58 ? 262 HIS B NE2 1 ATOM 4185 N N . VAL B 1 175 ? -44.072 28.219 -12.275 1.00 6.17 ? 263 VAL B N 1 ATOM 4186 C CA . VAL B 1 175 ? -43.472 29.254 -13.117 1.00 6.81 ? 263 VAL B CA 1 ATOM 4187 C C . VAL B 1 175 ? -42.930 30.397 -12.242 1.00 7.33 ? 263 VAL B C 1 ATOM 4188 O O . VAL B 1 175 ? -43.561 30.782 -11.252 1.00 7.80 ? 263 VAL B O 1 ATOM 4189 C CB . VAL B 1 175 ? -44.544 29.818 -14.119 1.00 8.33 ? 263 VAL B CB 1 ATOM 4190 C CG1 . VAL B 1 175 ? -44.072 31.111 -14.803 1.00 8.54 ? 263 VAL B CG1 1 ATOM 4191 C CG2 . VAL B 1 175 ? -44.861 28.792 -15.182 1.00 6.47 ? 263 VAL B CG2 1 ATOM 4192 N N . ALA B 1 176 ? -41.804 30.965 -12.639 1.00 7.53 ? 264 ALA B N 1 ATOM 4193 C CA . ALA B 1 176 ? -41.364 32.270 -12.156 1.00 6.83 ? 264 ALA B CA 1 ATOM 4194 C C . ALA B 1 176 ? -41.181 33.194 -13.362 1.00 5.86 ? 264 ALA B C 1 ATOM 4195 O O . ALA B 1 176 ? -40.517 32.803 -14.339 1.00 6.41 ? 264 ALA B O 1 ATOM 4196 C CB . ALA B 1 176 ? -40.050 32.179 -11.395 1.00 7.30 ? 264 ALA B CB 1 ATOM 4197 N N . MET B 1 177 ? -41.725 34.401 -13.267 1.00 6.35 ? 265 MET B N 1 ATOM 4198 C CA . MET B 1 177 ? -41.659 35.421 -14.309 1.00 6.54 ? 265 MET B CA 1 ATOM 4199 C C . MET B 1 177 ? -40.851 36.604 -13.844 1.00 6.96 ? 265 MET B C 1 ATOM 4200 O O . MET B 1 177 ? -40.996 37.075 -12.710 1.00 6.08 ? 265 MET B O 1 ATOM 4201 C CB . MET B 1 177 ? -43.071 35.944 -14.693 1.00 7.32 ? 265 MET B CB 1 ATOM 4202 C CG . MET B 1 177 ? -43.812 35.036 -15.647 1.00 9.20 ? 265 MET B CG 1 ATOM 4203 S SD . MET B 1 177 ? -45.389 35.617 -16.008 1.00 10.27 ? 265 MET B SD 1 ATOM 4204 C CE . MET B 1 177 ? -46.244 35.186 -14.502 1.00 10.23 ? 265 MET B CE 1 ATOM 4205 N N . TYR B 1 178 ? -40.006 37.077 -14.746 1.00 6.87 ? 266 TYR B N 1 ATOM 4206 C CA . TYR B 1 178 ? -39.307 38.341 -14.566 1.00 7.07 ? 266 TYR B CA 1 ATOM 4207 C C . TYR B 1 178 ? -39.691 39.234 -15.743 1.00 7.18 ? 266 TYR B C 1 ATOM 4208 O O . TYR B 1 178 ? -39.451 38.872 -16.917 1.00 8.03 ? 266 TYR B O 1 ATOM 4209 C CB . TYR B 1 178 ? -37.806 38.105 -14.577 1.00 6.13 ? 266 TYR B CB 1 ATOM 4210 C CG . TYR B 1 178 ? -37.303 37.251 -13.449 1.00 6.28 ? 266 TYR B CG 1 ATOM 4211 C CD1 . TYR B 1 178 ? -37.299 35.857 -13.536 1.00 6.25 ? 266 TYR B CD1 1 ATOM 4212 C CD2 . TYR B 1 178 ? -36.852 37.823 -12.271 1.00 6.66 ? 266 TYR B CD2 1 ATOM 4213 C CE1 . TYR B 1 178 ? -36.875 35.097 -12.487 1.00 6.35 ? 266 TYR B CE1 1 ATOM 4214 C CE2 . TYR B 1 178 ? -36.410 37.057 -11.201 1.00 3.20 ? 266 TYR B CE2 1 ATOM 4215 C CZ . TYR B 1 178 ? -36.412 35.690 -11.314 1.00 6.91 ? 266 TYR B CZ 1 ATOM 4216 O OH . TYR B 1 178 ? -35.937 34.893 -10.302 1.00 7.90 ? 266 TYR B OH 1 ATOM 4217 N N . MET B 1 179 ? -40.293 40.384 -15.483 1.00 7.59 ? 267 MET B N 1 ATOM 4218 C CA . MET B 1 179 ? -40.531 41.320 -16.579 1.00 8.00 ? 267 MET B CA 1 ATOM 4219 C C . MET B 1 179 ? -39.182 41.995 -17.008 1.00 7.43 ? 267 MET B C 1 ATOM 4220 O O . MET B 1 179 ? -38.353 42.359 -16.189 1.00 6.69 ? 267 MET B O 1 ATOM 4221 C CB . MET B 1 179 ? -41.519 42.382 -16.156 1.00 8.93 ? 267 MET B CB 1 ATOM 4222 C CG . MET B 1 179 ? -42.947 41.975 -16.258 1.00 12.20 ? 267 MET B CG 1 ATOM 4223 S SD . MET B 1 179 ? -43.950 43.408 -15.727 1.00 15.97 ? 267 MET B SD 1 ATOM 4224 C CE . MET B 1 179 ? -43.700 43.115 -13.971 1.00 7.64 ? 267 MET B CE 1 ATOM 4225 N N . ASP B 1 180 ? -38.965 42.173 -18.295 1.00 8.90 ? 268 ASP B N 1 ATOM 4226 C CA . ASP B 1 180 ? -37.800 42.926 -18.739 1.00 9.24 ? 268 ASP B CA 1 ATOM 4227 C C . ASP B 1 180 ? -37.847 44.382 -18.267 1.00 9.41 ? 268 ASP B C 1 ATOM 4228 O O . ASP B 1 180 ? -38.883 45.012 -18.332 1.00 9.79 ? 268 ASP B O 1 ATOM 4229 C CB . ASP B 1 180 ? -37.677 42.902 -20.233 1.00 10.67 ? 268 ASP B CB 1 ATOM 4230 C CG . ASP B 1 180 ? -36.401 43.524 -20.676 1.00 12.97 ? 268 ASP B CG 1 ATOM 4231 O OD1 . ASP B 1 180 ? -35.393 42.827 -20.548 1.00 10.28 ? 268 ASP B OD1 1 ATOM 4232 O OD2 . ASP B 1 180 ? -36.286 44.717 -21.051 1.00 12.44 ? 268 ASP B OD2 1 ATOM 4233 N N . ALA B 1 181 ? -36.708 44.893 -17.805 1.00 8.23 ? 269 ALA B N 1 ATOM 4234 C CA . ALA B 1 181 ? -36.595 46.235 -17.243 1.00 7.95 ? 269 ALA B CA 1 ATOM 4235 C C . ALA B 1 181 ? -35.361 46.996 -17.767 1.00 8.20 ? 269 ALA B C 1 ATOM 4236 O O . ALA B 1 181 ? -34.680 47.673 -17.033 1.00 7.89 ? 269 ALA B O 1 ATOM 4237 C CB . ALA B 1 181 ? -36.520 46.182 -15.756 1.00 8.73 ? 269 ALA B CB 1 ATOM 4238 N N . GLY B 1 182 ? -35.106 46.902 -19.055 1.00 7.85 ? 270 GLY B N 1 ATOM 4239 C CA . GLY B 1 182 ? -34.015 47.668 -19.636 1.00 7.40 ? 270 GLY B CA 1 ATOM 4240 C C . GLY B 1 182 ? -32.705 47.378 -18.968 1.00 7.64 ? 270 GLY B C 1 ATOM 4241 O O . GLY B 1 182 ? -32.366 46.215 -18.707 1.00 8.19 ? 270 GLY B O 1 ATOM 4242 N N . HIS B 1 183 ? -31.925 48.423 -18.770 1.00 7.49 ? 271 HIS B N 1 ATOM 4243 C CA . HIS B 1 183 ? -30.598 48.277 -18.188 1.00 7.31 ? 271 HIS B CA 1 ATOM 4244 C C . HIS B 1 183 ? -30.155 49.633 -17.589 1.00 7.63 ? 271 HIS B C 1 ATOM 4245 O O . HIS B 1 183 ? -30.852 50.631 -17.691 1.00 7.27 ? 271 HIS B O 1 ATOM 4246 C CB . HIS B 1 183 ? -29.598 47.729 -19.209 1.00 7.96 ? 271 HIS B CB 1 ATOM 4247 C CG . HIS B 1 183 ? -29.377 48.643 -20.365 1.00 6.07 ? 271 HIS B CG 1 ATOM 4248 N ND1 . HIS B 1 183 ? -28.461 49.669 -20.353 1.00 5.59 ? 271 HIS B ND1 1 ATOM 4249 C CD2 . HIS B 1 183 ? -29.953 48.663 -21.587 1.00 6.17 ? 271 HIS B CD2 1 ATOM 4250 C CE1 . HIS B 1 183 ? -28.498 50.309 -21.507 1.00 7.66 ? 271 HIS B CE1 1 ATOM 4251 N NE2 . HIS B 1 183 ? -29.383 49.700 -22.286 1.00 8.85 ? 271 HIS B NE2 1 ATOM 4252 N N . ALA B 1 184 ? -28.986 49.623 -16.973 1.00 6.71 ? 272 ALA B N 1 ATOM 4253 C CA . ALA B 1 184 ? -28.483 50.781 -16.226 1.00 7.39 ? 272 ALA B CA 1 ATOM 4254 C C . ALA B 1 184 ? -28.387 52.003 -17.112 1.00 7.59 ? 272 ALA B C 1 ATOM 4255 O O . ALA B 1 184 ? -28.667 53.122 -16.690 1.00 7.28 ? 272 ALA B O 1 ATOM 4256 C CB . ALA B 1 184 ? -27.093 50.483 -15.648 1.00 7.80 ? 272 ALA B CB 1 ATOM 4257 N N . GLY B 1 185 ? -27.984 51.758 -18.348 1.00 7.71 ? 273 GLY B N 1 ATOM 4258 C CA . GLY B 1 185 ? -27.727 52.812 -19.307 1.00 7.83 ? 273 GLY B CA 1 ATOM 4259 C C . GLY B 1 185 ? -28.995 53.217 -20.027 1.00 7.62 ? 273 GLY B C 1 ATOM 4260 O O . GLY B 1 185 ? -28.937 54.074 -20.907 1.00 8.91 ? 273 GLY B O 1 ATOM 4261 N N . TRP B 1 186 ? -30.126 52.608 -19.661 1.00 6.03 ? 274 TRP B N 1 ATOM 4262 C CA . TRP B 1 186 ? -31.417 52.939 -20.270 1.00 6.19 ? 274 TRP B CA 1 ATOM 4263 C C . TRP B 1 186 ? -32.309 53.569 -19.197 1.00 5.81 ? 274 TRP B C 1 ATOM 4264 O O . TRP B 1 186 ? -32.530 54.795 -19.181 1.00 7.78 ? 274 TRP B O 1 ATOM 4265 C CB . TRP B 1 186 ? -32.060 51.688 -20.877 1.00 5.45 ? 274 TRP B CB 1 ATOM 4266 C CG . TRP B 1 186 ? -33.244 51.930 -21.720 1.00 6.54 ? 274 TRP B CG 1 ATOM 4267 C CD1 . TRP B 1 186 ? -33.956 53.083 -21.834 1.00 7.42 ? 274 TRP B CD1 1 ATOM 4268 C CD2 . TRP B 1 186 ? -33.840 51.002 -22.636 1.00 5.66 ? 274 TRP B CD2 1 ATOM 4269 N NE1 . TRP B 1 186 ? -34.984 52.921 -22.734 1.00 7.99 ? 274 TRP B NE1 1 ATOM 4270 C CE2 . TRP B 1 186 ? -34.934 51.649 -23.235 1.00 7.68 ? 274 TRP B CE2 1 ATOM 4271 C CE3 . TRP B 1 186 ? -33.578 49.664 -22.979 1.00 6.05 ? 274 TRP B CE3 1 ATOM 4272 C CZ2 . TRP B 1 186 ? -35.756 51.016 -24.185 1.00 8.24 ? 274 TRP B CZ2 1 ATOM 4273 C CZ3 . TRP B 1 186 ? -34.374 49.047 -23.921 1.00 10.11 ? 274 TRP B CZ3 1 ATOM 4274 C CH2 . TRP B 1 186 ? -35.451 49.706 -24.501 1.00 8.16 ? 274 TRP B CH2 1 ATOM 4275 N N . LEU B 1 187 ? -32.760 52.744 -18.259 1.00 6.08 ? 275 LEU B N 1 ATOM 4276 C CA . LEU B 1 187 ? -33.738 53.191 -17.252 1.00 5.16 ? 275 LEU B CA 1 ATOM 4277 C C . LEU B 1 187 ? -33.038 53.614 -15.958 1.00 5.79 ? 275 LEU B C 1 ATOM 4278 O O . LEU B 1 187 ? -33.654 54.206 -15.081 1.00 5.57 ? 275 LEU B O 1 ATOM 4279 C CB . LEU B 1 187 ? -34.739 52.071 -16.963 1.00 5.31 ? 275 LEU B CB 1 ATOM 4280 C CG . LEU B 1 187 ? -35.608 51.595 -18.124 1.00 4.80 ? 275 LEU B CG 1 ATOM 4281 C CD1 . LEU B 1 187 ? -36.647 50.591 -17.658 1.00 7.21 ? 275 LEU B CD1 1 ATOM 4282 C CD2 . LEU B 1 187 ? -36.336 52.720 -18.866 1.00 6.37 ? 275 LEU B CD2 1 ATOM 4283 N N . GLY B 1 188 ? -31.737 53.335 -15.842 1.00 5.99 ? 276 GLY B N 1 ATOM 4284 C CA . GLY B 1 188 ? -31.007 53.710 -14.650 1.00 6.79 ? 276 GLY B CA 1 ATOM 4285 C C . GLY B 1 188 ? -30.663 55.174 -14.557 1.00 7.09 ? 276 GLY B C 1 ATOM 4286 O O . GLY B 1 188 ? -30.329 55.666 -13.491 1.00 7.29 ? 276 GLY B O 1 ATOM 4287 N N . TRP B 1 189 ? -30.687 55.882 -15.682 1.00 7.73 ? 277 TRP B N 1 ATOM 4288 C CA . TRP B 1 189 ? -30.458 57.308 -15.651 1.00 8.13 ? 277 TRP B CA 1 ATOM 4289 C C . TRP B 1 189 ? -31.424 57.921 -14.656 1.00 8.09 ? 277 TRP B C 1 ATOM 4290 O O . TRP B 1 189 ? -32.600 57.580 -14.685 1.00 6.41 ? 277 TRP B O 1 ATOM 4291 C CB . TRP B 1 189 ? -30.666 57.922 -17.039 1.00 8.59 ? 277 TRP B CB 1 ATOM 4292 C CG . TRP B 1 189 ? -29.572 57.631 -17.980 1.00 7.99 ? 277 TRP B CG 1 ATOM 4293 C CD1 . TRP B 1 189 ? -29.496 56.611 -18.884 1.00 8.33 ? 277 TRP B CD1 1 ATOM 4294 C CD2 . TRP B 1 189 ? -28.364 58.383 -18.120 1.00 7.01 ? 277 TRP B CD2 1 ATOM 4295 N NE1 . TRP B 1 189 ? -28.311 56.688 -19.574 1.00 9.71 ? 277 TRP B NE1 1 ATOM 4296 C CE2 . TRP B 1 189 ? -27.599 57.770 -19.127 1.00 7.51 ? 277 TRP B CE2 1 ATOM 4297 C CE3 . TRP B 1 189 ? -27.857 59.515 -17.493 1.00 8.98 ? 277 TRP B CE3 1 ATOM 4298 C CZ2 . TRP B 1 189 ? -26.339 58.248 -19.518 1.00 10.16 ? 277 TRP B CZ2 1 ATOM 4299 C CZ3 . TRP B 1 189 ? -26.603 60.003 -17.894 1.00 9.46 ? 277 TRP B CZ3 1 ATOM 4300 C CH2 . TRP B 1 189 ? -25.873 59.376 -18.891 1.00 8.33 ? 277 TRP B CH2 1 ATOM 4301 N N . PRO B 1 190 ? -30.933 58.812 -13.780 1.00 8.97 ? 278 PRO B N 1 ATOM 4302 C CA . PRO B 1 190 ? -31.774 59.473 -12.762 1.00 9.50 ? 278 PRO B CA 1 ATOM 4303 C C . PRO B 1 190 ? -33.110 59.979 -13.251 1.00 8.78 ? 278 PRO B C 1 ATOM 4304 O O . PRO B 1 190 ? -34.090 59.842 -12.541 1.00 9.25 ? 278 PRO B O 1 ATOM 4305 C CB . PRO B 1 190 ? -30.911 60.632 -12.332 1.00 9.80 ? 278 PRO B CB 1 ATOM 4306 C CG . PRO B 1 190 ? -29.555 60.048 -12.409 1.00 9.60 ? 278 PRO B CG 1 ATOM 4307 C CD . PRO B 1 190 ? -29.525 59.242 -13.650 1.00 9.87 ? 278 PRO B CD 1 ATOM 4308 N N . ALA B 1 191 ? -33.162 60.528 -14.454 1.00 7.86 ? 279 ALA B N 1 ATOM 4309 C CA . ALA B 1 191 ? -34.434 61.047 -14.977 1.00 8.13 ? 279 ALA B CA 1 ATOM 4310 C C . ALA B 1 191 ? -35.427 59.957 -15.382 1.00 8.27 ? 279 ALA B C 1 ATOM 4311 O O . ALA B 1 191 ? -36.670 60.189 -15.383 1.00 8.73 ? 279 ALA B O 1 ATOM 4312 C CB . ALA B 1 191 ? -34.173 61.991 -16.156 1.00 8.52 ? 279 ALA B CB 1 ATOM 4313 N N . ASN B 1 192 ? -34.922 58.780 -15.736 1.00 7.60 ? 280 ASN B N 1 ATOM 4314 C CA . ASN B 1 192 ? -35.779 57.669 -16.157 1.00 7.48 ? 280 ASN B CA 1 ATOM 4315 C C . ASN B 1 192 ? -36.163 56.687 -15.071 1.00 7.40 ? 280 ASN B C 1 ATOM 4316 O O . ASN B 1 192 ? -37.137 55.960 -15.243 1.00 7.31 ? 280 ASN B O 1 ATOM 4317 C CB . ASN B 1 192 ? -35.114 56.859 -17.273 1.00 7.12 ? 280 ASN B CB 1 ATOM 4318 C CG . ASN B 1 192 ? -34.913 57.676 -18.527 1.00 8.29 ? 280 ASN B CG 1 ATOM 4319 O OD1 . ASN B 1 192 ? -35.624 58.649 -18.739 1.00 9.85 ? 280 ASN B OD1 1 ATOM 4320 N ND2 . ASN B 1 192 ? -33.925 57.293 -19.369 1.00 6.16 ? 280 ASN B ND2 1 ATOM 4321 N N . ILE B 1 193 ? -35.414 56.652 -13.975 1.00 6.84 ? 281 ILE B N 1 ATOM 4322 C CA . ILE B 1 193 ? -35.614 55.566 -13.003 1.00 7.30 ? 281 ILE B CA 1 ATOM 4323 C C . ILE B 1 193 ? -36.945 55.673 -12.224 1.00 6.28 ? 281 ILE B C 1 ATOM 4324 O O . ILE B 1 193 ? -37.596 54.649 -11.968 1.00 6.57 ? 281 ILE B O 1 ATOM 4325 C CB . ILE B 1 193 ? -34.341 55.422 -12.095 1.00 7.26 ? 281 ILE B CB 1 ATOM 4326 C CG1 . ILE B 1 193 ? -34.234 54.016 -11.489 1.00 8.99 ? 281 ILE B CG1 1 ATOM 4327 C CG2 . ILE B 1 193 ? -34.248 56.532 -11.064 1.00 9.19 ? 281 ILE B CG2 1 ATOM 4328 C CD1 . ILE B 1 193 ? -32.959 53.801 -10.695 1.00 9.11 ? 281 ILE B CD1 1 ATOM 4329 N N . GLN B 1 194 ? -37.359 56.898 -11.884 1.00 6.65 ? 282 GLN B N 1 ATOM 4330 C CA . GLN B 1 194 ? -38.619 57.100 -11.168 1.00 7.11 ? 282 GLN B CA 1 ATOM 4331 C C . GLN B 1 194 ? -39.858 56.751 -12.013 1.00 6.51 ? 282 GLN B C 1 ATOM 4332 O O . GLN B 1 194 ? -40.716 55.978 -11.558 1.00 6.49 ? 282 GLN B O 1 ATOM 4333 C CB . GLN B 1 194 ? -38.759 58.513 -10.624 1.00 7.48 ? 282 GLN B CB 1 ATOM 4334 C CG . GLN B 1 194 ? -37.676 58.951 -9.650 1.00 11.56 ? 282 GLN B CG 1 ATOM 4335 C CD . GLN B 1 194 ? -38.039 60.277 -9.033 1.00 16.27 ? 282 GLN B CD 1 ATOM 4336 O OE1 . GLN B 1 194 ? -37.376 61.312 -9.261 1.00 20.09 ? 282 GLN B OE1 1 ATOM 4337 N NE2 . GLN B 1 194 ? -39.123 60.270 -8.281 1.00 14.87 ? 282 GLN B NE2 1 ATOM 4338 N N . PRO B 1 195 ? -39.982 57.286 -13.231 1.00 5.75 ? 283 PRO B N 1 ATOM 4339 C CA . PRO B 1 195 ? -41.081 56.859 -14.096 1.00 5.03 ? 283 PRO B CA 1 ATOM 4340 C C . PRO B 1 195 ? -41.019 55.377 -14.420 1.00 5.30 ? 283 PRO B C 1 ATOM 4341 O O . PRO B 1 195 ? -42.096 54.783 -14.533 1.00 5.56 ? 283 PRO B O 1 ATOM 4342 C CB . PRO B 1 195 ? -40.940 57.759 -15.351 1.00 5.11 ? 283 PRO B CB 1 ATOM 4343 C CG . PRO B 1 195 ? -39.611 58.312 -15.275 1.00 4.57 ? 283 PRO B CG 1 ATOM 4344 C CD . PRO B 1 195 ? -39.171 58.324 -13.875 1.00 5.65 ? 283 PRO B CD 1 ATOM 4345 N N . ALA B 1 196 ? -39.838 54.788 -14.546 1.00 5.34 ? 284 ALA B N 1 ATOM 4346 C CA . ALA B 1 196 ? -39.729 53.333 -14.670 1.00 6.31 ? 284 ALA B CA 1 ATOM 4347 C C . ALA B 1 196 ? -40.393 52.646 -13.459 1.00 7.33 ? 284 ALA B C 1 ATOM 4348 O O . ALA B 1 196 ? -41.220 51.769 -13.605 1.00 7.46 ? 284 ALA B O 1 ATOM 4349 C CB . ALA B 1 196 ? -38.253 52.899 -14.820 1.00 6.88 ? 284 ALA B CB 1 ATOM 4350 N N . ALA B 1 197 ? -40.026 53.050 -12.244 1.00 8.56 ? 285 ALA B N 1 ATOM 4351 C CA . ALA B 1 197 ? -40.563 52.386 -11.054 1.00 8.14 ? 285 ALA B CA 1 ATOM 4352 C C . ALA B 1 197 ? -42.093 52.513 -11.028 1.00 8.44 ? 285 ALA B C 1 ATOM 4353 O O . ALA B 1 197 ? -42.789 51.537 -10.723 1.00 9.18 ? 285 ALA B O 1 ATOM 4354 C CB . ALA B 1 197 ? -39.923 52.959 -9.803 1.00 7.71 ? 285 ALA B CB 1 ATOM 4355 N N . GLU B 1 198 ? -42.606 53.687 -11.394 1.00 7.96 ? 286 GLU B N 1 ATOM 4356 C CA . GLU B 1 198 ? -44.043 53.933 -11.383 1.00 9.26 ? 286 GLU B CA 1 ATOM 4357 C C . GLU B 1 198 ? -44.740 52.991 -12.343 1.00 9.56 ? 286 GLU B C 1 ATOM 4358 O O . GLU B 1 198 ? -45.749 52.359 -11.987 1.00 9.99 ? 286 GLU B O 1 ATOM 4359 C CB . GLU B 1 198 ? -44.350 55.407 -11.731 1.00 10.73 ? 286 GLU B CB 1 ATOM 4360 C CG . GLU B 1 198 ? -43.790 56.372 -10.700 1.00 13.29 ? 286 GLU B CG 1 ATOM 4361 C CD . GLU B 1 198 ? -44.070 57.837 -10.977 1.00 18.75 ? 286 GLU B CD 1 ATOM 4362 O OE1 . GLU B 1 198 ? -44.091 58.247 -12.172 1.00 22.01 ? 286 GLU B OE1 1 ATOM 4363 O OE2 . GLU B 1 198 ? -44.246 58.575 -9.973 1.00 20.97 ? 286 GLU B OE2 1 ATOM 4364 N N . LEU B 1 199 ? -44.171 52.861 -13.547 1.00 9.89 ? 287 LEU B N 1 ATOM 4365 C CA . LEU B 1 199 ? -44.743 52.005 -14.584 1.00 10.18 ? 287 LEU B CA 1 ATOM 4366 C C . LEU B 1 199 ? -44.767 50.521 -14.192 1.00 8.67 ? 287 LEU B C 1 ATOM 4367 O O . LEU B 1 199 ? -45.798 49.872 -14.302 1.00 8.80 ? 287 LEU B O 1 ATOM 4368 C CB . LEU B 1 199 ? -44.006 52.190 -15.921 1.00 9.81 ? 287 LEU B CB 1 ATOM 4369 C CG . LEU B 1 199 ? -44.432 51.268 -17.064 1.00 13.01 ? 287 LEU B CG 1 ATOM 4370 C CD1 . LEU B 1 199 ? -45.862 51.459 -17.368 1.00 14.78 ? 287 LEU B CD1 1 ATOM 4371 C CD2 . LEU B 1 199 ? -43.614 51.437 -18.317 1.00 15.17 ? 287 LEU B CD2 1 ATOM 4372 N N . PHE B 1 200 ? -43.633 49.990 -13.749 1.00 9.11 ? 288 PHE B N 1 ATOM 4373 C CA . PHE B 1 200 ? -43.540 48.567 -13.419 1.00 9.48 ? 288 PHE B CA 1 ATOM 4374 C C . PHE B 1 200 ? -44.383 48.191 -12.234 1.00 9.47 ? 288 PHE B C 1 ATOM 4375 O O . PHE B 1 200 ? -45.044 47.130 -12.225 1.00 11.40 ? 288 PHE B O 1 ATOM 4376 C CB . PHE B 1 200 ? -42.104 48.128 -13.204 1.00 8.98 ? 288 PHE B CB 1 ATOM 4377 C CG . PHE B 1 200 ? -41.359 47.966 -14.499 1.00 9.53 ? 288 PHE B CG 1 ATOM 4378 C CD1 . PHE B 1 200 ? -41.513 46.818 -15.274 1.00 12.21 ? 288 PHE B CD1 1 ATOM 4379 C CD2 . PHE B 1 200 ? -40.567 48.996 -14.998 1.00 12.69 ? 288 PHE B CD2 1 ATOM 4380 C CE1 . PHE B 1 200 ? -40.820 46.689 -16.476 1.00 12.84 ? 288 PHE B CE1 1 ATOM 4381 C CE2 . PHE B 1 200 ? -39.888 48.878 -16.235 1.00 11.58 ? 288 PHE B CE2 1 ATOM 4382 C CZ . PHE B 1 200 ? -40.011 47.747 -16.958 1.00 10.43 ? 288 PHE B CZ 1 ATOM 4383 N N . ALA B 1 201 ? -44.380 49.053 -11.230 1.00 9.70 ? 289 ALA B N 1 ATOM 4384 C CA . ALA B 1 201 ? -45.174 48.809 -10.056 1.00 8.43 ? 289 ALA B CA 1 ATOM 4385 C C . ALA B 1 201 ? -46.654 48.895 -10.368 1.00 9.17 ? 289 ALA B C 1 ATOM 4386 O O . ALA B 1 201 ? -47.425 48.141 -9.795 1.00 7.80 ? 289 ALA B O 1 ATOM 4387 C CB . ALA B 1 201 ? -44.794 49.749 -8.953 1.00 9.70 ? 289 ALA B CB 1 ATOM 4388 N N . LYS B 1 202 ? -47.058 49.785 -11.272 1.00 9.07 ? 290 LYS B N 1 ATOM 4389 C CA . LYS B 1 202 ? -48.468 49.915 -11.623 1.00 9.68 ? 290 LYS B CA 1 ATOM 4390 C C . LYS B 1 202 ? -48.955 48.683 -12.432 1.00 8.87 ? 290 LYS B C 1 ATOM 4391 O O . LYS B 1 202 ? -50.074 48.207 -12.237 1.00 8.27 ? 290 LYS B O 1 ATOM 4392 C CB . LYS B 1 202 ? -48.711 51.185 -12.424 1.00 10.25 ? 290 LYS B CB 1 ATOM 4393 C CG . LYS B 1 202 ? -50.181 51.333 -12.749 1.00 16.04 ? 290 LYS B CG 1 ATOM 4394 C CD . LYS B 1 202 ? -50.622 52.751 -13.066 1.00 21.49 ? 290 LYS B CD 1 ATOM 4395 C CE . LYS B 1 202 ? -52.082 52.980 -12.649 1.00 23.94 ? 290 LYS B CE 1 ATOM 4396 N NZ . LYS B 1 202 ? -52.696 51.820 -11.903 1.00 27.21 ? 290 LYS B NZ 1 ATOM 4397 N N . ILE B 1 203 ? -48.122 48.200 -13.343 1.00 9.73 ? 291 ILE B N 1 ATOM 4398 C CA . ILE B 1 203 ? -48.421 47.003 -14.143 1.00 9.89 ? 291 ILE B CA 1 ATOM 4399 C C . ILE B 1 203 ? -48.582 45.805 -13.187 1.00 9.36 ? 291 ILE B C 1 ATOM 4400 O O . ILE B 1 203 ? -49.531 45.040 -13.281 1.00 8.99 ? 291 ILE B O 1 ATOM 4401 C CB . ILE B 1 203 ? -47.305 46.718 -15.206 1.00 10.37 ? 291 ILE B CB 1 ATOM 4402 C CG1 . ILE B 1 203 ? -47.343 47.719 -16.363 1.00 12.55 ? 291 ILE B CG1 1 ATOM 4403 C CG2 . ILE B 1 203 ? -47.404 45.322 -15.767 1.00 10.87 ? 291 ILE B CG2 1 ATOM 4404 C CD1 . ILE B 1 203 ? -48.621 47.655 -17.167 1.00 16.49 ? 291 ILE B CD1 1 ATOM 4405 N N . TYR B 1 204 ? -47.680 45.698 -12.229 1.00 8.60 ? 292 TYR B N 1 ATOM 4406 C CA . TYR B 1 204 ? -47.729 44.615 -11.244 1.00 9.14 ? 292 TYR B CA 1 ATOM 4407 C C . TYR B 1 204 ? -49.048 44.672 -10.450 1.00 9.62 ? 292 TYR B C 1 ATOM 4408 O O . TYR B 1 204 ? -49.736 43.666 -10.273 1.00 10.20 ? 292 TYR B O 1 ATOM 4409 C CB . TYR B 1 204 ? -46.522 44.759 -10.322 1.00 8.99 ? 292 TYR B CB 1 ATOM 4410 C CG . TYR B 1 204 ? -46.399 43.719 -9.231 1.00 7.55 ? 292 TYR B CG 1 ATOM 4411 C CD1 . TYR B 1 204 ? -46.223 42.389 -9.549 1.00 8.75 ? 292 TYR B CD1 1 ATOM 4412 C CD2 . TYR B 1 204 ? -46.439 44.086 -7.883 1.00 6.17 ? 292 TYR B CD2 1 ATOM 4413 C CE1 . TYR B 1 204 ? -46.093 41.427 -8.555 1.00 9.32 ? 292 TYR B CE1 1 ATOM 4414 C CE2 . TYR B 1 204 ? -46.295 43.129 -6.875 1.00 7.14 ? 292 TYR B CE2 1 ATOM 4415 C CZ . TYR B 1 204 ? -46.114 41.802 -7.229 1.00 7.02 ? 292 TYR B CZ 1 ATOM 4416 O OH . TYR B 1 204 ? -45.979 40.845 -6.258 1.00 8.96 ? 292 TYR B OH 1 ATOM 4417 N N . GLU B 1 205 ? -49.424 45.867 -10.011 1.00 9.54 ? 293 GLU B N 1 ATOM 4418 C CA . GLU B 1 205 ? -50.667 46.080 -9.302 1.00 10.32 ? 293 GLU B CA 1 ATOM 4419 C C . GLU B 1 205 ? -51.860 45.752 -10.180 1.00 9.67 ? 293 GLU B C 1 ATOM 4420 O O . GLU B 1 205 ? -52.760 45.045 -9.759 1.00 9.48 ? 293 GLU B O 1 ATOM 4421 C CB . GLU B 1 205 ? -50.730 47.541 -8.844 1.00 11.48 ? 293 GLU B CB 1 ATOM 4422 C CG . GLU B 1 205 ? -52.059 48.000 -8.330 1.00 15.22 ? 293 GLU B CG 1 ATOM 4423 C CD . GLU B 1 205 ? -51.955 49.426 -7.805 1.00 19.48 ? 293 GLU B CD 1 ATOM 4424 O OE1 . GLU B 1 205 ? -50.970 49.718 -7.076 1.00 21.63 ? 293 GLU B OE1 1 ATOM 4425 O OE2 . GLU B 1 205 ? -52.835 50.238 -8.144 1.00 23.38 ? 293 GLU B OE2 1 ATOM 4426 N N . ASP B 1 206 ? -51.854 46.253 -11.410 1.00 9.49 ? 294 ASP B N 1 ATOM 4427 C CA . ASP B 1 206 ? -52.982 46.073 -12.333 1.00 10.59 ? 294 ASP B CA 1 ATOM 4428 C C . ASP B 1 206 ? -53.202 44.608 -12.703 1.00 9.93 ? 294 ASP B C 1 ATOM 4429 O O . ASP B 1 206 ? -54.336 44.206 -12.970 1.00 10.02 ? 294 ASP B O 1 ATOM 4430 C CB . ASP B 1 206 ? -52.827 46.964 -13.576 1.00 11.16 ? 294 ASP B CB 1 ATOM 4431 C CG . ASP B 1 206 ? -53.145 48.449 -13.275 1.00 12.57 ? 294 ASP B CG 1 ATOM 4432 O OD1 . ASP B 1 206 ? -53.777 48.775 -12.237 1.00 12.35 ? 294 ASP B OD1 1 ATOM 4433 O OD2 . ASP B 1 206 ? -52.769 49.375 -14.020 1.00 13.49 ? 294 ASP B OD2 1 ATOM 4434 N N . ALA B 1 207 ? -52.151 43.810 -12.597 1.00 9.31 ? 295 ALA B N 1 ATOM 4435 C CA . ALA B 1 207 ? -52.178 42.373 -12.875 1.00 9.00 ? 295 ALA B CA 1 ATOM 4436 C C . ALA B 1 207 ? -52.567 41.568 -11.641 1.00 9.13 ? 295 ALA B C 1 ATOM 4437 O O . ALA B 1 207 ? -52.593 40.341 -11.691 1.00 9.85 ? 295 ALA B O 1 ATOM 4438 C CB . ALA B 1 207 ? -50.815 41.924 -13.375 1.00 9.25 ? 295 ALA B CB 1 ATOM 4439 N N . GLY B 1 208 ? -52.867 42.248 -10.541 1.00 8.94 ? 296 GLY B N 1 ATOM 4440 C CA . GLY B 1 208 ? -53.343 41.626 -9.311 1.00 8.41 ? 296 GLY B CA 1 ATOM 4441 C C . GLY B 1 208 ? -52.201 40.999 -8.524 1.00 8.59 ? 296 GLY B C 1 ATOM 4442 O O . GLY B 1 208 ? -52.402 40.057 -7.720 1.00 7.12 ? 296 GLY B O 1 ATOM 4443 N N . LYS B 1 209 ? -50.996 41.492 -8.771 1.00 7.12 ? 297 LYS B N 1 ATOM 4444 C CA . LYS B 1 209 ? -49.800 41.041 -8.069 1.00 7.35 ? 297 LYS B CA 1 ATOM 4445 C C . LYS B 1 209 ? -49.650 39.513 -8.108 1.00 7.51 ? 297 LYS B C 1 ATOM 4446 O O . LYS B 1 209 ? -49.658 38.830 -7.057 1.00 6.35 ? 297 LYS B O 1 ATOM 4447 C CB . LYS B 1 209 ? -49.791 41.549 -6.640 1.00 8.26 ? 297 LYS B CB 1 ATOM 4448 C CG . LYS B 1 209 ? -49.859 43.061 -6.545 1.00 8.75 ? 297 LYS B CG 1 ATOM 4449 C CD . LYS B 1 209 ? -49.797 43.549 -5.138 1.00 7.94 ? 297 LYS B CD 1 ATOM 4450 C CE . LYS B 1 209 ? -49.699 45.056 -5.126 1.00 8.45 ? 297 LYS B CE 1 ATOM 4451 N NZ . LYS B 1 209 ? -49.484 45.557 -3.749 1.00 12.29 ? 297 LYS B NZ 1 ATOM 4452 N N . PRO B 1 210 ? -49.528 38.960 -9.314 1.00 6.88 ? 298 PRO B N 1 ATOM 4453 C CA . PRO B 1 210 ? -49.515 37.502 -9.424 1.00 6.93 ? 298 PRO B CA 1 ATOM 4454 C C . PRO B 1 210 ? -48.342 36.898 -8.679 1.00 6.77 ? 298 PRO B C 1 ATOM 4455 O O . PRO B 1 210 ? -47.202 37.383 -8.800 1.00 7.19 ? 298 PRO B O 1 ATOM 4456 C CB . PRO B 1 210 ? -49.417 37.232 -10.928 1.00 6.33 ? 298 PRO B CB 1 ATOM 4457 C CG . PRO B 1 210 ? -49.749 38.558 -11.645 1.00 6.90 ? 298 PRO B CG 1 ATOM 4458 C CD . PRO B 1 210 ? -49.341 39.613 -10.631 1.00 7.00 ? 298 PRO B CD 1 ATOM 4459 N N . ARG B 1 211 ? -48.622 35.822 -7.940 1.00 7.02 ? 299 ARG B N 1 ATOM 4460 C CA . ARG B 1 211 ? -47.604 35.129 -7.152 1.00 8.21 ? 299 ARG B CA 1 ATOM 4461 C C . ARG B 1 211 ? -46.373 34.769 -7.950 1.00 7.86 ? 299 ARG B C 1 ATOM 4462 O O . ARG B 1 211 ? -45.241 34.853 -7.445 1.00 7.72 ? 299 ARG B O 1 ATOM 4463 C CB . ARG B 1 211 ? -48.215 33.834 -6.549 1.00 8.87 ? 299 ARG B CB 1 ATOM 4464 C CG . ARG B 1 211 ? -47.283 32.985 -5.727 1.00 11.42 ? 299 ARG B CG 1 ATOM 4465 C CD . ARG B 1 211 ? -47.477 31.441 -5.852 1.00 12.40 ? 299 ARG B CD 1 ATOM 4466 N NE . ARG B 1 211 ? -47.147 30.984 -7.206 1.00 11.60 ? 299 ARG B NE 1 ATOM 4467 C CZ . ARG B 1 211 ? -45.924 30.904 -7.704 1.00 12.95 ? 299 ARG B CZ 1 ATOM 4468 N NH1 . ARG B 1 211 ? -44.861 31.232 -6.985 1.00 13.65 ? 299 ARG B NH1 1 ATOM 4469 N NH2 . ARG B 1 211 ? -45.754 30.489 -8.957 1.00 14.36 ? 299 ARG B NH2 1 ATOM 4470 N N . ALA B 1 212 ? -46.594 34.352 -9.192 1.00 7.03 ? 300 ALA B N 1 ATOM 4471 C CA . ALA B 1 212 ? -45.495 33.905 -10.045 1.00 7.53 ? 300 ALA B CA 1 ATOM 4472 C C . ALA B 1 212 ? -44.563 35.011 -10.536 1.00 7.40 ? 300 ALA B C 1 ATOM 4473 O O . ALA B 1 212 ? -43.492 34.704 -11.037 1.00 7.30 ? 300 ALA B O 1 ATOM 4474 C CB . ALA B 1 212 ? -46.017 33.145 -11.243 1.00 6.68 ? 300 ALA B CB 1 ATOM 4475 N N . VAL B 1 213 ? -44.978 36.269 -10.421 1.00 7.95 ? 301 VAL B N 1 ATOM 4476 C CA . VAL B 1 213 ? -44.083 37.373 -10.780 1.00 8.76 ? 301 VAL B CA 1 ATOM 4477 C C . VAL B 1 213 ? -43.040 37.540 -9.671 1.00 8.79 ? 301 VAL B C 1 ATOM 4478 O O . VAL B 1 213 ? -43.320 37.993 -8.557 1.00 9.18 ? 301 VAL B O 1 ATOM 4479 C CB . VAL B 1 213 ? -44.830 38.665 -11.074 1.00 8.45 ? 301 VAL B CB 1 ATOM 4480 C CG1 . VAL B 1 213 ? -43.847 39.839 -11.359 1.00 9.29 ? 301 VAL B CG1 1 ATOM 4481 C CG2 . VAL B 1 213 ? -45.751 38.497 -12.291 1.00 9.48 ? 301 VAL B CG2 1 ATOM 4482 N N . ARG B 1 214 ? -41.818 37.192 -10.012 1.00 8.27 ? 302 ARG B N 1 ATOM 4483 C CA . ARG B 1 214 ? -40.729 37.197 -9.074 1.00 7.76 ? 302 ARG B CA 1 ATOM 4484 C C . ARG B 1 214 ? -39.986 38.524 -9.077 1.00 7.13 ? 302 ARG B C 1 ATOM 4485 O O . ARG B 1 214 ? -39.422 38.946 -8.038 1.00 7.08 ? 302 ARG B O 1 ATOM 4486 C CB . ARG B 1 214 ? -39.806 36.026 -9.409 1.00 8.65 ? 302 ARG B CB 1 ATOM 4487 C CG . ARG B 1 214 ? -38.579 35.926 -8.550 1.00 10.25 ? 302 ARG B CG 1 ATOM 4488 C CD . ARG B 1 214 ? -38.867 35.519 -7.112 1.00 9.25 ? 302 ARG B CD 1 ATOM 4489 N NE . ARG B 1 214 ? -37.616 35.457 -6.396 1.00 7.96 ? 302 ARG B NE 1 ATOM 4490 C CZ . ARG B 1 214 ? -37.499 35.169 -5.107 1.00 7.91 ? 302 ARG B CZ 1 ATOM 4491 N NH1 . ARG B 1 214 ? -38.574 34.968 -4.355 1.00 8.51 ? 302 ARG B NH1 1 ATOM 4492 N NH2 . ARG B 1 214 ? -36.300 35.182 -4.548 1.00 7.34 ? 302 ARG B NH2 1 ATOM 4493 N N . GLY B 1 215 ? -39.985 39.192 -10.227 1.00 6.76 ? 303 GLY B N 1 ATOM 4494 C CA . GLY B 1 215 ? -39.359 40.484 -10.346 1.00 6.90 ? 303 GLY B CA 1 ATOM 4495 C C . GLY B 1 215 ? -39.070 40.922 -11.774 1.00 6.75 ? 303 GLY B C 1 ATOM 4496 O O . GLY B 1 215 ? -39.930 40.823 -12.623 1.00 7.28 ? 303 GLY B O 1 ATOM 4497 N N . LEU B 1 216 ? -37.837 41.383 -11.984 1.00 6.17 ? 304 LEU B N 1 ATOM 4498 C CA . LEU B 1 216 ? -37.397 42.052 -13.204 1.00 6.39 ? 304 LEU B CA 1 ATOM 4499 C C . LEU B 1 216 ? -36.084 41.458 -13.697 1.00 5.56 ? 304 LEU B C 1 ATOM 4500 O O . LEU B 1 216 ? -35.274 40.987 -12.897 1.00 5.12 ? 304 LEU B O 1 ATOM 4501 C CB . LEU B 1 216 ? -37.244 43.559 -12.977 1.00 6.11 ? 304 LEU B CB 1 ATOM 4502 C CG . LEU B 1 216 ? -38.500 44.284 -12.491 1.00 6.17 ? 304 LEU B CG 1 ATOM 4503 C CD1 . LEU B 1 216 ? -38.178 45.731 -12.217 1.00 7.45 ? 304 LEU B CD1 1 ATOM 4504 C CD2 . LEU B 1 216 ? -39.647 44.152 -13.491 1.00 7.14 ? 304 LEU B CD2 1 ATOM 4505 N N . ALA B 1 217 ? -35.915 41.485 -15.010 1.00 5.96 ? 305 ALA B N 1 ATOM 4506 C CA . ALA B 1 217 ? -34.658 41.119 -15.686 1.00 5.98 ? 305 ALA B CA 1 ATOM 4507 C C . ALA B 1 217 ? -33.952 42.384 -16.190 1.00 7.04 ? 305 ALA B C 1 ATOM 4508 O O . ALA B 1 217 ? -34.598 43.294 -16.685 1.00 8.15 ? 305 ALA B O 1 ATOM 4509 C CB . ALA B 1 217 ? -34.962 40.200 -16.856 1.00 5.91 ? 305 ALA B CB 1 ATOM 4510 N N . THR B 1 218 ? -32.638 42.481 -16.048 1.00 7.63 ? 306 THR B N 1 ATOM 4511 C CA . THR B 1 218 ? -31.933 43.656 -16.592 1.00 8.11 ? 306 THR B CA 1 ATOM 4512 C C . THR B 1 218 ? -30.773 43.238 -17.490 1.00 7.76 ? 306 THR B C 1 ATOM 4513 O O . THR B 1 218 ? -30.323 42.110 -17.424 1.00 6.81 ? 306 THR B O 1 ATOM 4514 C CB . THR B 1 218 ? -31.417 44.625 -15.485 1.00 8.59 ? 306 THR B CB 1 ATOM 4515 O OG1 . THR B 1 218 ? -30.337 44.037 -14.758 1.00 12.33 ? 306 THR B OG1 1 ATOM 4516 C CG2 . THR B 1 218 ? -32.473 44.942 -14.442 1.00 10.80 ? 306 THR B CG2 1 ATOM 4517 N N . ASN B 1 219 ? -30.328 44.181 -18.321 1.00 6.06 ? 307 ASN B N 1 ATOM 4518 C CA . ASN B 1 219 ? -29.231 44.023 -19.263 1.00 6.26 ? 307 ASN B CA 1 ATOM 4519 C C . ASN B 1 219 ? -29.468 43.017 -20.360 1.00 6.62 ? 307 ASN B C 1 ATOM 4520 O O . ASN B 1 219 ? -28.517 42.580 -20.995 1.00 6.55 ? 307 ASN B O 1 ATOM 4521 C CB . ASN B 1 219 ? -27.949 43.689 -18.477 1.00 6.56 ? 307 ASN B CB 1 ATOM 4522 C CG . ASN B 1 219 ? -26.683 44.090 -19.213 1.00 6.97 ? 307 ASN B CG 1 ATOM 4523 O OD1 . ASN B 1 219 ? -26.615 45.171 -19.805 1.00 7.16 ? 307 ASN B OD1 1 ATOM 4524 N ND2 . ASN B 1 219 ? -25.675 43.205 -19.193 1.00 7.10 ? 307 ASN B ND2 1 ATOM 4525 N N . VAL B 1 220 ? -30.740 42.660 -20.622 1.00 5.93 ? 308 VAL B N 1 ATOM 4526 C CA . VAL B 1 220 ? -31.017 41.636 -21.623 1.00 7.33 ? 308 VAL B CA 1 ATOM 4527 C C . VAL B 1 220 ? -30.557 42.128 -22.981 1.00 7.31 ? 308 VAL B C 1 ATOM 4528 O O . VAL B 1 220 ? -30.904 43.241 -23.425 1.00 6.00 ? 308 VAL B O 1 ATOM 4529 C CB . VAL B 1 220 ? -32.448 41.216 -21.678 1.00 8.38 ? 308 VAL B CB 1 ATOM 4530 C CG1 . VAL B 1 220 ? -32.694 40.323 -22.908 1.00 9.01 ? 308 VAL B CG1 1 ATOM 4531 C CG2 . VAL B 1 220 ? -32.835 40.510 -20.377 1.00 8.42 ? 308 VAL B CG2 1 ATOM 4532 N N . ALA B 1 221 ? -29.694 41.348 -23.613 1.00 8.69 ? 309 ALA B N 1 ATOM 4533 C CA . ALA B 1 221 ? -29.114 41.699 -24.909 1.00 8.02 ? 309 ALA B CA 1 ATOM 4534 C C . ALA B 1 221 ? -28.240 42.947 -24.868 1.00 7.02 ? 309 ALA B C 1 ATOM 4535 O O . ALA B 1 221 ? -27.971 43.565 -25.901 1.00 7.75 ? 309 ALA B O 1 ATOM 4536 C CB . ALA B 1 221 ? -30.216 41.794 -26.010 1.00 7.36 ? 309 ALA B CB 1 ATOM 4537 N N . ASN B 1 222 ? -27.728 43.303 -23.693 1.00 8.00 ? 310 ASN B N 1 ATOM 4538 C CA . ASN B 1 222 ? -26.819 44.398 -23.612 1.00 7.41 ? 310 ASN B CA 1 ATOM 4539 C C . ASN B 1 222 ? -25.538 43.923 -22.961 1.00 7.32 ? 310 ASN B C 1 ATOM 4540 O O . ASN B 1 222 ? -25.324 42.697 -22.892 1.00 6.61 ? 310 ASN B O 1 ATOM 4541 C CB . ASN B 1 222 ? -27.444 45.637 -22.947 1.00 8.02 ? 310 ASN B CB 1 ATOM 4542 C CG . ASN B 1 222 ? -26.888 46.944 -23.530 1.00 7.13 ? 310 ASN B CG 1 ATOM 4543 O OD1 . ASN B 1 222 ? -25.688 47.304 -23.304 1.00 7.34 ? 310 ASN B OD1 1 ATOM 4544 N ND2 . ASN B 1 222 ? -27.732 47.669 -24.297 1.00 7.53 ? 310 ASN B ND2 1 ATOM 4545 N N . TYR B 1 223 ? -24.696 44.858 -22.547 1.00 5.75 ? 311 TYR B N 1 ATOM 4546 C CA . TYR B 1 223 ? -23.277 44.536 -22.296 1.00 6.06 ? 311 TYR B CA 1 ATOM 4547 C C . TYR B 1 223 ? -22.725 45.043 -20.987 1.00 6.29 ? 311 TYR B C 1 ATOM 4548 O O . TYR B 1 223 ? -21.511 45.021 -20.787 1.00 6.64 ? 311 TYR B O 1 ATOM 4549 C CB . TYR B 1 223 ? -22.424 45.121 -23.424 1.00 6.55 ? 311 TYR B CB 1 ATOM 4550 C CG . TYR B 1 223 ? -22.950 44.926 -24.849 1.00 7.97 ? 311 TYR B CG 1 ATOM 4551 C CD1 . TYR B 1 223 ? -22.668 43.774 -25.570 1.00 9.63 ? 311 TYR B CD1 1 ATOM 4552 C CD2 . TYR B 1 223 ? -23.691 45.897 -25.478 1.00 8.63 ? 311 TYR B CD2 1 ATOM 4553 C CE1 . TYR B 1 223 ? -23.142 43.586 -26.858 1.00 6.71 ? 311 TYR B CE1 1 ATOM 4554 C CE2 . TYR B 1 223 ? -24.125 45.737 -26.791 1.00 10.69 ? 311 TYR B CE2 1 ATOM 4555 C CZ . TYR B 1 223 ? -23.861 44.581 -27.464 1.00 9.84 ? 311 TYR B CZ 1 ATOM 4556 O OH . TYR B 1 223 ? -24.296 44.466 -28.754 1.00 7.80 ? 311 TYR B OH 1 ATOM 4557 N N . ASN B 1 224 ? -23.603 45.593 -20.145 1.00 7.35 ? 312 ASN B N 1 ATOM 4558 C CA . ASN B 1 224 ? -23.180 46.288 -18.965 1.00 7.63 ? 312 ASN B CA 1 ATOM 4559 C C . ASN B 1 224 ? -22.500 45.388 -17.957 1.00 7.45 ? 312 ASN B C 1 ATOM 4560 O O . ASN B 1 224 ? -22.813 44.218 -17.859 1.00 7.29 ? 312 ASN B O 1 ATOM 4561 C CB . ASN B 1 224 ? -24.317 46.990 -18.280 1.00 7.00 ? 312 ASN B CB 1 ATOM 4562 C CG . ASN B 1 224 ? -24.933 48.085 -19.121 1.00 9.82 ? 312 ASN B CG 1 ATOM 4563 O OD1 . ASN B 1 224 ? -24.314 48.614 -20.052 1.00 13.80 ? 312 ASN B OD1 1 ATOM 4564 N ND2 . ASN B 1 224 ? -26.138 48.455 -18.770 1.00 10.63 ? 312 ASN B ND2 1 ATOM 4565 N N . ALA B 1 225 ? -21.562 45.960 -17.201 1.00 6.56 ? 313 ALA B N 1 ATOM 4566 C CA . ALA B 1 225 ? -20.968 45.262 -16.067 1.00 7.75 ? 313 ALA B CA 1 ATOM 4567 C C . ALA B 1 225 ? -21.988 45.030 -14.978 1.00 8.28 ? 313 ALA B C 1 ATOM 4568 O O . ALA B 1 225 ? -22.897 45.837 -14.816 1.00 8.13 ? 313 ALA B O 1 ATOM 4569 C CB . ALA B 1 225 ? -19.792 46.060 -15.501 1.00 7.49 ? 313 ALA B CB 1 ATOM 4570 N N . TRP B 1 226 ? -21.872 43.913 -14.264 1.00 8.06 ? 314 TRP B N 1 ATOM 4571 C CA . TRP B 1 226 ? -22.557 43.780 -13.004 1.00 8.76 ? 314 TRP B CA 1 ATOM 4572 C C . TRP B 1 226 ? -21.945 44.802 -12.036 1.00 8.86 ? 314 TRP B C 1 ATOM 4573 O O . TRP B 1 226 ? -22.625 45.668 -11.495 1.00 8.95 ? 314 TRP B O 1 ATOM 4574 C CB . TRP B 1 226 ? -22.423 42.364 -12.450 1.00 8.88 ? 314 TRP B CB 1 ATOM 4575 C CG . TRP B 1 226 ? -22.600 42.292 -11.001 1.00 8.10 ? 314 TRP B CG 1 ATOM 4576 C CD1 . TRP B 1 226 ? -21.671 41.902 -10.090 1.00 8.35 ? 314 TRP B CD1 1 ATOM 4577 C CD2 . TRP B 1 226 ? -23.782 42.632 -10.258 1.00 6.22 ? 314 TRP B CD2 1 ATOM 4578 N NE1 . TRP B 1 226 ? -22.206 41.961 -8.827 1.00 7.89 ? 314 TRP B NE1 1 ATOM 4579 C CE2 . TRP B 1 226 ? -23.499 42.413 -8.902 1.00 8.16 ? 314 TRP B CE2 1 ATOM 4580 C CE3 . TRP B 1 226 ? -25.058 43.051 -10.604 1.00 7.94 ? 314 TRP B CE3 1 ATOM 4581 C CZ2 . TRP B 1 226 ? -24.434 42.619 -7.905 1.00 8.12 ? 314 TRP B CZ2 1 ATOM 4582 C CZ3 . TRP B 1 226 ? -25.977 43.281 -9.605 1.00 8.37 ? 314 TRP B CZ3 1 ATOM 4583 C CH2 . TRP B 1 226 ? -25.668 43.047 -8.279 1.00 9.94 ? 314 TRP B CH2 1 ATOM 4584 N N . SER B 1 227 ? -20.630 44.722 -11.831 1.00 10.33 ? 315 SER B N 1 ATOM 4585 C CA . SER B 1 227 ? -19.996 45.581 -10.874 1.00 10.36 ? 315 SER B CA 1 ATOM 4586 C C . SER B 1 227 ? -18.542 45.860 -11.265 1.00 11.49 ? 315 SER B C 1 ATOM 4587 O O . SER B 1 227 ? -17.719 44.941 -11.354 1.00 12.42 ? 315 SER B O 1 ATOM 4588 C CB . SER B 1 227 ? -20.052 44.967 -9.469 1.00 10.99 ? 315 SER B CB 1 ATOM 4589 O OG . SER B 1 227 ? -19.481 45.839 -8.518 1.00 9.94 ? 315 SER B OG 1 ATOM 4590 N N . VAL B 1 228 ? -18.247 47.118 -11.551 1.00 11.34 ? 316 VAL B N 1 ATOM 4591 C CA . VAL B 1 228 ? -16.876 47.518 -11.846 1.00 12.50 ? 316 VAL B CA 1 ATOM 4592 C C . VAL B 1 228 ? -16.552 48.673 -10.946 1.00 13.40 ? 316 VAL B C 1 ATOM 4593 O O . VAL B 1 228 ? -17.442 49.387 -10.497 1.00 11.98 ? 316 VAL B O 1 ATOM 4594 C CB . VAL B 1 228 ? -16.613 47.867 -13.350 1.00 12.03 ? 316 VAL B CB 1 ATOM 4595 C CG1 . VAL B 1 228 ? -16.599 46.628 -14.150 1.00 15.72 ? 316 VAL B CG1 1 ATOM 4596 C CG2 . VAL B 1 228 ? -17.642 48.869 -13.915 1.00 11.82 ? 316 VAL B CG2 1 ATOM 4597 N N . SER B 1 229 ? -15.265 48.847 -10.647 1.00 14.06 ? 317 SER B N 1 ATOM 4598 C CA . SER B 1 229 ? -14.873 49.813 -9.646 1.00 14.71 ? 317 SER B CA 1 ATOM 4599 C C . SER B 1 229 ? -14.808 51.203 -10.242 1.00 14.95 ? 317 SER B C 1 ATOM 4600 O O . SER B 1 229 ? -14.786 52.176 -9.510 1.00 15.68 ? 317 SER B O 1 ATOM 4601 C CB . SER B 1 229 ? -13.502 49.458 -9.037 1.00 15.42 ? 317 SER B CB 1 ATOM 4602 O OG . SER B 1 229 ? -12.499 49.608 -10.011 1.00 16.73 ? 317 SER B OG 1 ATOM 4603 N N . SER B 1 230 ? -14.680 51.299 -11.555 1.00 14.06 ? 318 SER B N 1 ATOM 4604 C CA . SER B 1 230 ? -14.639 52.608 -12.175 1.00 14.60 ? 318 SER B CA 1 ATOM 4605 C C . SER B 1 230 ? -15.592 52.672 -13.356 1.00 12.90 ? 318 SER B C 1 ATOM 4606 O O . SER B 1 230 ? -15.738 51.690 -14.073 1.00 13.47 ? 318 SER B O 1 ATOM 4607 C CB . SER B 1 230 ? -13.216 52.950 -12.592 1.00 15.05 ? 318 SER B CB 1 ATOM 4608 O OG . SER B 1 230 ? -12.929 52.444 -13.857 1.00 17.61 ? 318 SER B OG 1 ATOM 4609 N N . PRO B 1 231 ? -16.262 53.812 -13.544 1.00 11.61 ? 319 PRO B N 1 ATOM 4610 C CA . PRO B 1 231 ? -17.272 53.903 -14.600 1.00 10.06 ? 319 PRO B CA 1 ATOM 4611 C C . PRO B 1 231 ? -16.658 53.828 -15.967 1.00 9.45 ? 319 PRO B C 1 ATOM 4612 O O . PRO B 1 231 ? -15.735 54.569 -16.238 1.00 9.85 ? 319 PRO B O 1 ATOM 4613 C CB . PRO B 1 231 ? -17.890 55.290 -14.408 1.00 10.36 ? 319 PRO B CB 1 ATOM 4614 C CG . PRO B 1 231 ? -17.329 55.853 -13.135 1.00 12.03 ? 319 PRO B CG 1 ATOM 4615 C CD . PRO B 1 231 ? -16.122 55.065 -12.779 1.00 11.23 ? 319 PRO B CD 1 ATOM 4616 N N . PRO B 1 232 ? -17.153 52.976 -16.845 1.00 8.80 ? 320 PRO B N 1 ATOM 4617 C CA . PRO B 1 232 ? -16.694 53.025 -18.233 1.00 9.28 ? 320 PRO B CA 1 ATOM 4618 C C . PRO B 1 232 ? -16.943 54.432 -18.801 1.00 8.90 ? 320 PRO B C 1 ATOM 4619 O O . PRO B 1 232 ? -17.922 55.048 -18.369 1.00 8.07 ? 320 PRO B O 1 ATOM 4620 C CB . PRO B 1 232 ? -17.522 51.948 -18.908 1.00 8.91 ? 320 PRO B CB 1 ATOM 4621 C CG . PRO B 1 232 ? -17.938 51.042 -17.786 1.00 9.16 ? 320 PRO B CG 1 ATOM 4622 C CD . PRO B 1 232 ? -18.191 51.945 -16.637 1.00 9.01 ? 320 PRO B CD 1 ATOM 4623 N N . PRO B 1 233 ? -16.065 54.979 -19.662 1.00 8.82 ? 321 PRO B N 1 ATOM 4624 C CA . PRO B 1 233 ? -16.198 56.382 -20.084 1.00 9.02 ? 321 PRO B CA 1 ATOM 4625 C C . PRO B 1 233 ? -17.545 56.754 -20.735 1.00 8.46 ? 321 PRO B C 1 ATOM 4626 O O . PRO B 1 233 ? -18.045 57.875 -20.539 1.00 9.09 ? 321 PRO B O 1 ATOM 4627 C CB . PRO B 1 233 ? -15.043 56.560 -21.096 1.00 9.23 ? 321 PRO B CB 1 ATOM 4628 C CG . PRO B 1 233 ? -14.073 55.499 -20.724 1.00 10.03 ? 321 PRO B CG 1 ATOM 4629 C CD . PRO B 1 233 ? -14.907 54.328 -20.308 1.00 9.60 ? 321 PRO B CD 1 ATOM 4630 N N . TYR B 1 234 ? -18.125 55.825 -21.481 1.00 8.65 ? 322 TYR B N 1 ATOM 4631 C CA . TYR B 1 234 ? -19.376 56.071 -22.205 1.00 8.24 ? 322 TYR B CA 1 ATOM 4632 C C . TYR B 1 234 ? -20.566 56.146 -21.257 1.00 7.90 ? 322 TYR B C 1 ATOM 4633 O O . TYR B 1 234 ? -21.662 56.534 -21.681 1.00 9.45 ? 322 TYR B O 1 ATOM 4634 C CB . TYR B 1 234 ? -19.599 55.010 -23.308 1.00 8.10 ? 322 TYR B CB 1 ATOM 4635 C CG . TYR B 1 234 ? -19.314 53.601 -22.844 1.00 9.14 ? 322 TYR B CG 1 ATOM 4636 C CD1 . TYR B 1 234 ? -20.207 52.938 -22.028 1.00 8.53 ? 322 TYR B CD1 1 ATOM 4637 C CD2 . TYR B 1 234 ? -18.126 52.956 -23.190 1.00 9.78 ? 322 TYR B CD2 1 ATOM 4638 C CE1 . TYR B 1 234 ? -19.951 51.629 -21.580 1.00 9.13 ? 322 TYR B CE1 1 ATOM 4639 C CE2 . TYR B 1 234 ? -17.845 51.686 -22.752 1.00 9.06 ? 322 TYR B CE2 1 ATOM 4640 C CZ . TYR B 1 234 ? -18.752 51.024 -21.931 1.00 9.28 ? 322 TYR B CZ 1 ATOM 4641 O OH . TYR B 1 234 ? -18.483 49.774 -21.436 1.00 8.60 ? 322 TYR B OH 1 ATOM 4642 N N . THR B 1 235 ? -20.368 55.818 -19.972 1.00 7.80 ? 323 THR B N 1 ATOM 4643 C CA . THR B 1 235 ? -21.449 55.909 -18.984 1.00 8.32 ? 323 THR B CA 1 ATOM 4644 C C . THR B 1 235 ? -21.606 57.255 -18.310 1.00 8.03 ? 323 THR B C 1 ATOM 4645 O O . THR B 1 235 ? -22.678 57.520 -17.733 1.00 7.01 ? 323 THR B O 1 ATOM 4646 C CB . THR B 1 235 ? -21.347 54.836 -17.860 1.00 9.14 ? 323 THR B CB 1 ATOM 4647 O OG1 . THR B 1 235 ? -20.251 55.151 -16.970 1.00 8.85 ? 323 THR B OG1 1 ATOM 4648 C CG2 . THR B 1 235 ? -21.108 53.437 -18.418 1.00 8.94 ? 323 THR B CG2 1 ATOM 4649 N N . SER B 1 236 ? -20.575 58.102 -18.332 1.00 8.33 ? 324 SER B N 1 ATOM 4650 C CA . SER B 1 236 ? -20.662 59.385 -17.661 1.00 8.87 ? 324 SER B CA 1 ATOM 4651 C C . SER B 1 236 ? -21.734 60.282 -18.313 1.00 7.98 ? 324 SER B C 1 ATOM 4652 O O . SER B 1 236 ? -21.850 60.300 -19.541 1.00 7.32 ? 324 SER B O 1 ATOM 4653 C CB . SER B 1 236 ? -19.305 60.129 -17.622 1.00 10.63 ? 324 SER B CB 1 ATOM 4654 O OG . SER B 1 236 ? -18.798 60.336 -18.925 1.00 16.43 ? 324 SER B OG 1 ATOM 4655 N N . PRO B 1 237 ? -22.463 61.061 -17.527 1.00 7.09 ? 325 PRO B N 1 ATOM 4656 C CA . PRO B 1 237 ? -22.367 61.159 -16.054 1.00 6.64 ? 325 PRO B CA 1 ATOM 4657 C C . PRO B 1 237 ? -23.398 60.355 -15.198 1.00 6.89 ? 325 PRO B C 1 ATOM 4658 O O . PRO B 1 237 ? -23.705 60.717 -14.066 1.00 6.23 ? 325 PRO B O 1 ATOM 4659 C CB . PRO B 1 237 ? -22.593 62.647 -15.847 1.00 7.49 ? 325 PRO B CB 1 ATOM 4660 C CG . PRO B 1 237 ? -23.617 62.967 -16.884 1.00 6.17 ? 325 PRO B CG 1 ATOM 4661 C CD . PRO B 1 237 ? -23.338 62.126 -18.069 1.00 7.11 ? 325 PRO B CD 1 ATOM 4662 N N . ASN B 1 238 ? -23.907 59.259 -15.729 1.00 6.47 ? 326 ASN B N 1 ATOM 4663 C CA . ASN B 1 238 ? -24.891 58.453 -15.022 1.00 6.70 ? 326 ASN B CA 1 ATOM 4664 C C . ASN B 1 238 ? -24.283 57.813 -13.779 1.00 7.74 ? 326 ASN B C 1 ATOM 4665 O O . ASN B 1 238 ? -23.381 56.995 -13.933 1.00 7.52 ? 326 ASN B O 1 ATOM 4666 C CB . ASN B 1 238 ? -25.399 57.366 -15.952 1.00 7.04 ? 326 ASN B CB 1 ATOM 4667 C CG . ASN B 1 238 ? -26.554 56.581 -15.361 1.00 5.22 ? 326 ASN B CG 1 ATOM 4668 O OD1 . ASN B 1 238 ? -26.905 56.755 -14.182 1.00 3.90 ? 326 ASN B OD1 1 ATOM 4669 N ND2 . ASN B 1 238 ? -27.188 55.759 -16.181 1.00 4.15 ? 326 ASN B ND2 1 ATOM 4670 N N . PRO B 1 239 ? -24.750 58.159 -12.571 1.00 8.18 ? 327 PRO B N 1 ATOM 4671 C CA . PRO B 1 239 ? -24.201 57.537 -11.357 1.00 8.80 ? 327 PRO B CA 1 ATOM 4672 C C . PRO B 1 239 ? -24.449 56.042 -11.310 1.00 8.72 ? 327 PRO B C 1 ATOM 4673 O O . PRO B 1 239 ? -23.724 55.308 -10.633 1.00 7.92 ? 327 PRO B O 1 ATOM 4674 C CB . PRO B 1 239 ? -24.943 58.255 -10.228 1.00 9.59 ? 327 PRO B CB 1 ATOM 4675 C CG . PRO B 1 239 ? -26.214 58.679 -10.840 1.00 9.61 ? 327 PRO B CG 1 ATOM 4676 C CD . PRO B 1 239 ? -25.830 59.112 -12.238 1.00 8.72 ? 327 PRO B CD 1 ATOM 4677 N N . ASN B 1 240 ? -25.496 55.594 -11.999 1.00 7.47 ? 328 ASN B N 1 ATOM 4678 C CA . ASN B 1 240 ? -25.810 54.175 -12.086 1.00 7.19 ? 328 ASN B CA 1 ATOM 4679 C C . ASN B 1 240 ? -25.124 53.587 -13.312 1.00 6.53 ? 328 ASN B C 1 ATOM 4680 O O . ASN B 1 240 ? -25.727 53.367 -14.349 1.00 6.93 ? 328 ASN B O 1 ATOM 4681 C CB . ASN B 1 240 ? -27.332 53.983 -12.090 1.00 7.37 ? 328 ASN B CB 1 ATOM 4682 C CG . ASN B 1 240 ? -27.970 54.526 -10.822 1.00 8.80 ? 328 ASN B CG 1 ATOM 4683 O OD1 . ASN B 1 240 ? -27.436 54.322 -9.744 1.00 13.01 ? 328 ASN B OD1 1 ATOM 4684 N ND2 . ASN B 1 240 ? -29.079 55.277 -10.949 1.00 9.02 ? 328 ASN B ND2 1 ATOM 4685 N N . TYR B 1 241 ? -23.817 53.361 -13.187 1.00 6.78 ? 329 TYR B N 1 ATOM 4686 C CA . TYR B 1 241 ? -22.968 53.039 -14.327 1.00 7.36 ? 329 TYR B CA 1 ATOM 4687 C C . TYR B 1 241 ? -22.767 51.550 -14.481 1.00 7.52 ? 329 TYR B C 1 ATOM 4688 O O . TYR B 1 241 ? -22.152 51.117 -15.439 1.00 8.10 ? 329 TYR B O 1 ATOM 4689 C CB . TYR B 1 241 ? -21.618 53.767 -14.214 1.00 6.54 ? 329 TYR B CB 1 ATOM 4690 C CG . TYR B 1 241 ? -20.787 53.320 -13.031 1.00 7.79 ? 329 TYR B CG 1 ATOM 4691 C CD1 . TYR B 1 241 ? -20.029 52.144 -13.095 1.00 8.24 ? 329 TYR B CD1 1 ATOM 4692 C CD2 . TYR B 1 241 ? -20.754 54.053 -11.863 1.00 10.93 ? 329 TYR B CD2 1 ATOM 4693 C CE1 . TYR B 1 241 ? -19.256 51.726 -12.018 1.00 10.61 ? 329 TYR B CE1 1 ATOM 4694 C CE2 . TYR B 1 241 ? -19.973 53.647 -10.778 1.00 13.54 ? 329 TYR B CE2 1 ATOM 4695 C CZ . TYR B 1 241 ? -19.244 52.470 -10.869 1.00 11.50 ? 329 TYR B CZ 1 ATOM 4696 O OH . TYR B 1 241 ? -18.496 52.059 -9.802 1.00 13.50 ? 329 TYR B OH 1 ATOM 4697 N N . ASP B 1 242 ? -23.325 50.756 -13.573 1.00 6.90 ? 330 ASP B N 1 ATOM 4698 C CA . ASP B 1 242 ? -23.304 49.314 -13.761 1.00 6.51 ? 330 ASP B CA 1 ATOM 4699 C C . ASP B 1 242 ? -24.597 48.740 -13.194 1.00 6.57 ? 330 ASP B C 1 ATOM 4700 O O . ASP B 1 242 ? -25.424 49.470 -12.649 1.00 6.70 ? 330 ASP B O 1 ATOM 4701 C CB . ASP B 1 242 ? -22.074 48.639 -13.160 1.00 6.40 ? 330 ASP B CB 1 ATOM 4702 C CG . ASP B 1 242 ? -21.884 48.932 -11.683 1.00 8.13 ? 330 ASP B CG 1 ATOM 4703 O OD1 . ASP B 1 242 ? -22.855 49.306 -10.966 1.00 6.76 ? 330 ASP B OD1 1 ATOM 4704 O OD2 . ASP B 1 242 ? -20.753 48.841 -11.156 1.00 8.64 ? 330 ASP B OD2 1 ATOM 4705 N N . GLU B 1 243 ? -24.788 47.452 -13.362 1.00 6.48 ? 331 GLU B N 1 ATOM 4706 C CA . GLU B 1 243 ? -26.115 46.900 -13.041 1.00 6.59 ? 331 GLU B CA 1 ATOM 4707 C C . GLU B 1 243 ? -26.358 46.862 -11.521 1.00 6.09 ? 331 GLU B C 1 ATOM 4708 O O . GLU B 1 243 ? -27.478 47.028 -11.060 1.00 6.72 ? 331 GLU B O 1 ATOM 4709 C CB . GLU B 1 243 ? -26.297 45.522 -13.661 1.00 6.11 ? 331 GLU B CB 1 ATOM 4710 C CG . GLU B 1 243 ? -26.358 45.574 -15.194 1.00 6.67 ? 331 GLU B CG 1 ATOM 4711 C CD . GLU B 1 243 ? -27.539 46.401 -15.721 1.00 10.08 ? 331 GLU B CD 1 ATOM 4712 O OE1 . GLU B 1 243 ? -28.702 46.198 -15.306 1.00 12.17 ? 331 GLU B OE1 1 ATOM 4713 O OE2 . GLU B 1 243 ? -27.318 47.285 -16.558 1.00 12.87 ? 331 GLU B OE2 1 ATOM 4714 N N . LYS B 1 244 ? -25.307 46.642 -10.754 1.00 7.04 ? 332 LYS B N 1 ATOM 4715 C CA . LYS B 1 244 ? -25.362 46.723 -9.304 1.00 6.82 ? 332 LYS B CA 1 ATOM 4716 C C . LYS B 1 244 ? -25.880 48.086 -8.817 1.00 7.51 ? 332 LYS B C 1 ATOM 4717 O O . LYS B 1 244 ? -26.810 48.166 -7.978 1.00 7.05 ? 332 LYS B O 1 ATOM 4718 C CB . LYS B 1 244 ? -23.994 46.426 -8.686 1.00 6.65 ? 332 LYS B CB 1 ATOM 4719 C CG . LYS B 1 244 ? -24.046 46.373 -7.174 1.00 8.59 ? 332 LYS B CG 1 ATOM 4720 C CD . LYS B 1 244 ? -22.705 45.871 -6.567 1.00 10.26 ? 332 LYS B CD 1 ATOM 4721 C CE . LYS B 1 244 ? -22.751 45.834 -5.064 1.00 13.70 ? 332 LYS B CE 1 ATOM 4722 N NZ . LYS B 1 244 ? -21.381 45.539 -4.529 1.00 17.10 ? 332 LYS B NZ 1 ATOM 4723 N N . HIS B 1 245 ? -25.262 49.169 -9.289 1.00 6.90 ? 333 HIS B N 1 ATOM 4724 C CA . HIS B 1 245 ? -25.759 50.508 -8.934 1.00 6.98 ? 333 HIS B CA 1 ATOM 4725 C C . HIS B 1 245 ? -27.243 50.701 -9.337 1.00 6.96 ? 333 HIS B C 1 ATOM 4726 O O . HIS B 1 245 ? -28.047 51.221 -8.546 1.00 6.17 ? 333 HIS B O 1 ATOM 4727 C CB . HIS B 1 245 ? -24.940 51.601 -9.580 1.00 7.19 ? 333 HIS B CB 1 ATOM 4728 C CG . HIS B 1 245 ? -23.642 51.897 -8.898 1.00 9.98 ? 333 HIS B CG 1 ATOM 4729 N ND1 . HIS B 1 245 ? -22.519 51.129 -9.093 1.00 10.29 ? 333 HIS B ND1 1 ATOM 4730 C CD2 . HIS B 1 245 ? -23.270 52.906 -8.074 1.00 9.32 ? 333 HIS B CD2 1 ATOM 4731 C CE1 . HIS B 1 245 ? -21.512 51.639 -8.410 1.00 11.28 ? 333 HIS B CE1 1 ATOM 4732 N NE2 . HIS B 1 245 ? -21.940 52.717 -7.774 1.00 10.75 ? 333 HIS B NE2 1 ATOM 4733 N N . TYR B 1 246 ? -27.571 50.329 -10.571 1.00 7.35 ? 334 TYR B N 1 ATOM 4734 C CA . TYR B 1 246 ? -28.935 50.428 -11.092 1.00 7.55 ? 334 TYR B CA 1 ATOM 4735 C C . TYR B 1 246 ? -29.915 49.723 -10.167 1.00 7.37 ? 334 TYR B C 1 ATOM 4736 O O . TYR B 1 246 ? -30.901 50.321 -9.699 1.00 6.94 ? 334 TYR B O 1 ATOM 4737 C CB . TYR B 1 246 ? -28.980 49.847 -12.487 1.00 8.48 ? 334 TYR B CB 1 ATOM 4738 C CG . TYR B 1 246 ? -30.344 49.721 -13.116 1.00 8.37 ? 334 TYR B CG 1 ATOM 4739 C CD1 . TYR B 1 246 ? -31.340 50.676 -12.879 1.00 8.19 ? 334 TYR B CD1 1 ATOM 4740 C CD2 . TYR B 1 246 ? -30.620 48.687 -14.015 1.00 9.53 ? 334 TYR B CD2 1 ATOM 4741 C CE1 . TYR B 1 246 ? -32.618 50.546 -13.456 1.00 8.81 ? 334 TYR B CE1 1 ATOM 4742 C CE2 . TYR B 1 246 ? -31.883 48.579 -14.633 1.00 9.35 ? 334 TYR B CE2 1 ATOM 4743 C CZ . TYR B 1 246 ? -32.864 49.519 -14.347 1.00 9.50 ? 334 TYR B CZ 1 ATOM 4744 O OH . TYR B 1 246 ? -34.105 49.432 -14.932 1.00 6.98 ? 334 TYR B OH 1 ATOM 4745 N N . ILE B 1 247 ? -29.629 48.463 -9.854 1.00 7.51 ? 335 ILE B N 1 ATOM 4746 C CA . ILE B 1 247 ? -30.567 47.651 -9.071 1.00 7.29 ? 335 ILE B CA 1 ATOM 4747 C C . ILE B 1 247 ? -30.711 48.178 -7.602 1.00 7.16 ? 335 ILE B C 1 ATOM 4748 O O . ILE B 1 247 ? -31.803 48.215 -6.997 1.00 8.00 ? 335 ILE B O 1 ATOM 4749 C CB . ILE B 1 247 ? -30.115 46.171 -9.171 1.00 7.64 ? 335 ILE B CB 1 ATOM 4750 C CG1 . ILE B 1 247 ? -30.455 45.620 -10.567 1.00 8.47 ? 335 ILE B CG1 1 ATOM 4751 C CG2 . ILE B 1 247 ? -30.682 45.331 -8.050 1.00 9.90 ? 335 ILE B CG2 1 ATOM 4752 C CD1 . ILE B 1 247 ? -29.795 44.285 -10.898 1.00 10.59 ? 335 ILE B CD1 1 ATOM 4753 N N . GLU B 1 248 ? -29.617 48.629 -7.040 1.00 7.24 ? 336 GLU B N 1 ATOM 4754 C CA . GLU B 1 248 ? -29.644 49.155 -5.670 1.00 7.30 ? 336 GLU B CA 1 ATOM 4755 C C . GLU B 1 248 ? -30.449 50.456 -5.593 1.00 8.04 ? 336 GLU B C 1 ATOM 4756 O O . GLU B 1 248 ? -30.986 50.788 -4.518 1.00 7.83 ? 336 GLU B O 1 ATOM 4757 C CB . GLU B 1 248 ? -28.227 49.344 -5.139 1.00 8.15 ? 336 GLU B CB 1 ATOM 4758 C CG . GLU B 1 248 ? -27.595 47.994 -4.832 1.00 8.40 ? 336 GLU B CG 1 ATOM 4759 C CD . GLU B 1 248 ? -26.220 48.062 -4.208 1.00 14.14 ? 336 GLU B CD 1 ATOM 4760 O OE1 . GLU B 1 248 ? -25.605 49.166 -4.162 1.00 14.54 ? 336 GLU B OE1 1 ATOM 4761 O OE2 . GLU B 1 248 ? -25.749 46.990 -3.745 1.00 14.85 ? 336 GLU B OE2 1 ATOM 4762 N N . ALA B 1 249 ? -30.526 51.195 -6.707 1.00 7.73 ? 337 ALA B N 1 ATOM 4763 C CA . ALA B 1 249 ? -31.307 52.439 -6.743 1.00 7.59 ? 337 ALA B CA 1 ATOM 4764 C C . ALA B 1 249 ? -32.754 52.176 -7.098 1.00 7.21 ? 337 ALA B C 1 ATOM 4765 O O . ALA B 1 249 ? -33.668 52.863 -6.612 1.00 6.68 ? 337 ALA B O 1 ATOM 4766 C CB . ALA B 1 249 ? -30.697 53.441 -7.715 1.00 7.96 ? 337 ALA B CB 1 ATOM 4767 N N . PHE B 1 250 ? -32.951 51.194 -7.963 1.00 7.41 ? 338 PHE B N 1 ATOM 4768 C CA . PHE B 1 250 ? -34.275 50.831 -8.511 1.00 7.22 ? 338 PHE B CA 1 ATOM 4769 C C . PHE B 1 250 ? -35.148 50.099 -7.491 1.00 8.60 ? 338 PHE B C 1 ATOM 4770 O O . PHE B 1 250 ? -36.317 50.415 -7.320 1.00 7.68 ? 338 PHE B O 1 ATOM 4771 C CB . PHE B 1 250 ? -34.051 49.964 -9.744 1.00 7.53 ? 338 PHE B CB 1 ATOM 4772 C CG . PHE B 1 250 ? -35.212 49.890 -10.722 1.00 6.71 ? 338 PHE B CG 1 ATOM 4773 C CD1 . PHE B 1 250 ? -36.194 50.839 -10.782 1.00 7.72 ? 338 PHE B CD1 1 ATOM 4774 C CD2 . PHE B 1 250 ? -35.228 48.864 -11.661 1.00 8.86 ? 338 PHE B CD2 1 ATOM 4775 C CE1 . PHE B 1 250 ? -37.245 50.735 -11.757 1.00 6.42 ? 338 PHE B CE1 1 ATOM 4776 C CE2 . PHE B 1 250 ? -36.244 48.760 -12.589 1.00 8.94 ? 338 PHE B CE2 1 ATOM 4777 C CZ . PHE B 1 250 ? -37.263 49.693 -12.612 1.00 8.38 ? 338 PHE B CZ 1 ATOM 4778 N N . ARG B 1 251 ? -34.592 49.112 -6.805 1.00 9.48 ? 339 ARG B N 1 ATOM 4779 C CA . ARG B 1 251 ? -35.405 48.251 -5.927 1.00 9.98 ? 339 ARG B CA 1 ATOM 4780 C C . ARG B 1 251 ? -36.164 49.068 -4.842 1.00 9.91 ? 339 ARG B C 1 ATOM 4781 O O . ARG B 1 251 ? -37.400 48.882 -4.670 1.00 9.42 ? 339 ARG B O 1 ATOM 4782 C CB . ARG B 1 251 ? -34.518 47.132 -5.346 1.00 10.92 ? 339 ARG B CB 1 ATOM 4783 C CG . ARG B 1 251 ? -35.086 46.306 -4.222 1.00 11.47 ? 339 ARG B CG 1 ATOM 4784 C CD . ARG B 1 251 ? -36.445 45.702 -4.462 1.00 13.60 ? 339 ARG B CD 1 ATOM 4785 N NE . ARG B 1 251 ? -36.895 45.069 -3.227 1.00 16.31 ? 339 ARG B NE 1 ATOM 4786 C CZ . ARG B 1 251 ? -36.760 43.775 -2.928 1.00 17.03 ? 339 ARG B CZ 1 ATOM 4787 N NH1 . ARG B 1 251 ? -36.233 42.920 -3.793 1.00 17.00 ? 339 ARG B NH1 1 ATOM 4788 N NH2 . ARG B 1 251 ? -37.185 43.333 -1.745 1.00 18.60 ? 339 ARG B NH2 1 ATOM 4789 N N . PRO B 1 252 ? -35.499 49.983 -4.133 1.00 9.30 ? 340 PRO B N 1 ATOM 4790 C CA . PRO B 1 252 ? -36.232 50.781 -3.134 1.00 9.03 ? 340 PRO B CA 1 ATOM 4791 C C . PRO B 1 252 ? -37.395 51.563 -3.723 1.00 8.97 ? 340 PRO B C 1 ATOM 4792 O O . PRO B 1 252 ? -38.404 51.701 -3.039 1.00 9.46 ? 340 PRO B O 1 ATOM 4793 C CB . PRO B 1 252 ? -35.185 51.743 -2.585 1.00 9.55 ? 340 PRO B CB 1 ATOM 4794 C CG . PRO B 1 252 ? -33.885 51.276 -3.033 1.00 10.66 ? 340 PRO B CG 1 ATOM 4795 C CD . PRO B 1 252 ? -34.069 50.312 -4.145 1.00 9.15 ? 340 PRO B CD 1 ATOM 4796 N N . LEU B 1 253 ? -37.262 52.086 -4.948 1.00 8.10 ? 341 LEU B N 1 ATOM 4797 C CA . LEU B 1 253 ? -38.368 52.808 -5.584 1.00 7.75 ? 341 LEU B CA 1 ATOM 4798 C C . LEU B 1 253 ? -39.518 51.858 -5.916 1.00 8.58 ? 341 LEU B C 1 ATOM 4799 O O . LEU B 1 253 ? -40.668 52.172 -5.719 1.00 8.47 ? 341 LEU B O 1 ATOM 4800 C CB . LEU B 1 253 ? -37.911 53.495 -6.858 1.00 7.75 ? 341 LEU B CB 1 ATOM 4801 C CG . LEU B 1 253 ? -36.804 54.553 -6.754 1.00 9.16 ? 341 LEU B CG 1 ATOM 4802 C CD1 . LEU B 1 253 ? -36.234 54.902 -8.125 1.00 9.73 ? 341 LEU B CD1 1 ATOM 4803 C CD2 . LEU B 1 253 ? -37.302 55.816 -6.078 1.00 11.76 ? 341 LEU B CD2 1 ATOM 4804 N N . LEU B 1 254 ? -39.186 50.685 -6.464 1.00 8.19 ? 342 LEU B N 1 ATOM 4805 C CA . LEU B 1 254 ? -40.205 49.691 -6.759 1.00 8.78 ? 342 LEU B CA 1 ATOM 4806 C C . LEU B 1 254 ? -40.927 49.216 -5.477 1.00 9.11 ? 342 LEU B C 1 ATOM 4807 O O . LEU B 1 254 ? -42.168 49.138 -5.414 1.00 9.59 ? 342 LEU B O 1 ATOM 4808 C CB . LEU B 1 254 ? -39.529 48.529 -7.462 1.00 7.82 ? 342 LEU B CB 1 ATOM 4809 C CG . LEU B 1 254 ? -39.026 48.808 -8.894 1.00 8.62 ? 342 LEU B CG 1 ATOM 4810 C CD1 . LEU B 1 254 ? -37.930 47.808 -9.283 1.00 9.11 ? 342 LEU B CD1 1 ATOM 4811 C CD2 . LEU B 1 254 ? -40.215 48.783 -9.874 1.00 8.19 ? 342 LEU B CD2 1 ATOM 4812 N N . GLU B 1 255 ? -40.152 48.918 -4.444 1.00 9.48 ? 343 GLU B N 1 ATOM 4813 C CA . GLU B 1 255 ? -40.703 48.406 -3.200 1.00 11.19 ? 343 GLU B CA 1 ATOM 4814 C C . GLU B 1 255 ? -41.639 49.426 -2.543 1.00 11.15 ? 343 GLU B C 1 ATOM 4815 O O . GLU B 1 255 ? -42.679 49.036 -2.033 1.00 11.17 ? 343 GLU B O 1 ATOM 4816 C CB . GLU B 1 255 ? -39.578 48.038 -2.222 1.00 11.88 ? 343 GLU B CB 1 ATOM 4817 C CG . GLU B 1 255 ? -40.073 47.437 -0.911 1.00 15.05 ? 343 GLU B CG 1 ATOM 4818 C CD . GLU B 1 255 ? -39.065 46.525 -0.235 1.00 19.65 ? 343 GLU B CD 1 ATOM 4819 O OE1 . GLU B 1 255 ? -37.965 46.313 -0.775 1.00 19.42 ? 343 GLU B OE1 1 ATOM 4820 O OE2 . GLU B 1 255 ? -39.380 46.019 0.859 1.00 25.15 ? 343 GLU B OE2 1 ATOM 4821 N N . ALA B 1 256 ? -41.274 50.706 -2.595 1.00 11.26 ? 344 ALA B N 1 ATOM 4822 C CA . ALA B 1 256 ? -42.066 51.793 -1.998 1.00 11.37 ? 344 ALA B CA 1 ATOM 4823 C C . ALA B 1 256 ? -43.442 51.880 -2.644 1.00 11.68 ? 344 ALA B C 1 ATOM 4824 O O . ALA B 1 256 ? -44.399 52.348 -2.020 1.00 11.10 ? 344 ALA B O 1 ATOM 4825 C CB . ALA B 1 256 ? -41.354 53.126 -2.157 1.00 12.00 ? 344 ALA B CB 1 ATOM 4826 N N . ARG B 1 257 ? -43.522 51.401 -3.884 1.00 10.81 ? 345 ARG B N 1 ATOM 4827 C CA . ARG B 1 257 ? -44.759 51.353 -4.657 1.00 10.97 ? 345 ARG B CA 1 ATOM 4828 C C . ARG B 1 257 ? -45.439 49.984 -4.736 1.00 10.55 ? 345 ARG B C 1 ATOM 4829 O O . ARG B 1 257 ? -46.268 49.777 -5.617 1.00 11.49 ? 345 ARG B O 1 ATOM 4830 C CB . ARG B 1 257 ? -44.480 51.868 -6.076 1.00 10.97 ? 345 ARG B CB 1 ATOM 4831 C CG . ARG B 1 257 ? -44.012 53.322 -6.105 1.00 12.28 ? 345 ARG B CG 1 ATOM 4832 C CD . ARG B 1 257 ? -43.308 53.753 -7.374 1.00 13.70 ? 345 ARG B CD 1 ATOM 4833 N NE . ARG B 1 257 ? -43.074 55.200 -7.322 1.00 16.12 ? 345 ARG B NE 1 ATOM 4834 C CZ . ARG B 1 257 ? -42.087 55.800 -6.648 1.00 18.27 ? 345 ARG B CZ 1 ATOM 4835 N NH1 . ARG B 1 257 ? -41.181 55.101 -5.961 1.00 15.94 ? 345 ARG B NH1 1 ATOM 4836 N NH2 . ARG B 1 257 ? -42.015 57.122 -6.650 1.00 18.53 ? 345 ARG B NH2 1 ATOM 4837 N N . GLY B 1 258 ? -45.095 49.050 -3.843 1.00 10.20 ? 346 GLY B N 1 ATOM 4838 C CA . GLY B 1 258 ? -45.806 47.780 -3.719 1.00 9.16 ? 346 GLY B CA 1 ATOM 4839 C C . GLY B 1 258 ? -45.228 46.585 -4.482 1.00 9.36 ? 346 GLY B C 1 ATOM 4840 O O . GLY B 1 258 ? -45.812 45.498 -4.468 1.00 8.04 ? 346 GLY B O 1 ATOM 4841 N N . PHE B 1 259 ? -44.071 46.784 -5.120 1.00 8.43 ? 347 PHE B N 1 ATOM 4842 C CA . PHE B 1 259 ? -43.406 45.744 -5.946 1.00 9.07 ? 347 PHE B CA 1 ATOM 4843 C C . PHE B 1 259 ? -41.957 45.488 -5.501 1.00 9.23 ? 347 PHE B C 1 ATOM 4844 O O . PHE B 1 259 ? -41.040 46.097 -6.053 1.00 9.94 ? 347 PHE B O 1 ATOM 4845 C CB . PHE B 1 259 ? -43.386 46.197 -7.406 1.00 7.90 ? 347 PHE B CB 1 ATOM 4846 C CG . PHE B 1 259 ? -42.933 45.135 -8.408 1.00 9.51 ? 347 PHE B CG 1 ATOM 4847 C CD1 . PHE B 1 259 ? -42.792 43.801 -8.063 1.00 7.57 ? 347 PHE B CD1 1 ATOM 4848 C CD2 . PHE B 1 259 ? -42.753 45.486 -9.731 1.00 9.43 ? 347 PHE B CD2 1 ATOM 4849 C CE1 . PHE B 1 259 ? -42.453 42.861 -9.011 1.00 7.78 ? 347 PHE B CE1 1 ATOM 4850 C CE2 . PHE B 1 259 ? -42.367 44.549 -10.695 1.00 8.39 ? 347 PHE B CE2 1 ATOM 4851 C CZ . PHE B 1 259 ? -42.220 43.230 -10.326 1.00 7.97 ? 347 PHE B CZ 1 ATOM 4852 N N . PRO B 1 260 ? -41.751 44.564 -4.558 1.00 10.93 ? 348 PRO B N 1 ATOM 4853 C CA . PRO B 1 260 ? -40.405 44.247 -4.053 1.00 11.59 ? 348 PRO B CA 1 ATOM 4854 C C . PRO B 1 260 ? -39.698 43.250 -4.987 1.00 11.58 ? 348 PRO B C 1 ATOM 4855 O O . PRO B 1 260 ? -39.451 42.077 -4.644 1.00 12.51 ? 348 PRO B O 1 ATOM 4856 C CB . PRO B 1 260 ? -40.687 43.650 -2.672 1.00 11.92 ? 348 PRO B CB 1 ATOM 4857 C CG . PRO B 1 260 ? -42.038 42.923 -2.840 1.00 12.20 ? 348 PRO B CG 1 ATOM 4858 C CD . PRO B 1 260 ? -42.782 43.722 -3.920 1.00 10.83 ? 348 PRO B CD 1 ATOM 4859 N N . ALA B 1 261 ? -39.357 43.728 -6.181 1.00 11.29 ? 349 ALA B N 1 ATOM 4860 C CA . ALA B 1 261 ? -38.857 42.872 -7.246 1.00 10.84 ? 349 ALA B CA 1 ATOM 4861 C C . ALA B 1 261 ? -37.494 42.317 -6.902 1.00 9.99 ? 349 ALA B C 1 ATOM 4862 O O . ALA B 1 261 ? -36.646 43.056 -6.460 1.00 10.44 ? 349 ALA B O 1 ATOM 4863 C CB . ALA B 1 261 ? -38.729 43.671 -8.547 1.00 11.38 ? 349 ALA B CB 1 ATOM 4864 N N . GLN B 1 262 ? -37.291 41.019 -7.138 1.00 9.19 ? 350 GLN B N 1 ATOM 4865 C CA . GLN B 1 262 ? -35.960 40.438 -7.184 1.00 8.23 ? 350 GLN B CA 1 ATOM 4866 C C . GLN B 1 262 ? -35.505 40.501 -8.630 1.00 7.77 ? 350 GLN B C 1 ATOM 4867 O O . GLN B 1 262 ? -36.303 40.635 -9.540 1.00 8.88 ? 350 GLN B O 1 ATOM 4868 C CB . GLN B 1 262 ? -35.991 38.978 -6.692 1.00 8.21 ? 350 GLN B CB 1 ATOM 4869 C CG . GLN B 1 262 ? -36.242 38.886 -5.201 1.00 8.07 ? 350 GLN B CG 1 ATOM 4870 C CD . GLN B 1 262 ? -35.030 39.294 -4.366 1.00 9.60 ? 350 GLN B CD 1 ATOM 4871 O OE1 . GLN B 1 262 ? -35.096 40.251 -3.593 1.00 10.35 ? 350 GLN B OE1 1 ATOM 4872 N NE2 . GLN B 1 262 ? -33.943 38.583 -4.517 1.00 8.05 ? 350 GLN B NE2 1 ATOM 4873 N N . PHE B 1 263 ? -34.214 40.408 -8.850 1.00 7.14 ? 351 PHE B N 1 ATOM 4874 C CA . PHE B 1 263 ? -33.691 40.653 -10.168 1.00 6.81 ? 351 PHE B CA 1 ATOM 4875 C C . PHE B 1 263 ? -32.893 39.470 -10.707 1.00 5.62 ? 351 PHE B C 1 ATOM 4876 O O . PHE B 1 263 ? -32.262 38.739 -9.941 1.00 5.72 ? 351 PHE B O 1 ATOM 4877 C CB . PHE B 1 263 ? -32.785 41.865 -10.135 1.00 6.80 ? 351 PHE B CB 1 ATOM 4878 C CG . PHE B 1 263 ? -33.534 43.168 -9.978 1.00 8.53 ? 351 PHE B CG 1 ATOM 4879 C CD1 . PHE B 1 263 ? -34.008 43.576 -8.725 1.00 8.05 ? 351 PHE B CD1 1 ATOM 4880 C CD2 . PHE B 1 263 ? -33.799 43.964 -11.084 1.00 6.72 ? 351 PHE B CD2 1 ATOM 4881 C CE1 . PHE B 1 263 ? -34.690 44.737 -8.593 1.00 9.57 ? 351 PHE B CE1 1 ATOM 4882 C CE2 . PHE B 1 263 ? -34.482 45.150 -10.934 1.00 8.91 ? 351 PHE B CE2 1 ATOM 4883 C CZ . PHE B 1 263 ? -34.934 45.521 -9.716 1.00 7.66 ? 351 PHE B CZ 1 ATOM 4884 N N . ILE B 1 264 ? -32.903 39.329 -12.026 1.00 6.36 ? 352 ILE B N 1 ATOM 4885 C CA . ILE B 1 264 ? -31.870 38.582 -12.747 1.00 7.02 ? 352 ILE B CA 1 ATOM 4886 C C . ILE B 1 264 ? -31.155 39.516 -13.692 1.00 6.64 ? 352 ILE B C 1 ATOM 4887 O O . ILE B 1 264 ? -31.744 40.445 -14.213 1.00 6.39 ? 352 ILE B O 1 ATOM 4888 C CB . ILE B 1 264 ? -32.439 37.342 -13.452 1.00 6.33 ? 352 ILE B CB 1 ATOM 4889 C CG1 . ILE B 1 264 ? -33.468 37.676 -14.542 1.00 7.66 ? 352 ILE B CG1 1 ATOM 4890 C CG2 . ILE B 1 264 ? -32.970 36.368 -12.414 1.00 6.27 ? 352 ILE B CG2 1 ATOM 4891 C CD1 . ILE B 1 264 ? -33.984 36.437 -15.212 1.00 8.45 ? 352 ILE B CD1 1 ATOM 4892 N N . VAL B 1 265 ? -29.841 39.290 -13.867 1.00 6.52 ? 353 VAL B N 1 ATOM 4893 C CA . VAL B 1 265 ? -29.000 40.161 -14.696 1.00 6.98 ? 353 VAL B CA 1 ATOM 4894 C C . VAL B 1 265 ? -28.275 39.388 -15.806 1.00 6.95 ? 353 VAL B C 1 ATOM 4895 O O . VAL B 1 265 ? -27.529 38.470 -15.522 1.00 6.22 ? 353 VAL B O 1 ATOM 4896 C CB . VAL B 1 265 ? -27.921 40.812 -13.808 1.00 6.83 ? 353 VAL B CB 1 ATOM 4897 C CG1 . VAL B 1 265 ? -27.075 41.774 -14.595 1.00 8.93 ? 353 VAL B CG1 1 ATOM 4898 C CG2 . VAL B 1 265 ? -28.570 41.550 -12.618 1.00 8.78 ? 353 VAL B CG2 1 ATOM 4899 N N . ASP B 1 266 ? -28.554 39.745 -17.052 1.00 6.61 ? 354 ASP B N 1 ATOM 4900 C CA . ASP B 1 266 ? -27.859 39.180 -18.216 1.00 7.64 ? 354 ASP B CA 1 ATOM 4901 C C . ASP B 1 266 ? -26.397 39.583 -18.147 1.00 7.39 ? 354 ASP B C 1 ATOM 4902 O O . ASP B 1 266 ? -26.075 40.739 -17.948 1.00 7.74 ? 354 ASP B O 1 ATOM 4903 C CB . ASP B 1 266 ? -28.473 39.687 -19.510 1.00 6.62 ? 354 ASP B CB 1 ATOM 4904 C CG . ASP B 1 266 ? -28.175 38.835 -20.717 1.00 9.33 ? 354 ASP B CG 1 ATOM 4905 O OD1 . ASP B 1 266 ? -27.330 37.887 -20.682 1.00 9.04 ? 354 ASP B OD1 1 ATOM 4906 O OD2 . ASP B 1 266 ? -28.780 39.050 -21.783 1.00 9.00 ? 354 ASP B OD2 1 ATOM 4907 N N . GLN B 1 267 ? -25.516 38.602 -18.252 1.00 7.80 ? 355 GLN B N 1 ATOM 4908 C CA . GLN B 1 267 ? -24.078 38.835 -18.310 1.00 6.65 ? 355 GLN B CA 1 ATOM 4909 C C . GLN B 1 267 ? -23.397 38.063 -19.474 1.00 6.49 ? 355 GLN B C 1 ATOM 4910 O O . GLN B 1 267 ? -22.177 37.961 -19.543 1.00 6.85 ? 355 GLN B O 1 ATOM 4911 C CB . GLN B 1 267 ? -23.451 38.437 -16.985 1.00 6.98 ? 355 GLN B CB 1 ATOM 4912 C CG . GLN B 1 267 ? -23.736 39.369 -15.858 1.00 7.42 ? 355 GLN B CG 1 ATOM 4913 C CD . GLN B 1 267 ? -23.011 40.680 -15.936 1.00 8.31 ? 355 GLN B CD 1 ATOM 4914 O OE1 . GLN B 1 267 ? -21.818 40.742 -15.614 1.00 8.70 ? 355 GLN B OE1 1 ATOM 4915 N NE2 . GLN B 1 267 ? -23.715 41.741 -16.381 1.00 7.75 ? 355 GLN B NE2 1 ATOM 4916 N N . GLY B 1 268 ? -24.185 37.578 -20.420 1.00 6.71 ? 356 GLY B N 1 ATOM 4917 C CA . GLY B 1 268 ? -23.655 36.788 -21.489 1.00 7.27 ? 356 GLY B CA 1 ATOM 4918 C C . GLY B 1 268 ? -22.721 37.496 -22.416 1.00 8.33 ? 356 GLY B C 1 ATOM 4919 O O . GLY B 1 268 ? -21.957 36.840 -23.116 1.00 7.64 ? 356 GLY B O 1 ATOM 4920 N N . ARG B 1 269 ? -22.779 38.824 -22.480 1.00 7.15 ? 357 ARG B N 1 ATOM 4921 C CA . ARG B 1 269 ? -21.848 39.589 -23.316 1.00 5.82 ? 357 ARG B CA 1 ATOM 4922 C C . ARG B 1 269 ? -21.168 40.717 -22.520 1.00 6.05 ? 357 ARG B C 1 ATOM 4923 O O . ARG B 1 269 ? -20.759 41.745 -23.064 1.00 5.61 ? 357 ARG B O 1 ATOM 4924 C CB . ARG B 1 269 ? -22.547 40.106 -24.574 1.00 7.24 ? 357 ARG B CB 1 ATOM 4925 C CG . ARG B 1 269 ? -23.143 39.016 -25.414 1.00 7.20 ? 357 ARG B CG 1 ATOM 4926 C CD . ARG B 1 269 ? -23.656 39.484 -26.782 1.00 8.29 ? 357 ARG B CD 1 ATOM 4927 N NE . ARG B 1 269 ? -24.797 40.390 -26.681 1.00 7.60 ? 357 ARG B NE 1 ATOM 4928 C CZ . ARG B 1 269 ? -25.297 41.027 -27.727 1.00 7.80 ? 357 ARG B CZ 1 ATOM 4929 N NH1 . ARG B 1 269 ? -24.783 40.847 -28.933 1.00 7.73 ? 357 ARG B NH1 1 ATOM 4930 N NH2 . ARG B 1 269 ? -26.309 41.874 -27.580 1.00 8.78 ? 357 ARG B NH2 1 ATOM 4931 N N . SER B 1 270 ? -20.977 40.458 -21.228 1.00 6.47 ? 358 SER B N 1 ATOM 4932 C CA . SER B 1 270 ? -20.486 41.460 -20.260 1.00 5.99 ? 358 SER B CA 1 ATOM 4933 C C . SER B 1 270 ? -19.069 41.217 -19.771 1.00 6.74 ? 358 SER B C 1 ATOM 4934 O O . SER B 1 270 ? -18.603 41.898 -18.901 1.00 6.11 ? 358 SER B O 1 ATOM 4935 C CB . SER B 1 270 ? -21.435 41.519 -19.036 1.00 6.38 ? 358 SER B CB 1 ATOM 4936 O OG . SER B 1 270 ? -22.701 42.023 -19.458 1.00 6.98 ? 358 SER B OG 1 ATOM 4937 N N . GLY B 1 271 ? -18.415 40.199 -20.304 1.00 6.99 ? 359 GLY B N 1 ATOM 4938 C CA . GLY B 1 271 ? -17.087 39.821 -19.823 1.00 6.80 ? 359 GLY B CA 1 ATOM 4939 C C . GLY B 1 271 ? -15.980 40.858 -19.936 1.00 6.60 ? 359 GLY B C 1 ATOM 4940 O O . GLY B 1 271 ? -15.074 40.875 -19.118 1.00 8.29 ? 359 GLY B O 1 ATOM 4941 N N . LYS B 1 272 ? -16.018 41.687 -20.968 1.00 7.25 ? 360 LYS B N 1 ATOM 4942 C CA . LYS B 1 272 ? -14.971 42.661 -21.199 1.00 7.05 ? 360 LYS B CA 1 ATOM 4943 C C . LYS B 1 272 ? -15.488 44.063 -20.896 1.00 6.98 ? 360 LYS B C 1 ATOM 4944 O O . LYS B 1 272 ? -16.504 44.498 -21.454 1.00 6.98 ? 360 LYS B O 1 ATOM 4945 C CB . LYS B 1 272 ? -14.474 42.602 -22.633 1.00 7.35 ? 360 LYS B CB 1 ATOM 4946 C CG . LYS B 1 272 ? -13.242 43.495 -22.919 1.00 9.00 ? 360 LYS B CG 1 ATOM 4947 C CD . LYS B 1 272 ? -12.462 42.998 -24.146 1.00 11.03 ? 360 LYS B CD 1 ATOM 4948 C CE . LYS B 1 272 ? -10.965 43.473 -24.183 1.00 14.72 ? 360 LYS B CE 1 ATOM 4949 N NZ . LYS B 1 272 ? -10.889 44.946 -24.101 1.00 14.98 ? 360 LYS B NZ 1 ATOM 4950 N N . GLN B 1 273 ? -14.817 44.728 -19.963 1.00 6.65 ? 361 GLN B N 1 ATOM 4951 C CA . GLN B 1 273 ? -15.208 46.047 -19.510 1.00 6.77 ? 361 GLN B CA 1 ATOM 4952 C C . GLN B 1 273 ? -13.971 46.969 -19.402 1.00 6.83 ? 361 GLN B C 1 ATOM 4953 O O . GLN B 1 273 ? -12.912 46.568 -18.862 1.00 6.63 ? 361 GLN B O 1 ATOM 4954 C CB . GLN B 1 273 ? -15.880 45.953 -18.141 1.00 6.29 ? 361 GLN B CB 1 ATOM 4955 C CG . GLN B 1 273 ? -17.142 45.086 -18.056 1.00 6.53 ? 361 GLN B CG 1 ATOM 4956 C CD . GLN B 1 273 ? -18.260 45.650 -18.817 1.00 6.01 ? 361 GLN B CD 1 ATOM 4957 O OE1 . GLN B 1 273 ? -18.326 46.880 -19.021 1.00 6.46 ? 361 GLN B OE1 1 ATOM 4958 N NE2 . GLN B 1 273 ? -19.211 44.786 -19.210 1.00 6.92 ? 361 GLN B NE2 1 ATOM 4959 N N . PRO B 1 274 ? -14.052 48.177 -19.952 1.00 7.43 ? 362 PRO B N 1 ATOM 4960 C CA . PRO B 1 274 ? -15.180 48.663 -20.751 1.00 7.36 ? 362 PRO B CA 1 ATOM 4961 C C . PRO B 1 274 ? -15.286 47.920 -22.072 1.00 8.19 ? 362 PRO B C 1 ATOM 4962 O O . PRO B 1 274 ? -14.334 47.304 -22.534 1.00 7.01 ? 362 PRO B O 1 ATOM 4963 C CB . PRO B 1 274 ? -14.788 50.128 -21.065 1.00 8.75 ? 362 PRO B CB 1 ATOM 4964 C CG . PRO B 1 274 ? -13.614 50.423 -20.359 1.00 7.40 ? 362 PRO B CG 1 ATOM 4965 C CD . PRO B 1 274 ? -12.987 49.173 -19.855 1.00 6.37 ? 362 PRO B CD 1 ATOM 4966 N N . THR B 1 275 ? -16.441 48.037 -22.692 1.00 7.92 ? 363 THR B N 1 ATOM 4967 C CA . THR B 1 275 ? -16.655 47.487 -24.032 1.00 8.52 ? 363 THR B CA 1 ATOM 4968 C C . THR B 1 275 ? -16.040 48.422 -25.069 1.00 8.72 ? 363 THR B C 1 ATOM 4969 O O . THR B 1 275 ? -15.483 49.462 -24.726 1.00 8.55 ? 363 THR B O 1 ATOM 4970 C CB . THR B 1 275 ? -18.163 47.405 -24.309 1.00 9.31 ? 363 THR B CB 1 ATOM 4971 O OG1 . THR B 1 275 ? -18.677 48.733 -24.398 1.00 8.25 ? 363 THR B OG1 1 ATOM 4972 C CG2 . THR B 1 275 ? -18.921 46.693 -23.150 1.00 10.47 ? 363 THR B CG2 1 ATOM 4973 N N . GLY B 1 276 ? -16.226 48.091 -26.349 1.00 9.39 ? 364 GLY B N 1 ATOM 4974 C CA . GLY B 1 276 ? -15.798 48.941 -27.456 1.00 9.13 ? 364 GLY B CA 1 ATOM 4975 C C . GLY B 1 276 ? -16.903 49.906 -27.921 1.00 9.73 ? 364 GLY B C 1 ATOM 4976 O O . GLY B 1 276 ? -16.756 50.575 -28.967 1.00 10.26 ? 364 GLY B O 1 ATOM 4977 N N . GLN B 1 277 ? -17.966 50.026 -27.149 1.00 9.02 ? 365 GLN B N 1 ATOM 4978 C CA . GLN B 1 277 ? -19.021 51.007 -27.445 1.00 9.75 ? 365 GLN B CA 1 ATOM 4979 C C . GLN B 1 277 ? -18.461 52.437 -27.391 1.00 10.48 ? 365 GLN B C 1 ATOM 4980 O O . GLN B 1 277 ? -17.713 52.808 -26.452 1.00 9.19 ? 365 GLN B O 1 ATOM 4981 C CB . GLN B 1 277 ? -20.169 50.879 -26.456 1.00 9.75 ? 365 GLN B CB 1 ATOM 4982 C CG . GLN B 1 277 ? -21.024 49.600 -26.590 1.00 9.10 ? 365 GLN B CG 1 ATOM 4983 C CD . GLN B 1 277 ? -21.875 49.359 -25.368 1.00 10.56 ? 365 GLN B CD 1 ATOM 4984 O OE1 . GLN B 1 277 ? -21.328 49.055 -24.294 1.00 12.06 ? 365 GLN B OE1 1 ATOM 4985 N NE2 . GLN B 1 277 ? -23.215 49.481 -25.500 1.00 7.99 ? 365 GLN B NE2 1 ATOM 4986 N N . LYS B 1 278 ? -18.758 53.217 -28.432 1.00 10.36 ? 366 LYS B N 1 ATOM 4987 C CA . LYS B 1 278 ? -18.336 54.611 -28.471 1.00 10.68 ? 366 LYS B CA 1 ATOM 4988 C C . LYS B 1 278 ? -19.288 55.487 -27.680 1.00 10.70 ? 366 LYS B C 1 ATOM 4989 O O . LYS B 1 278 ? -18.878 56.498 -27.075 1.00 9.32 ? 366 LYS B O 1 ATOM 4990 C CB . LYS B 1 278 ? -18.229 55.115 -29.924 1.00 11.58 ? 366 LYS B CB 1 ATOM 4991 C CG . LYS B 1 278 ? -17.072 54.511 -30.731 1.00 14.03 ? 366 LYS B CG 1 ATOM 4992 C CD . LYS B 1 278 ? -15.676 54.970 -30.263 1.00 20.46 ? 366 LYS B CD 1 ATOM 4993 C CE . LYS B 1 278 ? -15.030 56.004 -31.182 1.00 25.46 ? 366 LYS B CE 1 ATOM 4994 N NZ . LYS B 1 278 ? -13.685 55.522 -31.715 1.00 26.48 ? 366 LYS B NZ 1 ATOM 4995 N N . GLU B 1 279 ? -20.574 55.131 -27.745 1.00 10.38 ? 367 GLU B N 1 ATOM 4996 C CA . GLU B 1 279 ? -21.597 55.714 -26.897 1.00 10.85 ? 367 GLU B CA 1 ATOM 4997 C C . GLU B 1 279 ? -22.388 54.582 -26.257 1.00 10.29 ? 367 GLU B C 1 ATOM 4998 O O . GLU B 1 279 ? -22.500 53.478 -26.827 1.00 11.21 ? 367 GLU B O 1 ATOM 4999 C CB . GLU B 1 279 ? -22.529 56.639 -27.710 1.00 11.93 ? 367 GLU B CB 1 ATOM 5000 C CG . GLU B 1 279 ? -21.847 57.782 -28.454 1.00 15.09 ? 367 GLU B CG 1 ATOM 5001 C CD . GLU B 1 279 ? -21.168 58.797 -27.531 1.00 21.51 ? 367 GLU B CD 1 ATOM 5002 O OE1 . GLU B 1 279 ? -21.637 58.965 -26.375 1.00 24.20 ? 367 GLU B OE1 1 ATOM 5003 O OE2 . GLU B 1 279 ? -20.165 59.418 -27.948 1.00 24.61 ? 367 GLU B OE2 1 ATOM 5004 N N . TRP B 1 280 ? -22.954 54.845 -25.080 1.00 9.16 ? 368 TRP B N 1 ATOM 5005 C CA . TRP B 1 280 ? -23.657 53.817 -24.320 1.00 8.85 ? 368 TRP B CA 1 ATOM 5006 C C . TRP B 1 280 ? -24.918 53.308 -25.016 1.00 9.24 ? 368 TRP B C 1 ATOM 5007 O O . TRP B 1 280 ? -25.288 52.149 -24.827 1.00 9.57 ? 368 TRP B O 1 ATOM 5008 C CB . TRP B 1 280 ? -24.047 54.353 -22.944 1.00 9.84 ? 368 TRP B CB 1 ATOM 5009 C CG . TRP B 1 280 ? -24.173 53.325 -21.859 1.00 10.12 ? 368 TRP B CG 1 ATOM 5010 C CD1 . TRP B 1 280 ? -23.998 51.963 -21.969 1.00 11.52 ? 368 TRP B CD1 1 ATOM 5011 C CD2 . TRP B 1 280 ? -24.441 53.574 -20.484 1.00 8.90 ? 368 TRP B CD2 1 ATOM 5012 N NE1 . TRP B 1 280 ? -24.165 51.359 -20.748 1.00 10.58 ? 368 TRP B NE1 1 ATOM 5013 C CE2 . TRP B 1 280 ? -24.428 52.326 -19.817 1.00 8.11 ? 368 TRP B CE2 1 ATOM 5014 C CE3 . TRP B 1 280 ? -24.677 54.747 -19.727 1.00 8.09 ? 368 TRP B CE3 1 ATOM 5015 C CZ2 . TRP B 1 280 ? -24.648 52.199 -18.443 1.00 10.15 ? 368 TRP B CZ2 1 ATOM 5016 C CZ3 . TRP B 1 280 ? -24.898 54.614 -18.339 1.00 8.88 ? 368 TRP B CZ3 1 ATOM 5017 C CH2 . TRP B 1 280 ? -24.879 53.352 -17.721 1.00 7.06 ? 368 TRP B CH2 1 ATOM 5018 N N . GLY B 1 281 ? -25.567 54.157 -25.826 1.00 9.50 ? 369 GLY B N 1 ATOM 5019 C CA . GLY B 1 281 ? -26.780 53.777 -26.551 1.00 8.80 ? 369 GLY B CA 1 ATOM 5020 C C . GLY B 1 281 ? -26.540 52.902 -27.777 1.00 8.31 ? 369 GLY B C 1 ATOM 5021 O O . GLY B 1 281 ? -27.493 52.559 -28.502 1.00 7.61 ? 369 GLY B O 1 ATOM 5022 N N . HIS B 1 282 ? -25.282 52.553 -28.023 1.00 7.08 ? 370 HIS B N 1 ATOM 5023 C CA . HIS B 1 282 ? -24.895 51.702 -29.168 1.00 8.01 ? 370 HIS B CA 1 ATOM 5024 C C . HIS B 1 282 ? -25.013 50.221 -28.794 1.00 7.87 ? 370 HIS B C 1 ATOM 5025 O O . HIS B 1 282 ? -24.071 49.612 -28.262 1.00 8.39 ? 370 HIS B O 1 ATOM 5026 C CB . HIS B 1 282 ? -23.476 52.056 -29.676 1.00 7.14 ? 370 HIS B CB 1 ATOM 5027 C CG . HIS B 1 282 ? -23.360 53.451 -30.221 1.00 10.03 ? 370 HIS B CG 1 ATOM 5028 N ND1 . HIS B 1 282 ? -22.183 53.949 -30.724 1.00 10.97 ? 370 HIS B ND1 1 ATOM 5029 C CD2 . HIS B 1 282 ? -24.278 54.439 -30.367 1.00 8.65 ? 370 HIS B CD2 1 ATOM 5030 C CE1 . HIS B 1 282 ? -22.374 55.191 -31.151 1.00 13.73 ? 370 HIS B CE1 1 ATOM 5031 N NE2 . HIS B 1 282 ? -23.640 55.512 -30.947 1.00 6.70 ? 370 HIS B NE2 1 ATOM 5032 N N . TRP B 1 283 ? -26.184 49.665 -29.080 1.00 6.83 ? 371 TRP B N 1 ATOM 5033 C CA . TRP B 1 283 ? -26.573 48.323 -28.636 1.00 7.23 ? 371 TRP B CA 1 ATOM 5034 C C . TRP B 1 283 ? -26.291 47.231 -29.674 1.00 7.85 ? 371 TRP B C 1 ATOM 5035 O O . TRP B 1 283 ? -26.376 46.049 -29.345 1.00 8.36 ? 371 TRP B O 1 ATOM 5036 C CB . TRP B 1 283 ? -28.082 48.301 -28.281 1.00 6.33 ? 371 TRP B CB 1 ATOM 5037 C CG . TRP B 1 283 ? -28.992 48.890 -29.315 1.00 6.39 ? 371 TRP B CG 1 ATOM 5038 C CD1 . TRP B 1 283 ? -29.477 50.167 -29.331 1.00 8.44 ? 371 TRP B CD1 1 ATOM 5039 C CD2 . TRP B 1 283 ? -29.536 48.253 -30.498 1.00 7.41 ? 371 TRP B CD2 1 ATOM 5040 N NE1 . TRP B 1 283 ? -30.253 50.368 -30.446 1.00 6.45 ? 371 TRP B NE1 1 ATOM 5041 C CE2 . TRP B 1 283 ? -30.288 49.224 -31.192 1.00 7.32 ? 371 TRP B CE2 1 ATOM 5042 C CE3 . TRP B 1 283 ? -29.433 46.992 -31.063 1.00 5.16 ? 371 TRP B CE3 1 ATOM 5043 C CZ2 . TRP B 1 283 ? -30.959 48.943 -32.404 1.00 12.36 ? 371 TRP B CZ2 1 ATOM 5044 C CZ3 . TRP B 1 283 ? -30.082 46.726 -32.295 1.00 7.97 ? 371 TRP B CZ3 1 ATOM 5045 C CH2 . TRP B 1 283 ? -30.842 47.667 -32.922 1.00 8.74 ? 371 TRP B CH2 1 ATOM 5046 N N . CYS B 1 284 ? -26.066 47.603 -30.942 1.00 7.40 ? 372 CYS B N 1 ATOM 5047 C CA . CYS B 1 284 ? -26.081 46.579 -31.999 1.00 7.06 ? 372 CYS B CA 1 ATOM 5048 C C . CYS B 1 284 ? -24.688 46.012 -32.293 1.00 6.77 ? 372 CYS B C 1 ATOM 5049 O O . CYS B 1 284 ? -23.795 46.740 -32.733 1.00 6.74 ? 372 CYS B O 1 ATOM 5050 C CB . CYS B 1 284 ? -26.668 47.134 -33.274 1.00 7.36 ? 372 CYS B CB 1 ATOM 5051 S SG . CYS B 1 284 ? -26.909 45.850 -34.495 1.00 7.24 ? 372 CYS B SG 1 ATOM 5052 N N . ASN B 1 285 ? -24.511 44.717 -32.010 1.00 6.67 ? 373 ASN B N 1 ATOM 5053 C CA . ASN B 1 285 ? -23.308 43.977 -32.382 1.00 6.18 ? 373 ASN B CA 1 ATOM 5054 C C . ASN B 1 285 ? -22.050 44.709 -31.954 1.00 6.97 ? 373 ASN B C 1 ATOM 5055 O O . ASN B 1 285 ? -21.092 44.847 -32.728 1.00 6.82 ? 373 ASN B O 1 ATOM 5056 C CB . ASN B 1 285 ? -23.289 43.657 -33.895 1.00 4.85 ? 373 ASN B CB 1 ATOM 5057 C CG . ASN B 1 285 ? -24.535 42.932 -34.384 1.00 5.55 ? 373 ASN B CG 1 ATOM 5058 O OD1 . ASN B 1 285 ? -24.995 42.003 -33.764 1.00 5.10 ? 373 ASN B OD1 1 ATOM 5059 N ND2 . ASN B 1 285 ? -25.013 43.322 -35.561 1.00 6.42 ? 373 ASN B ND2 1 ATOM 5060 N N . ALA B 1 286 ? -22.025 45.167 -30.711 1.00 6.89 ? 374 ALA B N 1 ATOM 5061 C CA . ALA B 1 286 ? -20.942 46.054 -30.286 1.00 7.21 ? 374 ALA B CA 1 ATOM 5062 C C . ALA B 1 286 ? -19.575 45.342 -30.294 1.00 7.14 ? 374 ALA B C 1 ATOM 5063 O O . ALA B 1 286 ? -19.442 44.216 -29.830 1.00 6.62 ? 374 ALA B O 1 ATOM 5064 C CB . ALA B 1 286 ? -21.227 46.583 -28.911 1.00 7.55 ? 374 ALA B CB 1 ATOM 5065 N N . ILE B 1 287 ? -18.553 46.015 -30.793 1.00 7.55 ? 375 ILE B N 1 ATOM 5066 C CA . ILE B 1 287 ? -17.215 45.447 -30.759 1.00 7.40 ? 375 ILE B CA 1 ATOM 5067 C C . ILE B 1 287 ? -16.646 45.507 -29.336 1.00 7.44 ? 375 ILE B C 1 ATOM 5068 O O . ILE B 1 287 ? -17.175 46.198 -28.476 1.00 6.33 ? 375 ILE B O 1 ATOM 5069 C CB . ILE B 1 287 ? -16.290 46.154 -31.741 1.00 7.10 ? 375 ILE B CB 1 ATOM 5070 C CG1 . ILE B 1 287 ? -16.120 47.638 -31.371 1.00 9.05 ? 375 ILE B CG1 1 ATOM 5071 C CG2 . ILE B 1 287 ? -16.831 45.974 -33.123 1.00 10.00 ? 375 ILE B CG2 1 ATOM 5072 C CD1 . ILE B 1 287 ? -15.199 48.407 -32.330 1.00 10.00 ? 375 ILE B CD1 1 ATOM 5073 N N . GLY B 1 288 ? -15.571 44.760 -29.090 1.00 6.27 ? 376 GLY B N 1 ATOM 5074 C CA . GLY B 1 288 ? -14.893 44.863 -27.814 1.00 6.69 ? 376 GLY B CA 1 ATOM 5075 C C . GLY B 1 288 ? -15.618 44.215 -26.669 1.00 6.82 ? 376 GLY B C 1 ATOM 5076 O O . GLY B 1 288 ? -15.368 44.570 -25.520 1.00 9.02 ? 376 GLY B O 1 ATOM 5077 N N . THR B 1 289 ? -16.450 43.226 -26.951 1.00 6.84 ? 377 THR B N 1 ATOM 5078 C CA . THR B 1 289 ? -17.193 42.506 -25.905 1.00 6.02 ? 377 THR B CA 1 ATOM 5079 C C . THR B 1 289 ? -16.789 41.052 -25.797 1.00 5.64 ? 377 THR B C 1 ATOM 5080 O O . THR B 1 289 ? -16.212 40.480 -26.719 1.00 6.69 ? 377 THR B O 1 ATOM 5081 C CB . THR B 1 289 ? -18.743 42.564 -26.164 1.00 5.69 ? 377 THR B CB 1 ATOM 5082 O OG1 . THR B 1 289 ? -19.066 41.929 -27.423 1.00 6.12 ? 377 THR B OG1 1 ATOM 5083 C CG2 . THR B 1 289 ? -19.217 44.000 -26.295 1.00 8.25 ? 377 THR B CG2 1 ATOM 5084 N N . GLY B 1 290 ? -17.126 40.451 -24.667 1.00 6.01 ? 378 GLY B N 1 ATOM 5085 C CA . GLY B 1 290 ? -16.801 39.062 -24.404 1.00 5.80 ? 378 GLY B CA 1 ATOM 5086 C C . GLY B 1 290 ? -17.868 38.353 -23.619 1.00 5.51 ? 378 GLY B C 1 ATOM 5087 O O . GLY B 1 290 ? -18.634 38.964 -22.904 1.00 6.18 ? 378 GLY B O 1 ATOM 5088 N N . PHE B 1 291 ? -17.888 37.042 -23.714 1.00 5.36 ? 379 PHE B N 1 ATOM 5089 C CA . PHE B 1 291 ? -18.697 36.246 -22.825 1.00 5.80 ? 379 PHE B CA 1 ATOM 5090 C C . PHE B 1 291 ? -18.379 36.618 -21.404 1.00 6.51 ? 379 PHE B C 1 ATOM 5091 O O . PHE B 1 291 ? -17.207 36.734 -21.073 1.00 7.79 ? 379 PHE B O 1 ATOM 5092 C CB . PHE B 1 291 ? -18.394 34.759 -23.063 1.00 6.17 ? 379 PHE B CB 1 ATOM 5093 C CG . PHE B 1 291 ? -18.988 34.201 -24.357 1.00 5.38 ? 379 PHE B CG 1 ATOM 5094 C CD1 . PHE B 1 291 ? -20.331 34.296 -24.586 1.00 7.87 ? 379 PHE B CD1 1 ATOM 5095 C CD2 . PHE B 1 291 ? -18.180 33.616 -25.340 1.00 5.98 ? 379 PHE B CD2 1 ATOM 5096 C CE1 . PHE B 1 291 ? -20.895 33.800 -25.742 1.00 9.37 ? 379 PHE B CE1 1 ATOM 5097 C CE2 . PHE B 1 291 ? -18.700 33.161 -26.520 1.00 6.83 ? 379 PHE B CE2 1 ATOM 5098 C CZ . PHE B 1 291 ? -20.117 33.209 -26.706 1.00 6.75 ? 379 PHE B CZ 1 ATOM 5099 N N . GLY B 1 292 ? -19.393 36.712 -20.543 1.00 7.87 ? 380 GLY B N 1 ATOM 5100 C CA . GLY B 1 292 ? -19.208 37.084 -19.156 1.00 8.30 ? 380 GLY B CA 1 ATOM 5101 C C . GLY B 1 292 ? -19.467 35.986 -18.123 1.00 9.65 ? 380 GLY B C 1 ATOM 5102 O O . GLY B 1 292 ? -19.407 34.787 -18.401 1.00 9.13 ? 380 GLY B O 1 ATOM 5103 N N . MET B 1 293 ? -19.720 36.409 -16.891 1.00 9.92 ? 381 MET B N 1 ATOM 5104 C CA . MET B 1 293 ? -19.854 35.490 -15.765 1.00 10.65 ? 381 MET B CA 1 ATOM 5105 C C . MET B 1 293 ? -20.856 34.414 -16.091 1.00 11.04 ? 381 MET B C 1 ATOM 5106 O O . MET B 1 293 ? -21.921 34.712 -16.645 1.00 8.17 ? 381 MET B O 1 ATOM 5107 C CB . MET B 1 293 ? -20.331 36.259 -14.537 1.00 11.78 ? 381 MET B CB 1 ATOM 5108 C CG . MET B 1 293 ? -19.239 37.011 -13.812 1.00 15.93 ? 381 MET B CG 1 ATOM 5109 S SD . MET B 1 293 ? -19.875 37.762 -12.274 1.00 20.79 ? 381 MET B SD 1 ATOM 5110 C CE . MET B 1 293 ? -21.409 38.347 -12.797 1.00 14.95 ? 381 MET B CE 1 ATOM 5111 N N . ARG B 1 294 ? -20.557 33.160 -15.711 1.00 10.86 ? 382 ARG B N 1 ATOM 5112 C CA . ARG B 1 294 ? -21.508 32.081 -16.015 1.00 11.14 ? 382 ARG B CA 1 ATOM 5113 C C . ARG B 1 294 ? -22.757 32.166 -15.176 1.00 9.80 ? 382 ARG B C 1 ATOM 5114 O O . ARG B 1 294 ? -22.715 32.646 -14.032 1.00 9.98 ? 382 ARG B O 1 ATOM 5115 C CB . ARG B 1 294 ? -20.854 30.728 -15.742 1.00 11.67 ? 382 ARG B CB 1 ATOM 5116 C CG . ARG B 1 294 ? -19.495 30.643 -16.371 1.00 13.16 ? 382 ARG B CG 1 ATOM 5117 C CD . ARG B 1 294 ? -19.529 30.778 -17.888 1.00 13.02 ? 382 ARG B CD 1 ATOM 5118 N NE . ARG B 1 294 ? -18.212 30.461 -18.343 1.00 17.20 ? 382 ARG B NE 1 ATOM 5119 C CZ . ARG B 1 294 ? -17.260 31.280 -18.738 1.00 18.86 ? 382 ARG B CZ 1 ATOM 5120 N NH1 . ARG B 1 294 ? -17.449 32.609 -18.925 1.00 21.51 ? 382 ARG B NH1 1 ATOM 5121 N NH2 . ARG B 1 294 ? -16.064 30.714 -19.027 1.00 18.73 ? 382 ARG B NH2 1 ATOM 5122 N N . PRO B 1 295 ? -23.859 31.626 -15.719 1.00 9.03 ? 383 PRO B N 1 ATOM 5123 C CA . PRO B 1 295 ? -25.130 31.597 -14.971 1.00 9.38 ? 383 PRO B CA 1 ATOM 5124 C C . PRO B 1 295 ? -24.926 30.933 -13.607 1.00 10.02 ? 383 PRO B C 1 ATOM 5125 O O . PRO B 1 295 ? -24.260 29.884 -13.473 1.00 8.57 ? 383 PRO B O 1 ATOM 5126 C CB . PRO B 1 295 ? -26.053 30.818 -15.885 1.00 8.92 ? 383 PRO B CB 1 ATOM 5127 C CG . PRO B 1 295 ? -25.520 31.123 -17.247 1.00 9.28 ? 383 PRO B CG 1 ATOM 5128 C CD . PRO B 1 295 ? -24.020 31.077 -17.068 1.00 9.46 ? 383 PRO B CD 1 ATOM 5129 N N . THR B 1 296 ? -25.447 31.605 -12.597 1.00 10.06 ? 384 THR B N 1 ATOM 5130 C CA . THR B 1 296 ? -25.351 31.148 -11.244 1.00 9.78 ? 384 THR B CA 1 ATOM 5131 C C . THR B 1 296 ? -26.354 31.832 -10.335 1.00 9.95 ? 384 THR B C 1 ATOM 5132 O O . THR B 1 296 ? -26.636 33.001 -10.506 1.00 9.25 ? 384 THR B O 1 ATOM 5133 C CB . THR B 1 296 ? -23.910 31.341 -10.711 1.00 10.69 ? 384 THR B CB 1 ATOM 5134 O OG1 . THR B 1 296 ? -23.851 30.878 -9.365 1.00 10.48 ? 384 THR B OG1 1 ATOM 5135 C CG2 . THR B 1 296 ? -23.528 32.809 -10.622 1.00 10.56 ? 384 THR B CG2 1 ATOM 5136 N N . ALA B 1 297 ? -26.818 31.114 -9.316 1.00 9.61 ? 385 ALA B N 1 ATOM 5137 C CA . ALA B 1 297 ? -27.684 31.655 -8.274 1.00 10.47 ? 385 ALA B CA 1 ATOM 5138 C C . ALA B 1 297 ? -26.851 32.323 -7.183 1.00 11.67 ? 385 ALA B C 1 ATOM 5139 O O . ALA B 1 297 ? -27.382 33.042 -6.335 1.00 11.85 ? 385 ALA B O 1 ATOM 5140 C CB . ALA B 1 297 ? -28.527 30.547 -7.678 1.00 10.62 ? 385 ALA B CB 1 ATOM 5141 N N . ASN B 1 298 ? -25.541 32.100 -7.225 1.00 11.77 ? 386 ASN B N 1 ATOM 5142 C CA . ASN B 1 298 ? -24.633 32.600 -6.180 1.00 13.12 ? 386 ASN B CA 1 ATOM 5143 C C . ASN B 1 298 ? -24.146 34.008 -6.506 1.00 13.18 ? 386 ASN B C 1 ATOM 5144 O O . ASN B 1 298 ? -23.007 34.217 -6.919 1.00 14.01 ? 386 ASN B O 1 ATOM 5145 C CB . ASN B 1 298 ? -23.469 31.626 -6.024 1.00 13.60 ? 386 ASN B CB 1 ATOM 5146 C CG . ASN B 1 298 ? -22.583 31.957 -4.853 1.00 17.60 ? 386 ASN B CG 1 ATOM 5147 O OD1 . ASN B 1 298 ? -22.995 32.673 -3.930 1.00 18.92 ? 386 ASN B OD1 1 ATOM 5148 N ND2 . ASN B 1 298 ? -21.344 31.421 -4.869 1.00 21.29 ? 386 ASN B ND2 1 ATOM 5149 N N . THR B 1 299 ? -25.024 34.989 -6.297 1.00 12.92 ? 387 THR B N 1 ATOM 5150 C CA . THR B 1 299 ? -24.779 36.352 -6.773 1.00 12.27 ? 387 THR B CA 1 ATOM 5151 C C . THR B 1 299 ? -24.099 37.231 -5.744 1.00 12.55 ? 387 THR B C 1 ATOM 5152 O O . THR B 1 299 ? -23.602 38.288 -6.096 1.00 12.83 ? 387 THR B O 1 ATOM 5153 C CB . THR B 1 299 ? -26.081 37.026 -7.135 1.00 12.62 ? 387 THR B CB 1 ATOM 5154 O OG1 . THR B 1 299 ? -26.914 37.049 -5.971 1.00 10.63 ? 387 THR B OG1 1 ATOM 5155 C CG2 . THR B 1 299 ? -26.846 36.234 -8.227 1.00 11.43 ? 387 THR B CG2 1 ATOM 5156 N N . GLY B 1 300 ? -24.092 36.797 -4.478 1.00 11.83 ? 388 GLY B N 1 ATOM 5157 C CA . GLY B 1 300 ? -23.623 37.620 -3.379 1.00 11.85 ? 388 GLY B CA 1 ATOM 5158 C C . GLY B 1 300 ? -24.453 38.878 -3.117 1.00 11.73 ? 388 GLY B C 1 ATOM 5159 O O . GLY B 1 300 ? -24.012 39.763 -2.369 1.00 11.09 ? 388 GLY B O 1 ATOM 5160 N N . HIS B 1 301 ? -25.648 38.970 -3.708 1.00 9.48 ? 389 HIS B N 1 ATOM 5161 C CA . HIS B 1 301 ? -26.481 40.135 -3.528 1.00 9.21 ? 389 HIS B CA 1 ATOM 5162 C C . HIS B 1 301 ? -27.927 39.760 -3.196 1.00 9.18 ? 389 HIS B C 1 ATOM 5163 O O . HIS B 1 301 ? -28.571 39.014 -3.952 1.00 8.06 ? 389 HIS B O 1 ATOM 5164 C CB . HIS B 1 301 ? -26.481 40.986 -4.784 1.00 9.20 ? 389 HIS B CB 1 ATOM 5165 C CG . HIS B 1 301 ? -26.841 42.404 -4.523 1.00 10.37 ? 389 HIS B CG 1 ATOM 5166 N ND1 . HIS B 1 301 ? -28.117 42.788 -4.178 1.00 13.29 ? 389 HIS B ND1 1 ATOM 5167 C CD2 . HIS B 1 301 ? -26.082 43.525 -4.497 1.00 10.72 ? 389 HIS B CD2 1 ATOM 5168 C CE1 . HIS B 1 301 ? -28.129 44.093 -3.971 1.00 15.59 ? 389 HIS B CE1 1 ATOM 5169 N NE2 . HIS B 1 301 ? -26.909 44.562 -4.162 1.00 11.94 ? 389 HIS B NE2 1 ATOM 5170 N N . GLN B 1 302 ? -28.414 40.309 -2.081 0.50 7.12 ? 390 GLN B N 1 ATOM 5171 C CA . GLN B 1 302 ? -29.744 40.049 -1.565 0.50 7.24 ? 390 GLN B CA 1 ATOM 5172 C C . GLN B 1 302 ? -30.873 40.245 -2.586 0.50 6.88 ? 390 GLN B C 1 ATOM 5173 O O . GLN B 1 302 ? -31.874 39.565 -2.553 0.50 5.16 ? 390 GLN B O 1 ATOM 5174 C CB A GLN B 1 302 ? -29.924 41.038 -0.402 0.50 7.91 ? 390 GLN B CB 1 ATOM 5175 C CB B GLN B 1 302 ? -30.036 40.856 -0.305 0.50 7.68 ? 390 GLN B CB 1 ATOM 5176 C CG A GLN B 1 302 ? -29.298 42.454 -0.695 0.50 9.06 ? 390 GLN B CG 1 ATOM 5177 C CG B GLN B 1 302 ? -30.168 42.317 -0.545 0.50 7.89 ? 390 GLN B CG 1 ATOM 5178 C CD A GLN B 1 302 ? -27.815 42.668 -0.244 0.50 10.53 ? 390 GLN B CD 1 ATOM 5179 C CD B GLN B 1 302 ? -30.292 43.098 0.733 0.50 8.94 ? 390 GLN B CD 1 ATOM 5180 O OE1 A GLN B 1 302 ? -26.954 41.807 -0.424 0.50 5.82 ? 390 GLN B OE1 1 ATOM 5181 O OE1 B GLN B 1 302 ? -31.021 42.693 1.641 0.50 7.88 ? 390 GLN B OE1 1 ATOM 5182 N NE2 A GLN B 1 302 ? -27.546 43.851 0.363 0.50 12.60 ? 390 GLN B NE2 1 ATOM 5183 N NE2 B GLN B 1 302 ? -29.600 44.236 0.802 0.50 9.09 ? 390 GLN B NE2 1 ATOM 5184 N N . TYR B 1 303 ? -30.702 41.175 -3.503 1.00 8.31 ? 391 TYR B N 1 ATOM 5185 C CA . TYR B 1 303 ? -31.767 41.509 -4.482 1.00 8.61 ? 391 TYR B CA 1 ATOM 5186 C C . TYR B 1 303 ? -31.697 40.790 -5.817 1.00 8.83 ? 391 TYR B C 1 ATOM 5187 O O . TYR B 1 303 ? -32.610 40.931 -6.649 1.00 8.62 ? 391 TYR B O 1 ATOM 5188 C CB . TYR B 1 303 ? -31.778 43.003 -4.748 1.00 9.37 ? 391 TYR B CB 1 ATOM 5189 C CG . TYR B 1 303 ? -32.112 43.871 -3.553 1.00 11.41 ? 391 TYR B CG 1 ATOM 5190 C CD1 . TYR B 1 303 ? -32.920 43.409 -2.509 1.00 13.97 ? 391 TYR B CD1 1 ATOM 5191 C CD2 . TYR B 1 303 ? -31.643 45.168 -3.500 1.00 14.59 ? 391 TYR B CD2 1 ATOM 5192 C CE1 . TYR B 1 303 ? -33.232 44.228 -1.422 1.00 14.50 ? 391 TYR B CE1 1 ATOM 5193 C CE2 . TYR B 1 303 ? -31.946 45.996 -2.421 1.00 14.25 ? 391 TYR B CE2 1 ATOM 5194 C CZ . TYR B 1 303 ? -32.720 45.503 -1.384 1.00 15.26 ? 391 TYR B CZ 1 ATOM 5195 O OH . TYR B 1 303 ? -33.031 46.323 -0.334 1.00 16.29 ? 391 TYR B OH 1 ATOM 5196 N N . VAL B 1 304 ? -30.641 40.019 -6.017 1.00 8.43 ? 392 VAL B N 1 ATOM 5197 C CA . VAL B 1 304 ? -30.368 39.390 -7.300 1.00 8.53 ? 392 VAL B CA 1 ATOM 5198 C C . VAL B 1 304 ? -30.421 37.891 -7.153 1.00 8.06 ? 392 VAL B C 1 ATOM 5199 O O . VAL B 1 304 ? -29.552 37.244 -6.505 1.00 6.48 ? 392 VAL B O 1 ATOM 5200 C CB . VAL B 1 304 ? -29.000 39.804 -7.877 1.00 8.34 ? 392 VAL B CB 1 ATOM 5201 C CG1 . VAL B 1 304 ? -28.843 39.272 -9.279 1.00 8.86 ? 392 VAL B CG1 1 ATOM 5202 C CG2 . VAL B 1 304 ? -28.881 41.308 -7.909 1.00 10.15 ? 392 VAL B CG2 1 ATOM 5203 N N . ASP B 1 305 ? -31.471 37.334 -7.728 1.00 7.75 ? 393 ASP B N 1 ATOM 5204 C CA . ASP B 1 305 ? -31.647 35.888 -7.719 1.00 7.37 ? 393 ASP B CA 1 ATOM 5205 C C . ASP B 1 305 ? -30.596 35.143 -8.526 1.00 7.60 ? 393 ASP B C 1 ATOM 5206 O O . ASP B 1 305 ? -30.229 34.024 -8.169 1.00 9.10 ? 393 ASP B O 1 ATOM 5207 C CB . ASP B 1 305 ? -32.986 35.496 -8.304 1.00 7.10 ? 393 ASP B CB 1 ATOM 5208 C CG . ASP B 1 305 ? -34.137 35.803 -7.413 1.00 7.26 ? 393 ASP B CG 1 ATOM 5209 O OD1 . ASP B 1 305 ? -33.976 35.970 -6.178 1.00 9.76 ? 393 ASP B OD1 1 ATOM 5210 O OD2 . ASP B 1 305 ? -35.292 35.852 -7.904 1.00 8.27 ? 393 ASP B OD2 1 ATOM 5211 N N . ALA B 1 306 ? -30.147 35.718 -9.637 1.00 7.42 ? 394 ALA B N 1 ATOM 5212 C CA . ALA B 1 306 ? -29.187 35.003 -10.501 1.00 6.92 ? 394 ALA B CA 1 ATOM 5213 C C . ALA B 1 306 ? -28.518 35.902 -11.483 1.00 6.59 ? 394 ALA B C 1 ATOM 5214 O O . ALA B 1 306 ? -29.081 36.886 -11.909 1.00 5.50 ? 394 ALA B O 1 ATOM 5215 C CB . ALA B 1 306 ? -29.879 33.885 -11.251 1.00 7.20 ? 394 ALA B CB 1 ATOM 5216 N N . PHE B 1 307 ? -27.273 35.585 -11.801 1.00 6.22 ? 395 PHE B N 1 ATOM 5217 C CA . PHE B 1 307 ? -26.698 36.031 -13.044 1.00 6.00 ? 395 PHE B CA 1 ATOM 5218 C C . PHE B 1 307 ? -27.055 35.007 -14.113 1.00 6.29 ? 395 PHE B C 1 ATOM 5219 O O . PHE B 1 307 ? -26.941 33.777 -13.871 1.00 7.50 ? 395 PHE B O 1 ATOM 5220 C CB . PHE B 1 307 ? -25.206 36.128 -12.894 1.00 5.25 ? 395 PHE B CB 1 ATOM 5221 C CG . PHE B 1 307 ? -24.782 37.113 -11.849 1.00 6.43 ? 395 PHE B CG 1 ATOM 5222 C CD1 . PHE B 1 307 ? -25.235 38.412 -11.892 1.00 9.35 ? 395 PHE B CD1 1 ATOM 5223 C CD2 . PHE B 1 307 ? -23.917 36.744 -10.852 1.00 8.68 ? 395 PHE B CD2 1 ATOM 5224 C CE1 . PHE B 1 307 ? -24.829 39.323 -10.906 1.00 9.35 ? 395 PHE B CE1 1 ATOM 5225 C CE2 . PHE B 1 307 ? -23.492 37.630 -9.902 1.00 10.84 ? 395 PHE B CE2 1 ATOM 5226 C CZ . PHE B 1 307 ? -23.950 38.935 -9.923 1.00 10.90 ? 395 PHE B CZ 1 ATOM 5227 N N . VAL B 1 308 ? -27.456 35.502 -15.270 1.00 5.99 ? 396 VAL B N 1 ATOM 5228 C CA . VAL B 1 308 ? -27.914 34.644 -16.362 1.00 7.06 ? 396 VAL B CA 1 ATOM 5229 C C . VAL B 1 308 ? -27.376 35.034 -17.728 1.00 7.64 ? 396 VAL B C 1 ATOM 5230 O O . VAL B 1 308 ? -26.785 36.103 -17.881 1.00 7.38 ? 396 VAL B O 1 ATOM 5231 C CB . VAL B 1 308 ? -29.445 34.661 -16.454 1.00 7.09 ? 396 VAL B CB 1 ATOM 5232 C CG1 . VAL B 1 308 ? -30.088 33.904 -15.270 1.00 11.27 ? 396 VAL B CG1 1 ATOM 5233 C CG2 . VAL B 1 308 ? -29.994 36.090 -16.504 1.00 10.30 ? 396 VAL B CG2 1 ATOM 5234 N N . TRP B 1 309 ? -27.576 34.156 -18.720 1.00 6.87 ? 397 TRP B N 1 ATOM 5235 C CA . TRP B 1 309 ? -27.282 34.487 -20.121 1.00 6.92 ? 397 TRP B CA 1 ATOM 5236 C C . TRP B 1 309 ? -28.640 34.453 -20.811 1.00 7.05 ? 397 TRP B C 1 ATOM 5237 O O . TRP B 1 309 ? -29.142 33.393 -21.090 1.00 7.94 ? 397 TRP B O 1 ATOM 5238 C CB . TRP B 1 309 ? -26.344 33.486 -20.764 1.00 7.27 ? 397 TRP B CB 1 ATOM 5239 C CG . TRP B 1 309 ? -24.895 33.643 -20.367 1.00 6.98 ? 397 TRP B CG 1 ATOM 5240 C CD1 . TRP B 1 309 ? -24.374 34.288 -19.272 1.00 9.37 ? 397 TRP B CD1 1 ATOM 5241 C CD2 . TRP B 1 309 ? -23.770 33.069 -21.049 1.00 5.81 ? 397 TRP B CD2 1 ATOM 5242 N NE1 . TRP B 1 309 ? -23.001 34.169 -19.273 1.00 9.15 ? 397 TRP B NE1 1 ATOM 5243 C CE2 . TRP B 1 309 ? -22.617 33.458 -20.372 1.00 6.86 ? 397 TRP B CE2 1 ATOM 5244 C CE3 . TRP B 1 309 ? -23.637 32.331 -22.231 1.00 7.01 ? 397 TRP B CE3 1 ATOM 5245 C CZ2 . TRP B 1 309 ? -21.326 33.042 -20.799 1.00 5.98 ? 397 TRP B CZ2 1 ATOM 5246 C CZ3 . TRP B 1 309 ? -22.386 31.972 -22.663 1.00 6.95 ? 397 TRP B CZ3 1 ATOM 5247 C CH2 . TRP B 1 309 ? -21.278 32.328 -21.961 1.00 5.52 ? 397 TRP B CH2 1 ATOM 5248 N N . VAL B 1 310 ? -29.221 35.630 -21.057 1.00 7.70 ? 398 VAL B N 1 ATOM 5249 C CA . VAL B 1 310 ? -30.542 35.745 -21.698 1.00 7.27 ? 398 VAL B CA 1 ATOM 5250 C C . VAL B 1 310 ? -30.327 35.792 -23.214 1.00 7.26 ? 398 VAL B C 1 ATOM 5251 O O . VAL B 1 310 ? -30.780 34.873 -23.925 1.00 7.23 ? 398 VAL B O 1 ATOM 5252 C CB . VAL B 1 310 ? -31.372 36.891 -21.182 1.00 6.10 ? 398 VAL B CB 1 ATOM 5253 C CG1 . VAL B 1 310 ? -32.748 36.767 -21.713 1.00 6.80 ? 398 VAL B CG1 1 ATOM 5254 C CG2 . VAL B 1 310 ? -31.381 36.895 -19.645 1.00 10.06 ? 398 VAL B CG2 1 ATOM 5255 N N . LYS B 1 311 ? -29.583 36.802 -23.716 1.00 7.00 ? 399 LYS B N 1 ATOM 5256 C CA . LYS B 1 311 ? -29.265 36.883 -25.151 1.00 6.52 ? 399 LYS B CA 1 ATOM 5257 C C . LYS B 1 311 ? -28.152 35.888 -25.420 1.00 8.30 ? 399 LYS B C 1 ATOM 5258 O O . LYS B 1 311 ? -27.146 35.971 -24.754 1.00 7.85 ? 399 LYS B O 1 ATOM 5259 C CB . LYS B 1 311 ? -28.782 38.291 -25.512 1.00 6.78 ? 399 LYS B CB 1 ATOM 5260 C CG . LYS B 1 311 ? -28.222 38.467 -26.866 1.00 6.91 ? 399 LYS B CG 1 ATOM 5261 C CD . LYS B 1 311 ? -29.210 38.335 -27.947 1.00 8.72 ? 399 LYS B CD 1 ATOM 5262 C CE . LYS B 1 311 ? -28.564 38.409 -29.291 1.00 8.17 ? 399 LYS B CE 1 ATOM 5263 N NZ . LYS B 1 311 ? -29.534 38.523 -30.377 1.00 7.73 ? 399 LYS B NZ 1 ATOM 5264 N N . PRO B 1 312 ? -28.335 34.946 -26.334 1.00 8.43 ? 400 PRO B N 1 ATOM 5265 C CA . PRO B 1 312 ? -27.290 33.943 -26.585 1.00 8.04 ? 400 PRO B CA 1 ATOM 5266 C C . PRO B 1 312 ? -26.223 34.525 -27.493 1.00 8.18 ? 400 PRO B C 1 ATOM 5267 O O . PRO B 1 312 ? -26.452 34.792 -28.632 1.00 8.21 ? 400 PRO B O 1 ATOM 5268 C CB . PRO B 1 312 ? -28.048 32.794 -27.238 1.00 8.73 ? 400 PRO B CB 1 ATOM 5269 C CG . PRO B 1 312 ? -29.476 33.106 -27.022 1.00 8.88 ? 400 PRO B CG 1 ATOM 5270 C CD . PRO B 1 312 ? -29.555 34.604 -27.048 1.00 7.72 ? 400 PRO B CD 1 ATOM 5271 N N . GLY B 1 313 ? -25.034 34.724 -26.948 1.00 7.76 ? 401 GLY B N 1 ATOM 5272 C CA . GLY B 1 313 ? -23.964 35.377 -27.702 1.00 7.44 ? 401 GLY B CA 1 ATOM 5273 C C . GLY B 1 313 ? -23.620 34.625 -28.961 1.00 7.22 ? 401 GLY B C 1 ATOM 5274 O O . GLY B 1 313 ? -23.380 33.417 -28.925 1.00 7.80 ? 401 GLY B O 1 ATOM 5275 N N . GLY B 1 314 ? -23.537 35.336 -30.088 1.00 6.97 ? 402 GLY B N 1 ATOM 5276 C CA . GLY B 1 314 ? -23.337 34.717 -31.382 1.00 6.54 ? 402 GLY B CA 1 ATOM 5277 C C . GLY B 1 314 ? -24.535 34.915 -32.293 1.00 6.67 ? 402 GLY B C 1 ATOM 5278 O O . GLY B 1 314 ? -24.451 34.989 -33.531 1.00 6.91 ? 402 GLY B O 1 ATOM 5279 N N . GLU B 1 315 ? -25.692 35.013 -31.676 1.00 6.43 ? 403 GLU B N 1 ATOM 5280 C CA . GLU B 1 315 ? -26.909 35.348 -32.427 1.00 5.51 ? 403 GLU B CA 1 ATOM 5281 C C . GLU B 1 315 ? -26.974 36.853 -32.624 1.00 5.55 ? 403 GLU B C 1 ATOM 5282 O O . GLU B 1 315 ? -26.895 37.623 -31.663 1.00 7.73 ? 403 GLU B O 1 ATOM 5283 C CB . GLU B 1 315 ? -28.143 34.843 -31.654 1.00 5.56 ? 403 GLU B CB 1 ATOM 5284 C CG . GLU B 1 315 ? -28.174 33.330 -31.585 1.00 7.76 ? 403 GLU B CG 1 ATOM 5285 C CD . GLU B 1 315 ? -29.358 32.691 -30.872 1.00 9.12 ? 403 GLU B CD 1 ATOM 5286 O OE1 . GLU B 1 315 ? -30.370 33.354 -30.575 1.00 9.04 ? 403 GLU B OE1 1 ATOM 5287 O OE2 . GLU B 1 315 ? -29.305 31.445 -30.627 1.00 9.38 ? 403 GLU B OE2 1 ATOM 5288 N N . CYS B 1 316 ? -27.059 37.263 -33.868 1.00 5.75 ? 404 CYS B N 1 ATOM 5289 C CA . CYS B 1 316 ? -27.000 38.649 -34.277 1.00 6.03 ? 404 CYS B CA 1 ATOM 5290 C C . CYS B 1 316 ? -28.048 39.564 -33.591 1.00 5.50 ? 404 CYS B C 1 ATOM 5291 O O . CYS B 1 316 ? -29.140 39.114 -33.239 1.00 6.12 ? 404 CYS B O 1 ATOM 5292 C CB . CYS B 1 316 ? -27.202 38.745 -35.790 1.00 5.28 ? 404 CYS B CB 1 ATOM 5293 S SG . CYS B 1 316 ? -26.474 40.251 -36.456 1.00 8.34 ? 404 CYS B SG 1 ATOM 5294 N N . ASP B 1 317 ? -27.689 40.819 -33.425 1.00 6.80 ? 405 ASP B N 1 ATOM 5295 C CA . ASP B 1 317 ? -28.619 41.860 -32.953 1.00 5.90 ? 405 ASP B CA 1 ATOM 5296 C C . ASP B 1 317 ? -29.351 42.570 -34.095 1.00 7.01 ? 405 ASP B C 1 ATOM 5297 O O . ASP B 1 317 ? -30.366 43.274 -33.865 1.00 6.79 ? 405 ASP B O 1 ATOM 5298 C CB . ASP B 1 317 ? -27.899 42.920 -32.185 1.00 6.09 ? 405 ASP B CB 1 ATOM 5299 C CG . ASP B 1 317 ? -27.214 42.394 -30.988 1.00 8.22 ? 405 ASP B CG 1 ATOM 5300 O OD1 . ASP B 1 317 ? -27.853 41.575 -30.268 1.00 9.70 ? 405 ASP B OD1 1 ATOM 5301 O OD2 . ASP B 1 317 ? -26.086 42.782 -30.639 1.00 7.16 ? 405 ASP B OD2 1 ATOM 5302 N N . GLY B 1 318 ? -28.840 42.440 -35.308 1.00 5.92 ? 406 GLY B N 1 ATOM 5303 C CA . GLY B 1 318 ? -29.350 43.211 -36.435 1.00 6.89 ? 406 GLY B CA 1 ATOM 5304 C C . GLY B 1 318 ? -28.470 43.229 -37.649 1.00 6.25 ? 406 GLY B C 1 ATOM 5305 O O . GLY B 1 318 ? -27.228 43.189 -37.581 1.00 7.17 ? 406 GLY B O 1 ATOM 5306 N N . THR B 1 319 ? -29.106 43.285 -38.812 1.00 7.51 ? 407 THR B N 1 ATOM 5307 C CA . THR B 1 319 ? -28.368 43.303 -40.062 1.00 7.28 ? 407 THR B CA 1 ATOM 5308 C C . THR B 1 319 ? -27.680 44.653 -40.319 1.00 7.70 ? 407 THR B C 1 ATOM 5309 O O . THR B 1 319 ? -28.186 45.716 -39.950 1.00 7.03 ? 407 THR B O 1 ATOM 5310 C CB . THR B 1 319 ? -29.280 42.904 -41.244 1.00 8.06 ? 407 THR B CB 1 ATOM 5311 O OG1 . THR B 1 319 ? -28.534 42.929 -42.452 1.00 7.24 ? 407 THR B OG1 1 ATOM 5312 C CG2 . THR B 1 319 ? -30.394 43.915 -41.478 1.00 8.54 ? 407 THR B CG2 1 ATOM 5313 N N . SER B 1 320 ? -26.497 44.579 -40.920 1.00 7.23 ? 408 SER B N 1 ATOM 5314 C CA . SER B 1 320 ? -25.749 45.745 -41.323 1.00 7.60 ? 408 SER B CA 1 ATOM 5315 C C . SER B 1 320 ? -25.957 46.084 -42.810 1.00 7.80 ? 408 SER B C 1 ATOM 5316 O O . SER B 1 320 ? -25.347 47.024 -43.338 1.00 7.96 ? 408 SER B O 1 ATOM 5317 C CB . SER B 1 320 ? -24.262 45.507 -41.033 1.00 8.12 ? 408 SER B CB 1 ATOM 5318 O OG . SER B 1 320 ? -23.731 44.514 -41.902 1.00 7.82 ? 408 SER B OG 1 ATOM 5319 N N . ASP B 1 321 ? -26.773 45.288 -43.484 1.00 8.38 ? 409 ASP B N 1 ATOM 5320 C CA . ASP B 1 321 ? -27.192 45.535 -44.874 1.00 8.62 ? 409 ASP B CA 1 ATOM 5321 C C . ASP B 1 321 ? -28.155 46.723 -44.969 1.00 8.37 ? 409 ASP B C 1 ATOM 5322 O O . ASP B 1 321 ? -29.346 46.596 -44.655 1.00 8.42 ? 409 ASP B O 1 ATOM 5323 C CB . ASP B 1 321 ? -27.885 44.272 -45.420 1.00 8.51 ? 409 ASP B CB 1 ATOM 5324 C CG . ASP B 1 321 ? -28.214 44.342 -46.912 1.00 11.23 ? 409 ASP B CG 1 ATOM 5325 O OD1 . ASP B 1 321 ? -27.953 45.377 -47.541 1.00 11.48 ? 409 ASP B OD1 1 ATOM 5326 O OD2 . ASP B 1 321 ? -28.798 43.396 -47.539 1.00 11.95 ? 409 ASP B OD2 1 ATOM 5327 N N . THR B 1 322 ? -27.674 47.855 -45.475 1.00 9.25 ? 410 THR B N 1 ATOM 5328 C CA . THR B 1 322 ? -28.530 49.063 -45.609 1.00 9.06 ? 410 THR B CA 1 ATOM 5329 C C . THR B 1 322 ? -29.737 48.925 -46.549 1.00 10.16 ? 410 THR B C 1 ATOM 5330 O O . THR B 1 322 ? -30.676 49.711 -46.469 1.00 10.70 ? 410 THR B O 1 ATOM 5331 C CB . THR B 1 322 ? -27.723 50.276 -46.013 1.00 10.03 ? 410 THR B CB 1 ATOM 5332 O OG1 . THR B 1 322 ? -27.165 50.053 -47.301 1.00 9.44 ? 410 THR B OG1 1 ATOM 5333 C CG2 . THR B 1 322 ? -26.504 50.478 -45.074 1.00 9.76 ? 410 THR B CG2 1 ATOM 5334 N N . THR B 1 323 ? -29.751 47.906 -47.398 1.00 8.84 ? 411 THR B N 1 ATOM 5335 C CA . THR B 1 323 ? -30.905 47.682 -48.271 1.00 10.00 ? 411 THR B CA 1 ATOM 5336 C C . THR B 1 323 ? -32.007 46.833 -47.629 1.00 9.98 ? 411 THR B C 1 ATOM 5337 O O . THR B 1 323 ? -33.116 46.731 -48.190 1.00 9.52 ? 411 THR B O 1 ATOM 5338 C CB . THR B 1 323 ? -30.474 47.019 -49.598 1.00 9.55 ? 411 THR B CB 1 ATOM 5339 O OG1 . THR B 1 323 ? -30.016 45.679 -49.354 1.00 11.97 ? 411 THR B OG1 1 ATOM 5340 C CG2 . THR B 1 323 ? -29.306 47.703 -50.192 1.00 10.46 ? 411 THR B CG2 1 ATOM 5341 N N . ALA B 1 324 ? -31.721 46.218 -46.481 1.00 8.64 ? 412 ALA B N 1 ATOM 5342 C CA . ALA B 1 324 ? -32.673 45.291 -45.843 1.00 9.34 ? 412 ALA B CA 1 ATOM 5343 C C . ALA B 1 324 ? -33.832 46.032 -45.201 1.00 9.07 ? 412 ALA B C 1 ATOM 5344 O O . ALA B 1 324 ? -33.613 47.106 -44.650 1.00 8.55 ? 412 ALA B O 1 ATOM 5345 C CB . ALA B 1 324 ? -31.967 44.436 -44.757 1.00 7.89 ? 412 ALA B CB 1 ATOM 5346 N N . ALA B 1 325 ? -35.030 45.427 -45.218 1.00 9.56 ? 413 ALA B N 1 ATOM 5347 C CA . ALA B 1 325 ? -36.184 45.993 -44.549 1.00 8.93 ? 413 ALA B CA 1 ATOM 5348 C C . ALA B 1 325 ? -35.922 46.327 -43.082 1.00 8.83 ? 413 ALA B C 1 ATOM 5349 O O . ALA B 1 325 ? -36.359 47.368 -42.611 1.00 8.54 ? 413 ALA B O 1 ATOM 5350 C CB . ALA B 1 325 ? -37.397 45.065 -44.689 1.00 10.70 ? 413 ALA B CB 1 ATOM 5351 N N . ARG B 1 326 ? -35.187 45.472 -42.364 1.00 7.89 ? 414 ARG B N 1 ATOM 5352 C CA . ARG B 1 326 ? -34.957 45.655 -40.929 1.00 7.28 ? 414 ARG B CA 1 ATOM 5353 C C . ARG B 1 326 ? -33.646 46.346 -40.599 1.00 6.84 ? 414 ARG B C 1 ATOM 5354 O O . ARG B 1 326 ? -33.160 46.220 -39.465 1.00 8.18 ? 414 ARG B O 1 ATOM 5355 C CB . ARG B 1 326 ? -34.997 44.307 -40.186 1.00 6.53 ? 414 ARG B CB 1 ATOM 5356 C CG . ARG B 1 326 ? -36.332 43.595 -40.376 1.00 7.82 ? 414 ARG B CG 1 ATOM 5357 C CD . ARG B 1 326 ? -36.727 42.596 -39.273 1.00 9.95 ? 414 ARG B CD 1 ATOM 5358 N NE . ARG B 1 326 ? -35.746 41.505 -39.180 1.00 9.42 ? 414 ARG B NE 1 ATOM 5359 C CZ . ARG B 1 326 ? -35.646 40.639 -38.181 1.00 9.59 ? 414 ARG B CZ 1 ATOM 5360 N NH1 . ARG B 1 326 ? -36.469 40.645 -37.147 1.00 9.82 ? 414 ARG B NH1 1 ATOM 5361 N NH2 . ARG B 1 326 ? -34.667 39.747 -38.215 1.00 10.07 ? 414 ARG B NH2 1 ATOM 5362 N N . TYR B 1 327 ? -33.035 47.023 -41.561 1.00 7.58 ? 415 TYR B N 1 ATOM 5363 C CA . TYR B 1 327 ? -31.798 47.729 -41.278 1.00 6.67 ? 415 TYR B CA 1 ATOM 5364 C C . TYR B 1 327 ? -32.087 48.842 -40.279 1.00 7.16 ? 415 TYR B C 1 ATOM 5365 O O . TYR B 1 327 ? -32.986 49.687 -40.498 1.00 7.36 ? 415 TYR B O 1 ATOM 5366 C CB . TYR B 1 327 ? -31.227 48.366 -42.527 1.00 6.66 ? 415 TYR B CB 1 ATOM 5367 C CG . TYR B 1 327 ? -30.015 49.198 -42.195 1.00 5.14 ? 415 TYR B CG 1 ATOM 5368 C CD1 . TYR B 1 327 ? -28.861 48.597 -41.757 1.00 5.04 ? 415 TYR B CD1 1 ATOM 5369 C CD2 . TYR B 1 327 ? -30.054 50.583 -42.231 1.00 5.43 ? 415 TYR B CD2 1 ATOM 5370 C CE1 . TYR B 1 327 ? -27.719 49.346 -41.442 1.00 6.90 ? 415 TYR B CE1 1 ATOM 5371 C CE2 . TYR B 1 327 ? -28.916 51.338 -41.940 1.00 9.98 ? 415 TYR B CE2 1 ATOM 5372 C CZ . TYR B 1 327 ? -27.768 50.713 -41.515 1.00 9.14 ? 415 TYR B CZ 1 ATOM 5373 O OH . TYR B 1 327 ? -26.630 51.448 -41.181 1.00 10.92 ? 415 TYR B OH 1 ATOM 5374 N N . ASP B 1 328 ? -31.279 48.885 -39.230 1.00 6.91 ? 416 ASP B N 1 ATOM 5375 C CA . ASP B 1 328 ? -31.331 49.931 -38.212 1.00 6.93 ? 416 ASP B CA 1 ATOM 5376 C C . ASP B 1 328 ? -29.969 50.606 -38.230 1.00 7.22 ? 416 ASP B C 1 ATOM 5377 O O . ASP B 1 328 ? -28.943 49.926 -38.284 1.00 6.81 ? 416 ASP B O 1 ATOM 5378 C CB . ASP B 1 328 ? -31.635 49.323 -36.856 1.00 7.70 ? 416 ASP B CB 1 ATOM 5379 C CG . ASP B 1 328 ? -31.894 50.393 -35.785 1.00 8.64 ? 416 ASP B CG 1 ATOM 5380 O OD1 . ASP B 1 328 ? -30.914 51.055 -35.332 1.00 8.00 ? 416 ASP B OD1 1 ATOM 5381 O OD2 . ASP B 1 328 ? -33.058 50.617 -35.385 1.00 10.23 ? 416 ASP B OD2 1 ATOM 5382 N N . TYR B 1 329 ? -29.927 51.940 -38.214 1.00 6.69 ? 417 TYR B N 1 ATOM 5383 C CA . TYR B 1 329 ? -28.633 52.619 -38.277 1.00 6.76 ? 417 TYR B CA 1 ATOM 5384 C C . TYR B 1 329 ? -27.664 52.233 -37.166 1.00 6.04 ? 417 TYR B C 1 ATOM 5385 O O . TYR B 1 329 ? -26.456 52.338 -37.364 1.00 5.45 ? 417 TYR B O 1 ATOM 5386 C CB . TYR B 1 329 ? -28.780 54.138 -38.262 1.00 6.88 ? 417 TYR B CB 1 ATOM 5387 C CG . TYR B 1 329 ? -29.068 54.744 -36.915 1.00 8.27 ? 417 TYR B CG 1 ATOM 5388 C CD1 . TYR B 1 329 ? -30.357 54.813 -36.441 1.00 9.80 ? 417 TYR B CD1 1 ATOM 5389 C CD2 . TYR B 1 329 ? -28.064 55.335 -36.163 1.00 11.99 ? 417 TYR B CD2 1 ATOM 5390 C CE1 . TYR B 1 329 ? -30.638 55.388 -35.211 1.00 12.07 ? 417 TYR B CE1 1 ATOM 5391 C CE2 . TYR B 1 329 ? -28.345 55.931 -34.932 1.00 11.37 ? 417 TYR B CE2 1 ATOM 5392 C CZ . TYR B 1 329 ? -29.613 55.976 -34.487 1.00 15.47 ? 417 TYR B CZ 1 ATOM 5393 O OH . TYR B 1 329 ? -29.936 56.548 -33.271 1.00 21.09 ? 417 TYR B OH 1 ATOM 5394 N N . HIS B 1 330 ? -28.150 51.794 -36.016 1.00 6.80 ? 418 HIS B N 1 ATOM 5395 C CA . HIS B 1 330 ? -27.231 51.367 -34.941 1.00 7.20 ? 418 HIS B CA 1 ATOM 5396 C C . HIS B 1 330 ? -26.295 50.237 -35.369 1.00 5.97 ? 418 HIS B C 1 ATOM 5397 O O . HIS B 1 330 ? -25.170 50.100 -34.863 1.00 7.99 ? 418 HIS B O 1 ATOM 5398 C CB . HIS B 1 330 ? -27.954 50.945 -33.676 1.00 6.02 ? 418 HIS B CB 1 ATOM 5399 C CG . HIS B 1 330 ? -28.603 52.077 -32.955 1.00 9.08 ? 418 HIS B CG 1 ATOM 5400 N ND1 . HIS B 1 330 ? -29.905 52.435 -33.206 1.00 8.67 ? 418 HIS B ND1 1 ATOM 5401 C CD2 . HIS B 1 330 ? -28.141 52.937 -32.009 1.00 11.10 ? 418 HIS B CD2 1 ATOM 5402 C CE1 . HIS B 1 330 ? -30.240 53.463 -32.430 1.00 11.16 ? 418 HIS B CE1 1 ATOM 5403 N NE2 . HIS B 1 330 ? -29.179 53.803 -31.712 1.00 10.94 ? 418 HIS B NE2 1 ATOM 5404 N N . CYS B 1 331 ? -26.767 49.433 -36.299 1.00 6.88 ? 419 CYS B N 1 ATOM 5405 C CA . CYS B 1 331 ? -26.015 48.256 -36.760 1.00 6.87 ? 419 CYS B CA 1 ATOM 5406 C C . CYS B 1 331 ? -25.022 48.618 -37.844 1.00 7.07 ? 419 CYS B C 1 ATOM 5407 O O . CYS B 1 331 ? -24.197 47.806 -38.261 1.00 8.16 ? 419 CYS B O 1 ATOM 5408 C CB . CYS B 1 331 ? -27.016 47.197 -37.242 1.00 7.05 ? 419 CYS B CB 1 ATOM 5409 S SG . CYS B 1 331 ? -28.127 46.640 -35.935 1.00 8.94 ? 419 CYS B SG 1 ATOM 5410 N N . GLY B 1 332 ? -25.049 49.878 -38.259 1.00 7.14 ? 420 GLY B N 1 ATOM 5411 C CA . GLY B 1 332 ? -24.144 50.422 -39.247 1.00 7.53 ? 420 GLY B CA 1 ATOM 5412 C C . GLY B 1 332 ? -23.021 51.263 -38.686 1.00 7.60 ? 420 GLY B C 1 ATOM 5413 O O . GLY B 1 332 ? -22.130 51.714 -39.436 1.00 9.65 ? 420 GLY B O 1 ATOM 5414 N N . LEU B 1 333 ? -23.041 51.452 -37.375 1.00 7.91 ? 421 LEU B N 1 ATOM 5415 C CA . LEU B 1 333 ? -22.093 52.335 -36.738 1.00 8.51 ? 421 LEU B CA 1 ATOM 5416 C C . LEU B 1 333 ? -20.701 51.705 -36.773 1.00 9.40 ? 421 LEU B C 1 ATOM 5417 O O . LEU B 1 333 ? -20.537 50.510 -37.020 1.00 8.53 ? 421 LEU B O 1 ATOM 5418 C CB . LEU B 1 333 ? -22.539 52.649 -35.309 1.00 8.36 ? 421 LEU B CB 1 ATOM 5419 C CG . LEU B 1 333 ? -23.874 53.392 -35.187 1.00 9.27 ? 421 LEU B CG 1 ATOM 5420 C CD1 . LEU B 1 333 ? -24.261 53.447 -33.755 1.00 9.98 ? 421 LEU B CD1 1 ATOM 5421 C CD2 . LEU B 1 333 ? -23.795 54.811 -35.811 1.00 10.35 ? 421 LEU B CD2 1 ATOM 5422 N N . GLU B 1 334 ? -19.708 52.556 -36.518 1.00 11.07 ? 422 GLU B N 1 ATOM 5423 C CA . GLU B 1 334 ? -18.289 52.227 -36.570 1.00 10.96 ? 422 GLU B CA 1 ATOM 5424 C C . GLU B 1 334 ? -17.908 51.203 -35.505 1.00 10.62 ? 422 GLU B C 1 ATOM 5425 O O . GLU B 1 334 ? -16.976 50.441 -35.682 1.00 10.83 ? 422 GLU B O 1 ATOM 5426 C CB . GLU B 1 334 ? -17.494 53.531 -36.326 1.00 11.58 ? 422 GLU B CB 1 ATOM 5427 C CG . GLU B 1 334 ? -18.117 54.785 -36.986 1.00 17.93 ? 422 GLU B CG 1 ATOM 5428 C CD . GLU B 1 334 ? -19.493 55.236 -36.419 1.00 22.14 ? 422 GLU B CD 1 ATOM 5429 O OE1 . GLU B 1 334 ? -19.671 55.303 -35.162 1.00 27.17 ? 422 GLU B OE1 1 ATOM 5430 O OE2 . GLU B 1 334 ? -20.404 55.534 -37.254 1.00 24.93 ? 422 GLU B OE2 1 ATOM 5431 N N . ASP B 1 335 ? -18.658 51.185 -34.397 1.00 9.17 ? 423 ASP B N 1 ATOM 5432 C CA . ASP B 1 335 ? -18.454 50.206 -33.323 1.00 9.41 ? 423 ASP B CA 1 ATOM 5433 C C . ASP B 1 335 ? -19.406 49.005 -33.350 1.00 9.49 ? 423 ASP B C 1 ATOM 5434 O O . ASP B 1 335 ? -19.523 48.295 -32.348 1.00 10.32 ? 423 ASP B O 1 ATOM 5435 C CB . ASP B 1 335 ? -18.522 50.908 -31.966 1.00 9.63 ? 423 ASP B CB 1 ATOM 5436 C CG . ASP B 1 335 ? -19.864 51.612 -31.728 1.00 12.96 ? 423 ASP B CG 1 ATOM 5437 O OD1 . ASP B 1 335 ? -20.882 51.308 -32.437 1.00 19.24 ? 423 ASP B OD1 1 ATOM 5438 O OD2 . ASP B 1 335 ? -20.019 52.407 -30.785 1.00 11.10 ? 423 ASP B OD2 1 ATOM 5439 N N . ALA B 1 336 ? -20.089 48.790 -34.482 1.00 8.35 ? 424 ALA B N 1 ATOM 5440 C CA . ALA B 1 336 ? -20.912 47.574 -34.710 1.00 7.66 ? 424 ALA B CA 1 ATOM 5441 C C . ALA B 1 336 ? -20.113 46.662 -35.639 1.00 8.82 ? 424 ALA B C 1 ATOM 5442 O O . ALA B 1 336 ? -19.576 47.122 -36.643 1.00 9.44 ? 424 ALA B O 1 ATOM 5443 C CB . ALA B 1 336 ? -22.227 47.937 -35.329 1.00 8.32 ? 424 ALA B CB 1 ATOM 5444 N N . LEU B 1 337 ? -19.994 45.389 -35.305 1.00 7.89 ? 425 LEU B N 1 ATOM 5445 C CA . LEU B 1 337 ? -19.221 44.478 -36.122 1.00 8.64 ? 425 LEU B CA 1 ATOM 5446 C C . LEU B 1 337 ? -19.976 44.162 -37.392 1.00 9.37 ? 425 LEU B C 1 ATOM 5447 O O . LEU B 1 337 ? -21.201 43.983 -37.363 1.00 7.05 ? 425 LEU B O 1 ATOM 5448 C CB . LEU B 1 337 ? -18.924 43.199 -35.334 1.00 8.92 ? 425 LEU B CB 1 ATOM 5449 C CG . LEU B 1 337 ? -17.854 42.278 -35.918 1.00 9.91 ? 425 LEU B CG 1 ATOM 5450 C CD1 . LEU B 1 337 ? -16.484 42.913 -35.833 1.00 10.88 ? 425 LEU B CD1 1 ATOM 5451 C CD2 . LEU B 1 337 ? -17.855 40.946 -35.159 1.00 7.80 ? 425 LEU B CD2 1 ATOM 5452 N N . LYS B 1 338 ? -19.262 44.146 -38.521 1.00 9.07 ? 426 LYS B N 1 ATOM 5453 C CA . LYS B 1 338 ? -19.882 43.979 -39.852 1.00 11.15 ? 426 LYS B CA 1 ATOM 5454 C C . LYS B 1 338 ? -19.031 43.116 -40.790 1.00 12.93 ? 426 LYS B C 1 ATOM 5455 O O . LYS B 1 338 ? -17.836 43.011 -40.542 1.00 14.10 ? 426 LYS B O 1 ATOM 5456 C CB . LYS B 1 338 ? -19.975 45.320 -40.539 1.00 12.85 ? 426 LYS B CB 1 ATOM 5457 C CG . LYS B 1 338 ? -20.716 46.368 -39.810 1.00 13.53 ? 426 LYS B CG 1 ATOM 5458 C CD . LYS B 1 338 ? -20.656 47.652 -40.656 1.00 16.63 ? 426 LYS B CD 1 ATOM 5459 C CE . LYS B 1 338 ? -20.674 48.864 -39.799 1.00 17.42 ? 426 LYS B CE 1 ATOM 5460 N NZ . LYS B 1 338 ? -19.504 48.940 -38.902 1.00 17.67 ? 426 LYS B NZ 1 ATOM 5461 N N . PRO B 1 339 ? -19.596 42.526 -41.851 1.00 13.36 ? 427 PRO B N 1 ATOM 5462 C CA . PRO B 1 339 ? -21.047 42.485 -42.121 1.00 12.99 ? 427 PRO B CA 1 ATOM 5463 C C . PRO B 1 339 ? -21.809 41.574 -41.167 1.00 11.73 ? 427 PRO B C 1 ATOM 5464 O O . PRO B 1 339 ? -21.319 40.503 -40.803 1.00 11.67 ? 427 PRO B O 1 ATOM 5465 C CB . PRO B 1 339 ? -21.128 41.911 -43.548 1.00 13.54 ? 427 PRO B CB 1 ATOM 5466 C CG . PRO B 1 339 ? -19.896 41.054 -43.655 1.00 14.21 ? 427 PRO B CG 1 ATOM 5467 C CD . PRO B 1 339 ? -18.837 41.860 -42.929 1.00 14.74 ? 427 PRO B CD 1 ATOM 5468 N N . ALA B 1 340 ? -23.013 41.995 -40.794 1.00 9.69 ? 428 ALA B N 1 ATOM 5469 C CA . ALA B 1 340 ? -23.862 41.286 -39.824 1.00 8.46 ? 428 ALA B CA 1 ATOM 5470 C C . ALA B 1 340 ? -25.137 40.804 -40.504 1.00 8.43 ? 428 ALA B C 1 ATOM 5471 O O . ALA B 1 340 ? -25.713 41.516 -41.338 1.00 7.82 ? 428 ALA B O 1 ATOM 5472 C CB . ALA B 1 340 ? -24.178 42.183 -38.684 1.00 8.19 ? 428 ALA B CB 1 ATOM 5473 N N . PRO B 1 341 ? -25.570 39.585 -40.200 1.00 7.20 ? 429 PRO B N 1 ATOM 5474 C CA . PRO B 1 341 ? -26.755 39.033 -40.835 1.00 7.52 ? 429 PRO B CA 1 ATOM 5475 C C . PRO B 1 341 ? -28.037 39.548 -40.107 1.00 7.58 ? 429 PRO B C 1 ATOM 5476 O O . PRO B 1 341 ? -27.943 40.381 -39.219 1.00 8.56 ? 429 PRO B O 1 ATOM 5477 C CB . PRO B 1 341 ? -26.532 37.543 -40.695 1.00 7.48 ? 429 PRO B CB 1 ATOM 5478 C CG . PRO B 1 341 ? -25.836 37.440 -39.342 1.00 9.19 ? 429 PRO B CG 1 ATOM 5479 C CD . PRO B 1 341 ? -24.914 38.590 -39.309 1.00 7.80 ? 429 PRO B CD 1 ATOM 5480 N N . GLU B 1 342 ? -29.196 39.041 -40.467 1.00 10.03 ? 430 GLU B N 1 ATOM 5481 C CA . GLU B 1 342 ? -30.424 39.424 -39.783 1.00 9.02 ? 430 GLU B CA 1 ATOM 5482 C C . GLU B 1 342 ? -30.386 39.141 -38.263 1.00 8.51 ? 430 GLU B C 1 ATOM 5483 O O . GLU B 1 342 ? -29.793 38.149 -37.839 1.00 8.22 ? 430 GLU B O 1 ATOM 5484 C CB . GLU B 1 342 ? -31.578 38.663 -40.384 1.00 10.20 ? 430 GLU B CB 1 ATOM 5485 C CG . GLU B 1 342 ? -32.017 39.190 -41.727 1.00 10.20 ? 430 GLU B CG 1 ATOM 5486 C CD . GLU B 1 342 ? -32.671 40.559 -41.673 1.00 12.15 ? 430 GLU B CD 1 ATOM 5487 O OE1 . GLU B 1 342 ? -33.198 40.926 -40.613 1.00 12.38 ? 430 GLU B OE1 1 ATOM 5488 O OE2 . GLU B 1 342 ? -32.699 41.257 -42.721 1.00 10.70 ? 430 GLU B OE2 1 ATOM 5489 N N . ALA B 1 343 ? -31.070 39.972 -37.467 1.00 7.89 ? 431 ALA B N 1 ATOM 5490 C CA . ALA B 1 343 ? -31.256 39.708 -36.035 1.00 7.86 ? 431 ALA B CA 1 ATOM 5491 C C . ALA B 1 343 ? -31.669 38.267 -35.829 1.00 7.94 ? 431 ALA B C 1 ATOM 5492 O O . ALA B 1 343 ? -32.597 37.742 -36.507 1.00 7.60 ? 431 ALA B O 1 ATOM 5493 C CB . ALA B 1 343 ? -32.297 40.669 -35.373 1.00 8.01 ? 431 ALA B CB 1 ATOM 5494 N N . GLY B 1 344 ? -30.942 37.637 -34.905 1.00 7.92 ? 432 GLY B N 1 ATOM 5495 C CA . GLY B 1 344 ? -31.150 36.267 -34.500 1.00 7.83 ? 432 GLY B CA 1 ATOM 5496 C C . GLY B 1 344 ? -30.444 35.222 -35.307 1.00 7.93 ? 432 GLY B C 1 ATOM 5497 O O . GLY B 1 344 ? -30.318 34.078 -34.839 1.00 9.51 ? 432 GLY B O 1 ATOM 5498 N N . GLN B 1 345 ? -29.948 35.572 -36.491 1.00 6.38 ? 433 GLN B N 1 ATOM 5499 C CA . GLN B 1 345 ? -29.162 34.630 -37.262 1.00 7.11 ? 433 GLN B CA 1 ATOM 5500 C C . GLN B 1 345 ? -27.743 34.554 -36.688 1.00 7.18 ? 433 GLN B C 1 ATOM 5501 O O . GLN B 1 345 ? -27.241 35.475 -36.002 1.00 7.62 ? 433 GLN B O 1 ATOM 5502 C CB . GLN B 1 345 ? -29.088 35.000 -38.714 1.00 8.41 ? 433 GLN B CB 1 ATOM 5503 C CG . GLN B 1 345 ? -30.424 35.031 -39.409 1.00 9.23 ? 433 GLN B CG 1 ATOM 5504 C CD . GLN B 1 345 ? -31.036 33.674 -39.463 1.00 11.48 ? 433 GLN B CD 1 ATOM 5505 O OE1 . GLN B 1 345 ? -30.412 32.724 -39.948 1.00 16.24 ? 433 GLN B OE1 1 ATOM 5506 N NE2 . GLN B 1 345 ? -32.256 33.555 -38.979 1.00 13.39 ? 433 GLN B NE2 1 ATOM 5507 N N . TRP B 1 346 ? -27.084 33.457 -37.013 1.00 7.60 ? 434 TRP B N 1 ATOM 5508 C CA . TRP B 1 346 ? -25.753 33.233 -36.475 1.00 6.41 ? 434 TRP B CA 1 ATOM 5509 C C . TRP B 1 346 ? -24.749 34.216 -37.119 1.00 6.09 ? 434 TRP B C 1 ATOM 5510 O O . TRP B 1 346 ? -24.717 34.370 -38.340 1.00 5.77 ? 434 TRP B O 1 ATOM 5511 C CB . TRP B 1 346 ? -25.323 31.792 -36.714 1.00 6.64 ? 434 TRP B CB 1 ATOM 5512 C CG . TRP B 1 346 ? -24.115 31.437 -35.896 1.00 6.89 ? 434 TRP B CG 1 ATOM 5513 C CD1 . TRP B 1 346 ? -22.867 31.225 -36.339 1.00 8.67 ? 434 TRP B CD1 1 ATOM 5514 C CD2 . TRP B 1 346 ? -24.085 31.269 -34.486 1.00 7.09 ? 434 TRP B CD2 1 ATOM 5515 N NE1 . TRP B 1 346 ? -22.036 30.962 -35.276 1.00 7.78 ? 434 TRP B NE1 1 ATOM 5516 C CE2 . TRP B 1 346 ? -22.751 30.986 -34.120 1.00 6.40 ? 434 TRP B CE2 1 ATOM 5517 C CE3 . TRP B 1 346 ? -25.037 31.419 -33.471 1.00 6.03 ? 434 TRP B CE3 1 ATOM 5518 C CZ2 . TRP B 1 346 ? -22.371 30.748 -32.802 1.00 8.05 ? 434 TRP B CZ2 1 ATOM 5519 C CZ3 . TRP B 1 346 ? -24.662 31.180 -32.142 1.00 5.59 ? 434 TRP B CZ3 1 ATOM 5520 C CH2 . TRP B 1 346 ? -23.320 30.869 -31.829 1.00 8.05 ? 434 TRP B CH2 1 ATOM 5521 N N . PHE B 1 347 ? -23.917 34.812 -36.285 1.00 5.88 ? 435 PHE B N 1 ATOM 5522 C CA . PHE B 1 347 ? -22.920 35.786 -36.667 1.00 6.06 ? 435 PHE B CA 1 ATOM 5523 C C . PHE B 1 347 ? -21.561 35.267 -36.157 1.00 6.70 ? 435 PHE B C 1 ATOM 5524 O O . PHE B 1 347 ? -21.101 35.554 -35.061 1.00 6.21 ? 435 PHE B O 1 ATOM 5525 C CB . PHE B 1 347 ? -23.316 37.160 -36.098 1.00 6.77 ? 435 PHE B CB 1 ATOM 5526 C CG . PHE B 1 347 ? -22.459 38.325 -36.569 1.00 6.31 ? 435 PHE B CG 1 ATOM 5527 C CD1 . PHE B 1 347 ? -21.393 38.192 -37.454 1.00 7.44 ? 435 PHE B CD1 1 ATOM 5528 C CD2 . PHE B 1 347 ? -22.733 39.608 -36.067 1.00 7.09 ? 435 PHE B CD2 1 ATOM 5529 C CE1 . PHE B 1 347 ? -20.645 39.286 -37.809 1.00 5.41 ? 435 PHE B CE1 1 ATOM 5530 C CE2 . PHE B 1 347 ? -22.009 40.676 -36.446 1.00 8.05 ? 435 PHE B CE2 1 ATOM 5531 C CZ . PHE B 1 347 ? -20.945 40.541 -37.303 1.00 7.05 ? 435 PHE B CZ 1 ATOM 5532 N N . ASN B 1 348 ? -20.948 34.433 -36.991 1.00 6.72 ? 436 ASN B N 1 ATOM 5533 C CA . ASN B 1 348 ? -19.794 33.705 -36.509 1.00 5.73 ? 436 ASN B CA 1 ATOM 5534 C C . ASN B 1 348 ? -18.602 34.560 -36.123 1.00 6.33 ? 436 ASN B C 1 ATOM 5535 O O . ASN B 1 348 ? -17.924 34.244 -35.144 1.00 6.17 ? 436 ASN B O 1 ATOM 5536 C CB . ASN B 1 348 ? -19.363 32.634 -37.490 1.00 6.18 ? 436 ASN B CB 1 ATOM 5537 C CG . ASN B 1 348 ? -18.605 31.507 -36.785 1.00 8.74 ? 436 ASN B CG 1 ATOM 5538 O OD1 . ASN B 1 348 ? -19.103 30.935 -35.837 1.00 12.92 ? 436 ASN B OD1 1 ATOM 5539 N ND2 . ASN B 1 348 ? -17.374 31.252 -37.208 1.00 12.23 ? 436 ASN B ND2 1 ATOM 5540 N N . GLU B 1 349 ? -18.336 35.633 -36.855 1.00 6.59 ? 437 GLU B N 1 ATOM 5541 C CA . GLU B 1 349 ? -17.267 36.509 -36.428 1.00 6.96 ? 437 GLU B CA 1 ATOM 5542 C C . GLU B 1 349 ? -17.535 37.115 -35.070 1.00 5.69 ? 437 GLU B C 1 ATOM 5543 O O . GLU B 1 349 ? -16.585 37.385 -34.348 1.00 6.98 ? 437 GLU B O 1 ATOM 5544 C CB . GLU B 1 349 ? -16.910 37.583 -37.456 1.00 8.13 ? 437 GLU B CB 1 ATOM 5545 C CG . GLU B 1 349 ? -16.236 36.984 -38.700 1.00 13.00 ? 437 GLU B CG 1 ATOM 5546 C CD . GLU B 1 349 ? -14.789 36.491 -38.558 1.00 22.80 ? 437 GLU B CD 1 ATOM 5547 O OE1 . GLU B 1 349 ? -14.118 36.508 -37.469 1.00 26.45 ? 437 GLU B OE1 1 ATOM 5548 O OE2 . GLU B 1 349 ? -14.259 36.062 -39.631 1.00 32.09 ? 437 GLU B OE2 1 ATOM 5549 N N . TYR B 1 350 ? -18.797 37.405 -34.762 1.00 5.61 ? 438 TYR B N 1 ATOM 5550 C CA . TYR B 1 350 ? -19.165 37.942 -33.449 1.00 5.72 ? 438 TYR B CA 1 ATOM 5551 C C . TYR B 1 350 ? -18.994 36.897 -32.332 1.00 5.77 ? 438 TYR B C 1 ATOM 5552 O O . TYR B 1 350 ? -18.467 37.176 -31.216 1.00 5.62 ? 438 TYR B O 1 ATOM 5553 C CB . TYR B 1 350 ? -20.574 38.520 -33.495 1.00 4.26 ? 438 TYR B CB 1 ATOM 5554 C CG . TYR B 1 350 ? -20.768 39.472 -32.353 1.00 5.73 ? 438 TYR B CG 1 ATOM 5555 C CD1 . TYR B 1 350 ? -21.169 39.036 -31.102 1.00 9.30 ? 438 TYR B CD1 1 ATOM 5556 C CD2 . TYR B 1 350 ? -20.489 40.814 -32.512 1.00 6.60 ? 438 TYR B CD2 1 ATOM 5557 C CE1 . TYR B 1 350 ? -21.243 39.909 -30.036 1.00 8.91 ? 438 TYR B CE1 1 ATOM 5558 C CE2 . TYR B 1 350 ? -20.602 41.698 -31.458 1.00 7.03 ? 438 TYR B CE2 1 ATOM 5559 C CZ . TYR B 1 350 ? -20.976 41.241 -30.230 1.00 7.50 ? 438 TYR B CZ 1 ATOM 5560 O OH . TYR B 1 350 ? -21.072 42.146 -29.183 1.00 6.96 ? 438 TYR B OH 1 ATOM 5561 N N . PHE B 1 351 ? -19.348 35.658 -32.655 1.00 4.94 ? 439 PHE B N 1 ATOM 5562 C CA . PHE B 1 351 ? -19.163 34.543 -31.723 1.00 4.91 ? 439 PHE B CA 1 ATOM 5563 C C . PHE B 1 351 ? -17.687 34.440 -31.377 1.00 4.75 ? 439 PHE B C 1 ATOM 5564 O O . PHE B 1 351 ? -17.314 34.264 -30.214 1.00 5.02 ? 439 PHE B O 1 ATOM 5565 C CB . PHE B 1 351 ? -19.651 33.245 -32.352 1.00 3.44 ? 439 PHE B CB 1 ATOM 5566 C CG . PHE B 1 351 ? -19.447 32.030 -31.498 1.00 4.40 ? 439 PHE B CG 1 ATOM 5567 C CD1 . PHE B 1 351 ? -20.187 31.795 -30.369 1.00 3.93 ? 439 PHE B CD1 1 ATOM 5568 C CD2 . PHE B 1 351 ? -18.532 31.080 -31.883 1.00 4.13 ? 439 PHE B CD2 1 ATOM 5569 C CE1 . PHE B 1 351 ? -20.017 30.646 -29.638 1.00 4.54 ? 439 PHE B CE1 1 ATOM 5570 C CE2 . PHE B 1 351 ? -18.326 29.937 -31.139 1.00 7.82 ? 439 PHE B CE2 1 ATOM 5571 C CZ . PHE B 1 351 ? -19.097 29.708 -30.035 1.00 6.49 ? 439 PHE B CZ 1 ATOM 5572 N N . ILE B 1 352 ? -16.846 34.552 -32.386 1.00 6.36 ? 440 ILE B N 1 ATOM 5573 C CA . ILE B 1 352 ? -15.416 34.433 -32.170 1.00 7.08 ? 440 ILE B CA 1 ATOM 5574 C C . ILE B 1 352 ? -14.873 35.569 -31.323 1.00 6.66 ? 440 ILE B C 1 ATOM 5575 O O . ILE B 1 352 ? -13.983 35.383 -30.464 1.00 6.92 ? 440 ILE B O 1 ATOM 5576 C CB . ILE B 1 352 ? -14.649 34.260 -33.502 1.00 7.46 ? 440 ILE B CB 1 ATOM 5577 C CG1 . ILE B 1 352 ? -14.999 32.873 -34.122 1.00 7.40 ? 440 ILE B CG1 1 ATOM 5578 C CG2 . ILE B 1 352 ? -13.142 34.421 -33.276 1.00 10.85 ? 440 ILE B CG2 1 ATOM 5579 C CD1 . ILE B 1 352 ? -14.612 32.742 -35.569 1.00 9.94 ? 440 ILE B CD1 1 ATOM 5580 N N . GLN B 1 353 ? -15.335 36.776 -31.601 1.00 6.00 ? 441 GLN B N 1 ATOM 5581 C CA . GLN B 1 353 ? -14.975 37.912 -30.750 1.00 6.27 ? 441 GLN B CA 1 ATOM 5582 C C . GLN B 1 353 ? -15.313 37.614 -29.288 1.00 6.17 ? 441 GLN B C 1 ATOM 5583 O O . GLN B 1 353 ? -14.489 37.860 -28.383 1.00 6.70 ? 441 GLN B O 1 ATOM 5584 C CB . GLN B 1 353 ? -15.698 39.167 -31.240 1.00 7.09 ? 441 GLN B CB 1 ATOM 5585 C CG . GLN B 1 353 ? -15.484 40.390 -30.349 1.00 7.88 ? 441 GLN B CG 1 ATOM 5586 C CD . GLN B 1 353 ? -16.449 41.511 -30.687 1.00 8.03 ? 441 GLN B CD 1 ATOM 5587 O OE1 . GLN B 1 353 ? -16.362 42.079 -31.768 1.00 9.38 ? 441 GLN B OE1 1 ATOM 5588 N NE2 . GLN B 1 353 ? -17.359 41.832 -29.763 1.00 9.42 ? 441 GLN B NE2 1 ATOM 5589 N N . LEU B 1 354 ? -16.526 37.118 -29.032 1.00 6.16 ? 442 LEU B N 1 ATOM 5590 C CA . LEU B 1 354 ? -16.951 36.846 -27.666 1.00 6.28 ? 442 LEU B CA 1 ATOM 5591 C C . LEU B 1 354 ? -16.076 35.807 -26.994 1.00 6.57 ? 442 LEU B C 1 ATOM 5592 O O . LEU B 1 354 ? -15.772 35.889 -25.788 1.00 7.27 ? 442 LEU B O 1 ATOM 5593 C CB . LEU B 1 354 ? -18.407 36.410 -27.636 1.00 4.99 ? 442 LEU B CB 1 ATOM 5594 C CG . LEU B 1 354 ? -19.461 37.460 -27.955 1.00 5.44 ? 442 LEU B CG 1 ATOM 5595 C CD1 . LEU B 1 354 ? -20.794 36.803 -28.127 1.00 8.01 ? 442 LEU B CD1 1 ATOM 5596 C CD2 . LEU B 1 354 ? -19.574 38.529 -26.874 1.00 5.15 ? 442 LEU B CD2 1 ATOM 5597 N N . LEU B 1 355 ? -15.714 34.795 -27.758 1.00 6.92 ? 443 LEU B N 1 ATOM 5598 C CA . LEU B 1 355 ? -14.828 33.746 -27.243 1.00 7.63 ? 443 LEU B CA 1 ATOM 5599 C C . LEU B 1 355 ? -13.455 34.250 -26.902 1.00 7.08 ? 443 LEU B C 1 ATOM 5600 O O . LEU B 1 355 ? -12.920 33.977 -25.833 1.00 6.36 ? 443 LEU B O 1 ATOM 5601 C CB . LEU B 1 355 ? -14.675 32.622 -28.269 1.00 7.92 ? 443 LEU B CB 1 ATOM 5602 C CG . LEU B 1 355 ? -15.636 31.458 -28.361 1.00 14.86 ? 443 LEU B CG 1 ATOM 5603 C CD1 . LEU B 1 355 ? -15.086 30.541 -29.468 1.00 11.91 ? 443 LEU B CD1 1 ATOM 5604 C CD2 . LEU B 1 355 ? -15.668 30.717 -27.023 1.00 17.80 ? 443 LEU B CD2 1 ATOM 5605 N N . ARG B 1 356 ? -12.883 35.046 -27.789 1.00 7.45 ? 444 ARG B N 1 ATOM 5606 C CA . ARG B 1 356 ? -11.560 35.581 -27.566 1.00 7.23 ? 444 ARG B CA 1 ATOM 5607 C C . ARG B 1 356 ? -11.499 36.472 -26.343 1.00 7.51 ? 444 ARG B C 1 ATOM 5608 O O . ARG B 1 356 ? -10.464 36.544 -25.666 1.00 6.21 ? 444 ARG B O 1 ATOM 5609 C CB . ARG B 1 356 ? -11.074 36.368 -28.766 1.00 8.21 ? 444 ARG B CB 1 ATOM 5610 C CG . ARG B 1 356 ? -10.746 35.522 -30.036 1.00 10.74 ? 444 ARG B CG 1 ATOM 5611 C CD . ARG B 1 356 ? -10.154 36.394 -31.180 1.00 14.34 ? 444 ARG B CD 1 ATOM 5612 N NE . ARG B 1 356 ? -10.000 35.709 -32.478 1.00 14.36 ? 444 ARG B NE 1 ATOM 5613 C CZ . ARG B 1 356 ? -9.143 34.741 -32.732 1.00 20.42 ? 444 ARG B CZ 1 ATOM 5614 N NH1 . ARG B 1 356 ? -8.318 34.292 -31.783 1.00 21.02 ? 444 ARG B NH1 1 ATOM 5615 N NH2 . ARG B 1 356 ? -9.073 34.220 -33.962 1.00 20.16 ? 444 ARG B NH2 1 ATOM 5616 N N . ASN B 1 357 ? -12.589 37.183 -26.087 1.00 6.42 ? 445 ASN B N 1 ATOM 5617 C CA . ASN B 1 357 ? -12.671 38.153 -25.003 1.00 7.24 ? 445 ASN B CA 1 ATOM 5618 C C . ASN B 1 357 ? -13.371 37.604 -23.751 1.00 6.96 ? 445 ASN B C 1 ATOM 5619 O O . ASN B 1 357 ? -13.605 38.356 -22.817 1.00 6.99 ? 445 ASN B O 1 ATOM 5620 C CB . ASN B 1 357 ? -13.434 39.401 -25.461 1.00 7.54 ? 445 ASN B CB 1 ATOM 5621 C CG . ASN B 1 357 ? -12.646 40.252 -26.410 1.00 9.65 ? 445 ASN B CG 1 ATOM 5622 O OD1 . ASN B 1 357 ? -11.406 40.247 -26.369 1.00 8.95 ? 445 ASN B OD1 1 ATOM 5623 N ND2 . ASN B 1 357 ? -13.329 40.995 -27.269 1.00 5.64 ? 445 ASN B ND2 1 ATOM 5624 N N . ALA B 1 358 ? -13.621 36.310 -23.695 1.00 8.09 ? 446 ALA B N 1 ATOM 5625 C CA . ALA B 1 358 ? -14.371 35.701 -22.601 1.00 8.11 ? 446 ALA B CA 1 ATOM 5626 C C . ALA B 1 358 ? -13.698 35.943 -21.252 1.00 8.40 ? 446 ALA B C 1 ATOM 5627 O O . ALA B 1 358 ? -12.510 35.737 -21.112 1.00 8.63 ? 446 ALA B O 1 ATOM 5628 C CB . ALA B 1 358 ? -14.506 34.224 -22.826 1.00 8.18 ? 446 ALA B CB 1 ATOM 5629 N N . ASN B 1 359 ? -14.507 36.314 -20.256 1.00 8.77 ? 447 ASN B N 1 ATOM 5630 C CA . ASN B 1 359 ? -14.053 36.461 -18.870 1.00 9.91 ? 447 ASN B CA 1 ATOM 5631 C C . ASN B 1 359 ? -15.131 36.025 -17.895 1.00 10.12 ? 447 ASN B C 1 ATOM 5632 O O . ASN B 1 359 ? -16.136 36.753 -17.748 1.00 10.02 ? 447 ASN B O 1 ATOM 5633 C CB . ASN B 1 359 ? -13.749 37.908 -18.596 1.00 10.17 ? 447 ASN B CB 1 ATOM 5634 C CG . ASN B 1 359 ? -12.938 38.083 -17.327 1.00 14.12 ? 447 ASN B CG 1 ATOM 5635 O OD1 . ASN B 1 359 ? -12.548 37.113 -16.679 1.00 17.59 ? 447 ASN B OD1 1 ATOM 5636 N ND2 . ASN B 1 359 ? -12.682 39.311 -16.975 1.00 23.42 ? 447 ASN B ND2 1 ATOM 5637 N N . PRO B 1 360 ? -14.980 34.901 -17.214 1.00 11.57 ? 448 PRO B N 1 ATOM 5638 C CA . PRO B 1 360 ? -13.771 34.059 -17.240 1.00 11.79 ? 448 PRO B CA 1 ATOM 5639 C C . PRO B 1 360 ? -13.615 33.306 -18.564 1.00 12.57 ? 448 PRO B C 1 ATOM 5640 O O . PRO B 1 360 ? -14.598 33.103 -19.275 1.00 9.81 ? 448 PRO B O 1 ATOM 5641 C CB . PRO B 1 360 ? -13.986 33.078 -16.094 1.00 12.09 ? 448 PRO B CB 1 ATOM 5642 C CG . PRO B 1 360 ? -15.439 33.056 -15.813 1.00 13.63 ? 448 PRO B CG 1 ATOM 5643 C CD . PRO B 1 360 ? -16.051 34.328 -16.370 1.00 13.21 ? 448 PRO B CD 1 ATOM 5644 N N . PRO B 1 361 ? -12.396 32.982 -18.919 1.00 12.97 ? 449 PRO B N 1 ATOM 5645 C CA . PRO B 1 361 ? -12.111 32.316 -20.205 1.00 13.53 ? 449 PRO B CA 1 ATOM 5646 C C . PRO B 1 361 ? -12.562 30.876 -20.283 1.00 14.26 ? 449 PRO B C 1 ATOM 5647 O O . PRO B 1 361 ? -12.857 30.291 -19.243 1.00 13.82 ? 449 PRO B O 1 ATOM 5648 C CB . PRO B 1 361 ? -10.610 32.422 -20.321 1.00 14.61 ? 449 PRO B CB 1 ATOM 5649 C CG . PRO B 1 361 ? -10.133 32.587 -18.941 1.00 14.20 ? 449 PRO B CG 1 ATOM 5650 C CD . PRO B 1 361 ? -11.167 33.311 -18.172 1.00 13.04 ? 449 PRO B CD 1 ATOM 5651 N N . PHE B 1 362 ? -12.686 30.371 -21.522 1.00 14.87 ? 450 PHE B N 1 ATOM 5652 C CA . PHE B 1 362 ? -13.120 29.008 -21.853 1.00 15.94 ? 450 PHE B CA 1 ATOM 5653 C C . PHE B 1 362 ? -11.986 28.067 -22.293 1.00 18.74 ? 450 PHE B C 1 ATOM 5654 O O . PHE B 1 362 ? -12.257 26.836 -22.554 1.00 21.19 ? 450 PHE B O 1 ATOM 5655 C CB . PHE B 1 362 ? -14.158 29.063 -22.979 1.00 14.94 ? 450 PHE B CB 1 ATOM 5656 C CG . PHE B 1 362 ? -15.488 29.462 -22.536 1.00 11.78 ? 450 PHE B CG 1 ATOM 5657 C CD1 . PHE B 1 362 ? -16.327 28.535 -21.939 1.00 11.63 ? 450 PHE B CD1 1 ATOM 5658 C CD2 . PHE B 1 362 ? -15.935 30.770 -22.693 1.00 12.94 ? 450 PHE B CD2 1 ATOM 5659 C CE1 . PHE B 1 362 ? -17.537 28.862 -21.494 1.00 12.38 ? 450 PHE B CE1 1 ATOM 5660 C CE2 . PHE B 1 362 ? -17.220 31.109 -22.265 1.00 12.49 ? 450 PHE B CE2 1 ATOM 5661 C CZ . PHE B 1 362 ? -18.020 30.161 -21.660 1.00 11.99 ? 450 PHE B CZ 1 ATOM 5662 O OXT . PHE B 1 362 ? -10.808 28.514 -22.402 1.00 18.69 ? 450 PHE B OXT 1 HETATM 5663 C C1 . NAG C 2 . ? -16.879 10.118 -3.989 1.00 14.78 ? 451 NAG A C1 1 HETATM 5664 C C2 . NAG C 2 . ? -18.424 10.056 -4.145 1.00 15.53 ? 451 NAG A C2 1 HETATM 5665 C C3 . NAG C 2 . ? -18.869 11.025 -5.258 1.00 19.64 ? 451 NAG A C3 1 HETATM 5666 C C4 . NAG C 2 . ? -18.267 12.398 -5.036 1.00 16.99 ? 451 NAG A C4 1 HETATM 5667 C C5 . NAG C 2 . ? -16.750 12.284 -4.843 1.00 18.19 ? 451 NAG A C5 1 HETATM 5668 C C6 . NAG C 2 . ? -16.087 13.609 -4.552 1.00 19.35 ? 451 NAG A C6 1 HETATM 5669 C C7 . NAG C 2 . ? -19.855 8.088 -3.963 1.00 17.92 ? 451 NAG A C7 1 HETATM 5670 C C8 . NAG C 2 . ? -20.078 6.705 -4.435 1.00 18.79 ? 451 NAG A C8 1 HETATM 5671 N N2 . NAG C 2 . ? -18.821 8.733 -4.521 1.00 16.84 ? 451 NAG A N2 1 HETATM 5672 O O3 . NAG C 2 . ? -20.274 11.139 -5.238 1.00 19.76 ? 451 NAG A O3 1 HETATM 5673 O O4 . NAG C 2 . ? -18.631 13.336 -6.042 1.00 18.84 ? 451 NAG A O4 1 HETATM 5674 O O5 . NAG C 2 . ? -16.501 11.457 -3.726 1.00 17.27 ? 451 NAG A O5 1 HETATM 5675 O O6 . NAG C 2 . ? -14.673 13.445 -4.590 1.00 17.96 ? 451 NAG A O6 1 HETATM 5676 O O7 . NAG C 2 . ? -20.623 8.600 -3.131 1.00 20.66 ? 451 NAG A O7 1 HETATM 5677 C C1 . GTM D 3 . ? 3.916 -24.241 6.553 1.00 35.00 ? 452 GTM A C1 1 HETATM 5678 C C2 . GTM D 3 . ? 3.454 -23.092 7.430 1.00 33.69 ? 452 GTM A C2 1 HETATM 5679 C C3 . GTM D 3 . ? 2.179 -22.442 6.870 1.00 31.82 ? 452 GTM A C3 1 HETATM 5680 C C4 . GTM D 3 . ? 2.347 -22.009 5.419 1.00 30.58 ? 452 GTM A C4 1 HETATM 5681 C C5 . GTM D 3 . ? 2.851 -23.184 4.609 1.00 31.83 ? 452 GTM A C5 1 HETATM 5682 C C6 . GTM D 3 . ? 3.224 -22.701 3.228 1.00 31.66 ? 452 GTM A C6 1 HETATM 5683 C C7 . GTM D 3 . ? 5.910 -25.538 6.063 1.00 37.52 ? 452 GTM A C7 1 HETATM 5684 O O1 . GTM D 3 . ? 5.180 -24.759 6.995 1.00 37.07 ? 452 GTM A O1 1 HETATM 5685 O O2 . GTM D 3 . ? 3.273 -23.637 8.741 1.00 34.14 ? 452 GTM A O2 1 HETATM 5686 O O3 . GTM D 3 . ? 1.821 -21.313 7.642 1.00 33.37 ? 452 GTM A O3 1 HETATM 5687 S S4 . GTM D 3 . ? 0.783 -21.436 4.661 1.00 24.69 ? 452 GTM A S4 1 HETATM 5688 O O5 . GTM D 3 . ? 4.005 -23.793 5.215 1.00 33.20 ? 452 GTM A O5 1 HETATM 5689 O O6 . GTM D 3 . ? 3.681 -23.835 2.564 1.00 35.38 ? 452 GTM A O6 1 HETATM 5690 C C2 . BGC E 4 . ? -0.098 -19.059 3.742 1.00 17.62 ? 453 BGC A C2 1 HETATM 5691 C C3 . BGC E 4 . ? -0.075 -17.528 3.856 1.00 16.03 ? 453 BGC A C3 1 HETATM 5692 C C4 . BGC E 4 . ? 0.084 -17.084 5.328 1.00 17.64 ? 453 BGC A C4 1 HETATM 5693 C C5 . BGC E 4 . ? 1.232 -17.826 5.987 1.00 18.30 ? 453 BGC A C5 1 HETATM 5694 C C6 . BGC E 4 . ? 1.346 -17.555 7.480 1.00 22.69 ? 453 BGC A C6 1 HETATM 5695 C C1 . BGC E 4 . ? 1.074 -19.640 4.495 1.00 18.56 ? 453 BGC A C1 1 HETATM 5696 O O2 . BGC E 4 . ? 0.056 -19.384 2.377 1.00 20.07 ? 453 BGC A O2 1 HETATM 5697 O O3 . BGC E 4 . ? -1.210 -16.967 3.186 1.00 18.83 ? 453 BGC A O3 1 HETATM 5698 O O4 . BGC E 4 . ? 0.360 -15.677 5.405 1.00 17.33 ? 453 BGC A O4 1 HETATM 5699 O O5 . BGC E 4 . ? 1.001 -19.244 5.838 1.00 21.24 ? 453 BGC A O5 1 HETATM 5700 O O6 . BGC E 4 . ? 2.765 -17.617 7.722 1.00 26.64 ? 453 BGC A O6 1 HETATM 5701 C C2 . BGC F 4 . ? 0.023 -13.566 6.281 1.00 14.99 ? 454 BGC A C2 1 HETATM 5702 C C3 . BGC F 4 . ? -0.943 -12.525 6.778 1.00 14.62 ? 454 BGC A C3 1 HETATM 5703 C C4 . BGC F 4 . ? -2.173 -12.417 5.868 1.00 12.14 ? 454 BGC A C4 1 HETATM 5704 C C5 . BGC F 4 . ? -2.744 -13.838 5.608 1.00 13.39 ? 454 BGC A C5 1 HETATM 5705 C C6 . BGC F 4 . ? -3.905 -13.843 4.608 1.00 15.15 ? 454 BGC A C6 1 HETATM 5706 C C1 . BGC F 4 . ? -0.676 -14.890 5.982 1.00 15.98 ? 454 BGC A C1 1 HETATM 5707 O O2 . BGC F 4 . ? 1.130 -13.718 7.193 1.00 17.70 ? 454 BGC A O2 1 HETATM 5708 O O3 . BGC F 4 . ? -0.183 -11.334 6.894 1.00 15.25 ? 454 BGC A O3 1 HETATM 5709 O O4 . BGC F 4 . ? -3.230 -11.739 6.506 1.00 12.20 ? 454 BGC A O4 1 HETATM 5710 O O5 . BGC F 4 . ? -1.767 -14.709 5.087 1.00 14.95 ? 454 BGC A O5 1 HETATM 5711 O O6 . BGC F 4 . ? -4.543 -15.115 4.597 1.00 14.34 ? 454 BGC A O6 1 HETATM 5712 C C1 . GDA G 5 . ? -3.390 -10.392 6.105 1.00 12.45 ? 455 GDA A C1 1 HETATM 5713 C C2 . GDA G 5 . ? -4.738 -9.856 6.542 1.00 13.47 ? 455 GDA A C2 1 HETATM 5714 C C3 . GDA G 5 . ? -4.846 -8.356 6.232 1.00 14.30 ? 455 GDA A C3 1 HETATM 5715 C C4 . GDA G 5 . ? -3.621 -7.597 6.781 1.00 13.98 ? 455 GDA A C4 1 HETATM 5716 C C5 . GDA G 5 . ? -2.314 -8.246 6.334 1.00 11.00 ? 455 GDA A C5 1 HETATM 5717 C C6 . GDA G 5 . ? -1.063 -7.632 7.024 1.00 10.40 ? 455 GDA A C6 1 HETATM 5718 N N4 . GDA G 5 . ? -3.661 -6.170 6.363 1.00 16.92 ? 455 GDA A N4 1 HETATM 5719 O O2 . GDA G 5 . ? -5.775 -10.614 5.920 1.00 13.36 ? 455 GDA A O2 1 HETATM 5720 O O3 . GDA G 5 . ? -6.079 -7.856 6.757 1.00 14.55 ? 455 GDA A O3 1 HETATM 5721 O O5 . GDA G 5 . ? -2.365 -9.637 6.690 1.00 12.62 ? 455 GDA A O5 1 HETATM 5722 O O6 . GDA G 5 . ? 0.109 -8.294 6.535 1.00 12.33 ? 455 GDA A O6 1 HETATM 5723 C C1 . GTM H 3 . ? -6.176 0.144 7.498 1.00 12.60 ? 456 GTM A C1 1 HETATM 5724 C C2 . GTM H 3 . ? -7.468 0.682 8.056 1.00 11.84 ? 456 GTM A C2 1 HETATM 5725 C C3 . GTM H 3 . ? -7.625 2.154 7.678 1.00 11.30 ? 456 GTM A C3 1 HETATM 5726 C C4 . GTM H 3 . ? -6.347 2.941 8.052 1.00 10.18 ? 456 GTM A C4 1 HETATM 5727 C C5 . GTM H 3 . ? -5.058 2.261 7.583 1.00 10.76 ? 456 GTM A C5 1 HETATM 5728 C C6 . GTM H 3 . ? -3.795 2.939 8.152 1.00 11.70 ? 456 GTM A C6 1 HETATM 5729 C C7 . GTM H 3 . ? -5.091 -1.923 6.933 1.00 16.40 ? 456 GTM A C7 1 HETATM 5730 O O1 . GTM H 3 . ? -5.966 -1.192 7.816 1.00 14.58 ? 456 GTM A O1 1 HETATM 5731 O O2 . GTM H 3 . ? -8.543 -0.120 7.557 1.00 14.73 ? 456 GTM A O2 1 HETATM 5732 O O3 . GTM H 3 . ? -8.785 2.683 8.280 1.00 13.37 ? 456 GTM A O3 1 HETATM 5733 S S4 . GTM H 3 . ? -6.430 4.566 7.345 1.00 14.11 ? 456 GTM A S4 1 HETATM 5734 O O5 . GTM H 3 . ? -5.082 0.919 8.005 1.00 12.64 ? 456 GTM A O5 1 HETATM 5735 O O6 . GTM H 3 . ? -3.846 2.873 9.589 1.00 9.63 ? 456 GTM A O6 1 HETATM 5736 C C2 . BGC I 4 . ? -6.353 7.025 8.583 1.00 14.59 ? 457 BGC A C2 1 HETATM 5737 C C3 . BGC I 4 . ? -6.887 7.901 9.701 1.00 16.68 ? 457 BGC A C3 1 HETATM 5738 C C4 . BGC I 4 . ? -8.398 7.789 9.827 1.00 16.67 ? 457 BGC A C4 1 HETATM 5739 C C5 . BGC I 4 . ? -8.750 6.294 9.951 1.00 15.25 ? 457 BGC A C5 1 HETATM 5740 C C6 . BGC I 4 . ? -10.245 6.012 10.036 1.00 18.34 ? 457 BGC A C6 1 HETATM 5741 C C1 . BGC I 4 . ? -6.818 5.572 8.771 1.00 15.48 ? 457 BGC A C1 1 HETATM 5742 O O2 . BGC I 4 . ? -4.952 7.049 8.489 1.00 15.37 ? 457 BGC A O2 1 HETATM 5743 O O3 . BGC I 4 . ? -6.496 9.266 9.519 1.00 17.56 ? 457 BGC A O3 1 HETATM 5744 O O4 . BGC I 4 . ? -8.728 8.452 11.053 1.00 19.49 ? 457 BGC A O4 1 HETATM 5745 O O5 . BGC I 4 . ? -8.222 5.505 8.896 1.00 13.06 ? 457 BGC A O5 1 HETATM 5746 O O6 . BGC I 4 . ? -10.842 6.404 8.833 1.00 20.06 ? 457 BGC A O6 1 HETATM 5747 C C2 . BGC J 4 . ? -10.262 9.773 12.377 1.00 28.63 ? 458 BGC A C2 1 HETATM 5748 C C3 . BGC J 4 . ? -11.527 10.622 12.364 1.00 32.54 ? 458 BGC A C3 1 HETATM 5749 C C4 . BGC J 4 . ? -11.374 11.731 11.346 1.00 31.28 ? 458 BGC A C4 1 HETATM 5750 C C5 . BGC J 4 . ? -10.781 11.179 10.041 1.00 29.40 ? 458 BGC A C5 1 HETATM 5751 C C6 . BGC J 4 . ? -10.535 12.301 9.060 1.00 29.43 ? 458 BGC A C6 1 HETATM 5752 C C1 . BGC J 4 . ? -9.840 9.349 10.968 1.00 24.53 ? 458 BGC A C1 1 HETATM 5753 O O2 . BGC J 4 . ? -10.481 8.677 13.248 1.00 28.86 ? 458 BGC A O2 1 HETATM 5754 O O3 . BGC J 4 . ? -11.778 11.127 13.672 1.00 35.28 ? 458 BGC A O3 1 HETATM 5755 O O4 . BGC J 4 . ? -12.666 12.295 11.168 1.00 32.67 ? 458 BGC A O4 1 HETATM 5756 O O5 . BGC J 4 . ? -9.511 10.517 10.231 1.00 24.43 ? 458 BGC A O5 1 HETATM 5757 O O6 . BGC J 4 . ? -10.274 11.698 7.805 1.00 29.82 ? 458 BGC A O6 1 HETATM 5758 C C1 . GOL K 6 . ? 5.842 19.010 7.167 1.00 25.77 ? 459 GOL A C1 1 HETATM 5759 O O1 . GOL K 6 . ? 4.817 19.132 8.114 1.00 30.16 ? 459 GOL A O1 1 HETATM 5760 C C2 . GOL K 6 . ? 7.272 19.224 7.685 1.00 29.92 ? 459 GOL A C2 1 HETATM 5761 O O2 . GOL K 6 . ? 7.387 19.999 8.869 1.00 30.60 ? 459 GOL A O2 1 HETATM 5762 C C3 . GOL K 6 . ? 7.958 17.913 7.866 1.00 26.95 ? 459 GOL A C3 1 HETATM 5763 O O3 . GOL K 6 . ? 7.479 17.048 6.857 1.00 17.36 ? 459 GOL A O3 1 HETATM 5764 C C1 . NAG L 2 . ? -49.645 30.130 -33.695 1.00 18.22 ? 451 NAG B C1 1 HETATM 5765 C C2 . NAG L 2 . ? -50.635 30.290 -34.873 1.00 19.12 ? 451 NAG B C2 1 HETATM 5766 C C3 . NAG L 2 . ? -51.891 29.439 -34.627 1.00 22.13 ? 451 NAG B C3 1 HETATM 5767 C C4 . NAG L 2 . ? -51.464 28.008 -34.374 1.00 21.52 ? 451 NAG B C4 1 HETATM 5768 C C5 . NAG L 2 . ? -50.474 28.005 -33.181 1.00 21.53 ? 451 NAG B C5 1 HETATM 5769 C C6 . NAG L 2 . ? -50.049 26.630 -32.703 1.00 22.74 ? 451 NAG B C6 1 HETATM 5770 C C7 . NAG L 2 . ? -51.104 32.324 -36.203 1.00 23.03 ? 451 NAG B C7 1 HETATM 5771 C C8 . NAG L 2 . ? -51.510 33.765 -36.132 1.00 24.87 ? 451 NAG B C8 1 HETATM 5772 N N2 . NAG L 2 . ? -51.039 31.667 -35.023 1.00 21.86 ? 451 NAG B N2 1 HETATM 5773 O O3 . NAG L 2 . ? -52.695 29.477 -35.790 1.00 24.23 ? 451 NAG B O3 1 HETATM 5774 O O4 . NAG L 2 . ? -52.626 27.272 -34.030 1.00 21.33 ? 451 NAG B O4 1 HETATM 5775 O O5 . NAG L 2 . ? -49.321 28.768 -33.555 1.00 18.92 ? 451 NAG B O5 1 HETATM 5776 O O6 . NAG L 2 . ? -49.107 26.719 -31.622 1.00 21.06 ? 451 NAG B O6 1 HETATM 5777 O O7 . NAG L 2 . ? -50.836 31.795 -37.296 1.00 24.86 ? 451 NAG B O7 1 HETATM 5778 C C1 . GTM M 3 . ? -29.057 62.998 -19.508 1.00 33.28 ? 452 GTM B C1 1 HETATM 5779 C C2 . GTM M 3 . ? -28.066 62.319 -20.443 1.00 30.61 ? 452 GTM B C2 1 HETATM 5780 C C3 . GTM M 3 . ? -28.815 61.707 -21.605 1.00 29.58 ? 452 GTM B C3 1 HETATM 5781 C C4 . GTM M 3 . ? -29.860 60.715 -21.147 1.00 29.58 ? 452 GTM B C4 1 HETATM 5782 C C5 . GTM M 3 . ? -30.770 61.397 -20.133 1.00 30.63 ? 452 GTM B C5 1 HETATM 5783 C C6 . GTM M 3 . ? -31.740 60.446 -19.458 1.00 32.99 ? 452 GTM B C6 1 HETATM 5784 C C7 . GTM M 3 . ? -29.150 64.571 -17.667 1.00 35.55 ? 452 GTM B C7 1 HETATM 5785 O O1 . GTM M 3 . ? -28.386 63.608 -18.392 1.00 34.49 ? 452 GTM B O1 1 HETATM 5786 O O2 . GTM M 3 . ? -27.117 63.247 -21.005 1.00 32.14 ? 452 GTM B O2 1 HETATM 5787 O O3 . GTM M 3 . ? -27.898 61.098 -22.502 1.00 30.84 ? 452 GTM B O3 1 HETATM 5788 S S4 . GTM M 3 . ? -30.857 60.186 -22.574 1.00 23.99 ? 452 GTM B S4 1 HETATM 5789 O O5 . GTM M 3 . ? -30.040 62.028 -19.101 1.00 31.68 ? 452 GTM B O5 1 HETATM 5790 O O6 . GTM M 3 . ? -32.153 61.086 -18.258 1.00 33.05 ? 452 GTM B O6 1 HETATM 5791 C C2 . BGC N 4 . ? -32.221 57.873 -23.006 1.00 20.22 ? 453 BGC B C2 1 HETATM 5792 C C3 . BGC N 4 . ? -32.195 56.339 -23.075 1.00 19.03 ? 453 BGC B C3 1 HETATM 5793 C C4 . BGC N 4 . ? -30.919 55.870 -23.758 1.00 17.40 ? 453 BGC B C4 1 HETATM 5794 C C5 . BGC N 4 . ? -29.691 56.530 -23.110 1.00 19.88 ? 453 BGC B C5 1 HETATM 5795 C C6 . BGC N 4 . ? -28.368 56.165 -23.776 1.00 21.79 ? 453 BGC B C6 1 HETATM 5796 C C1 . BGC N 4 . ? -30.912 58.355 -22.381 1.00 20.12 ? 453 BGC B C1 1 HETATM 5797 O O2 . BGC N 4 . ? -33.266 58.253 -22.124 1.00 23.08 ? 453 BGC B O2 1 HETATM 5798 O O3 . BGC N 4 . ? -33.349 55.794 -23.723 1.00 20.70 ? 453 BGC B O3 1 HETATM 5799 O O4 . BGC N 4 . ? -30.829 54.454 -23.535 1.00 16.43 ? 453 BGC B O4 1 HETATM 5800 O O5 . BGC N 4 . ? -29.810 57.943 -23.154 1.00 19.14 ? 453 BGC B O5 1 HETATM 5801 O O6 . BGC N 4 . ? -27.381 56.333 -22.767 1.00 22.59 ? 453 BGC B O6 1 HETATM 5802 C C2 . BGC O 4 . ? -30.396 52.290 -24.388 1.00 14.53 ? 454 BGC B C2 1 HETATM 5803 C C3 . BGC O 4 . ? -30.569 51.334 -25.579 1.00 13.25 ? 454 BGC B C3 1 HETATM 5804 C C4 . BGC O 4 . ? -32.020 51.337 -26.035 1.00 14.43 ? 454 BGC B C4 1 HETATM 5805 C C5 . BGC O 4 . ? -32.438 52.817 -26.288 1.00 15.26 ? 454 BGC B C5 1 HETATM 5806 C C6 . BGC O 4 . ? -33.891 52.906 -26.716 1.00 14.51 ? 454 BGC B C6 1 HETATM 5807 C C1 . BGC O 4 . ? -30.939 53.696 -24.719 1.00 14.45 ? 454 BGC B C1 1 HETATM 5808 O O2 . BGC O 4 . ? -29.031 52.337 -24.022 1.00 18.02 ? 454 BGC B O2 1 HETATM 5809 O O3 . BGC O 4 . ? -30.147 50.051 -25.086 1.00 13.93 ? 454 BGC B O3 1 HETATM 5810 O O4 . BGC O 4 . ? -32.167 50.689 -27.269 1.00 13.84 ? 454 BGC B O4 1 HETATM 5811 O O5 . BGC O 4 . ? -32.297 53.591 -25.120 1.00 15.82 ? 454 BGC B O5 1 HETATM 5812 O O6 . BGC O 4 . ? -34.172 54.209 -27.211 1.00 15.44 ? 454 BGC B O6 1 HETATM 5813 C C1 . GDA P 5 . ? -32.631 49.346 -27.256 1.00 14.92 ? 455 GDA B C1 1 HETATM 5814 C C2 . GDA P 5 . ? -32.977 48.926 -28.672 1.00 14.41 ? 455 GDA B C2 1 HETATM 5815 C C3 . GDA P 5 . ? -33.368 47.415 -28.688 1.00 14.34 ? 455 GDA B C3 1 HETATM 5816 C C4 . GDA P 5 . ? -32.334 46.514 -28.002 1.00 16.76 ? 455 GDA B C4 1 HETATM 5817 C C5 . GDA P 5 . ? -31.943 47.126 -26.627 1.00 13.84 ? 455 GDA B C5 1 HETATM 5818 C C6 . GDA P 5 . ? -30.841 46.385 -25.845 1.00 12.51 ? 455 GDA B C6 1 HETATM 5819 N N4 . GDA P 5 . ? -32.875 45.138 -27.840 1.00 13.09 ? 455 GDA B N4 1 HETATM 5820 O O2 . GDA P 5 . ? -34.027 49.757 -29.178 1.00 15.54 ? 455 GDA B O2 1 HETATM 5821 O O3 . GDA P 5 . ? -33.601 46.951 -30.026 1.00 16.65 ? 455 GDA B O3 1 HETATM 5822 O O5 . GDA P 5 . ? -31.578 48.503 -26.759 1.00 14.89 ? 455 GDA B O5 1 HETATM 5823 O O6 . GDA P 5 . ? -30.520 46.992 -24.621 1.00 14.39 ? 455 GDA B O6 1 HETATM 5824 C C1 . GTM Q 3 . ? -33.623 38.951 -30.759 1.00 13.77 ? 456 GTM B C1 1 HETATM 5825 C C2 . GTM Q 3 . ? -33.916 38.470 -32.167 1.00 12.73 ? 456 GTM B C2 1 HETATM 5826 C C3 . GTM Q 3 . ? -34.457 37.075 -32.097 1.00 11.39 ? 456 GTM B C3 1 HETATM 5827 C C4 . GTM Q 3 . ? -33.496 36.155 -31.295 1.00 11.65 ? 456 GTM B C4 1 HETATM 5828 C C5 . GTM Q 3 . ? -33.112 36.762 -29.952 1.00 10.09 ? 456 GTM B C5 1 HETATM 5829 C C6 . GTM Q 3 . ? -32.010 35.995 -29.207 1.00 13.85 ? 456 GTM B C6 1 HETATM 5830 C C7 . GTM Q 3 . ? -33.398 40.906 -29.486 1.00 16.16 ? 456 GTM B C7 1 HETATM 5831 O O1 . GTM Q 3 . ? -33.138 40.247 -30.722 1.00 15.96 ? 456 GTM B O1 1 HETATM 5832 O O2 . GTM Q 3 . ? -34.839 39.360 -32.805 1.00 14.26 ? 456 GTM B O2 1 HETATM 5833 O O3 . GTM Q 3 . ? -34.628 36.577 -33.402 1.00 12.38 ? 456 GTM B O3 1 HETATM 5834 S S4 . GTM Q 3 . ? -34.222 34.545 -31.022 1.00 14.08 ? 456 GTM B S4 1 HETATM 5835 O O5 . GTM Q 3 . ? -32.673 38.094 -30.157 1.00 11.28 ? 456 GTM B O5 1 HETATM 5836 O O6 . GTM Q 3 . ? -30.840 36.013 -30.036 1.00 11.14 ? 456 GTM B O6 1 HETATM 5837 C C2 . BGC R 4 . ? -33.278 32.067 -31.735 1.00 16.26 ? 457 BGC B C2 1 HETATM 5838 C C3 . BGC R 4 . ? -32.663 31.153 -32.760 1.00 17.02 ? 457 BGC B C3 1 HETATM 5839 C C4 . BGC R 4 . ? -33.386 31.388 -34.090 1.00 18.16 ? 457 BGC B C4 1 HETATM 5840 C C5 . BGC R 4 . ? -33.407 32.894 -34.444 1.00 18.22 ? 457 BGC B C5 1 HETATM 5841 C C6 . BGC R 4 . ? -34.088 33.243 -35.758 1.00 18.72 ? 457 BGC B C6 1 HETATM 5842 C C1 . BGC R 4 . ? -33.315 33.546 -32.190 1.00 14.13 ? 457 BGC B C1 1 HETATM 5843 O O2 . BGC R 4 . ? -32.607 31.998 -30.482 1.00 16.85 ? 457 BGC B O2 1 HETATM 5844 O O3 . BGC R 4 . ? -32.707 29.742 -32.448 1.00 17.37 ? 457 BGC B O3 1 HETATM 5845 O O4 . BGC R 4 . ? -32.601 30.695 -35.037 1.00 22.03 ? 457 BGC B O4 1 HETATM 5846 O O5 . BGC R 4 . ? -33.979 33.709 -33.449 1.00 16.99 ? 457 BGC B O5 1 HETATM 5847 O O6 . BGC R 4 . ? -35.496 33.120 -35.664 1.00 20.84 ? 457 BGC B O6 1 HETATM 5848 C C2 . BGC S 4 . ? -32.356 29.423 -37.101 1.00 27.14 ? 458 BGC B C2 1 HETATM 5849 C C3 . BGC S 4 . ? -33.138 28.675 -38.183 1.00 31.94 ? 458 BGC B C3 1 HETATM 5850 C C4 . BGC S 4 . ? -34.013 27.596 -37.549 1.00 31.28 ? 458 BGC B C4 1 HETATM 5851 C C5 . BGC S 4 . ? -34.788 28.183 -36.362 1.00 30.63 ? 458 BGC B C5 1 HETATM 5852 C C6 . BGC S 4 . ? -35.667 27.169 -35.646 1.00 31.06 ? 458 BGC B C6 1 HETATM 5853 C C1 . BGC S 4 . ? -33.320 29.898 -35.988 1.00 26.27 ? 458 BGC B C1 1 HETATM 5854 O O2 . BGC S 4 . ? -31.601 30.475 -37.687 1.00 30.85 ? 458 BGC B O2 1 HETATM 5855 O O3 . BGC S 4 . ? -32.247 28.108 -39.143 1.00 29.18 ? 458 BGC B O3 1 HETATM 5856 O O4 . BGC S 4 . ? -34.810 27.035 -38.578 1.00 35.48 ? 458 BGC B O4 1 HETATM 5857 O O5 . BGC S 4 . ? -33.884 28.737 -35.395 1.00 26.46 ? 458 BGC B O5 1 HETATM 5858 O O6 . BGC S 4 . ? -36.467 27.847 -34.680 1.00 33.92 ? 458 BGC B O6 1 HETATM 5859 C C1 . GOL T 6 . ? -28.611 19.608 -21.717 1.00 25.13 ? 459 GOL B C1 1 HETATM 5860 O O1 . GOL T 6 . ? -28.477 18.781 -22.855 1.00 30.27 ? 459 GOL B O1 1 HETATM 5861 C C2 . GOL T 6 . ? -27.732 19.318 -20.531 1.00 26.15 ? 459 GOL B C2 1 HETATM 5862 O O2 . GOL T 6 . ? -26.390 18.851 -20.737 1.00 34.30 ? 459 GOL B O2 1 HETATM 5863 C C3 . GOL T 6 . ? -27.927 20.331 -19.417 1.00 23.02 ? 459 GOL B C3 1 HETATM 5864 O O3 . GOL T 6 . ? -27.609 21.621 -19.590 1.00 24.01 ? 459 GOL B O3 1 HETATM 5865 S S1 . FLG U 7 . ? -40.091 19.794 -34.330 0.50 27.66 ? 460 FLG B S1 1 HETATM 5866 C C21 . FLG U 7 . ? -38.499 20.493 -34.823 0.50 23.77 ? 460 FLG B C21 1 HETATM 5867 N N1 . FLG U 7 . ? -37.558 20.646 -33.883 0.50 24.21 ? 460 FLG B N1 1 HETATM 5868 C C17 . FLG U 7 . ? -36.309 21.133 -34.164 0.50 19.98 ? 460 FLG B C17 1 HETATM 5869 C C18 . FLG U 7 . ? -35.260 20.870 -33.286 0.50 20.74 ? 460 FLG B C18 1 HETATM 5870 C C19 . FLG U 7 . ? -33.969 21.347 -33.560 0.50 20.92 ? 460 FLG B C19 1 HETATM 5871 C C20 . FLG U 7 . ? -32.818 21.079 -32.650 0.50 20.90 ? 460 FLG B C20 1 HETATM 5872 O O4 . FLG U 7 . ? -31.724 21.710 -32.839 0.50 22.66 ? 460 FLG B O4 1 HETATM 5873 O O5 . FLG U 7 . ? -32.965 20.237 -31.742 0.50 22.24 ? 460 FLG B O5 1 HETATM 5874 C C16 . FLG U 7 . ? -36.074 21.895 -35.315 0.50 20.96 ? 460 FLG B C16 1 HETATM 5875 C C15 . FLG U 7 . ? -34.789 22.371 -35.586 0.50 20.69 ? 460 FLG B C15 1 HETATM 5876 C C14 . FLG U 7 . ? -33.742 22.095 -34.716 0.50 20.84 ? 460 FLG B C14 1 HETATM 5877 C C10 . FLG U 7 . ? -32.399 22.647 -35.088 0.50 18.13 ? 460 FLG B C10 1 HETATM 5878 C C9 . FLG U 7 . ? -31.453 21.882 -35.770 0.50 18.50 ? 460 FLG B C9 1 HETATM 5879 C C4 . FLG U 7 . ? -30.236 22.470 -36.106 0.50 14.50 ? 460 FLG B C4 1 HETATM 5880 O O2 . FLG U 7 . ? -30.011 23.679 -35.806 0.50 19.48 ? 460 FLG B O2 1 HETATM 5881 C C5 . FLG U 7 . ? -29.274 21.735 -36.790 0.50 14.04 ? 460 FLG B C5 1 HETATM 5882 C C8 . FLG U 7 . ? -31.690 20.551 -36.094 0.50 17.43 ? 460 FLG B C8 1 HETATM 5883 C C7 . FLG U 7 . ? -30.712 19.824 -36.756 0.50 15.78 ? 460 FLG B C7 1 HETATM 5884 C C6 . FLG U 7 . ? -29.511 20.394 -37.121 0.50 12.36 ? 460 FLG B C6 1 HETATM 5885 O O3 . FLG U 7 . ? -28.695 19.674 -37.778 0.50 14.27 ? 460 FLG B O3 1 HETATM 5886 C C11 . FLG U 7 . ? -32.065 23.983 -34.810 0.50 17.41 ? 460 FLG B C11 1 HETATM 5887 C C3 . FLG U 7 . ? -30.814 24.452 -35.202 0.50 16.58 ? 460 FLG B C3 1 HETATM 5888 C C2 . FLG U 7 . ? -30.463 25.781 -34.903 0.50 13.89 ? 460 FLG B C2 1 HETATM 5889 C C12 . FLG U 7 . ? -32.938 24.847 -34.133 0.50 15.27 ? 460 FLG B C12 1 HETATM 5890 C C13 . FLG U 7 . ? -32.597 26.151 -33.857 0.50 15.98 ? 460 FLG B C13 1 HETATM 5891 C C1 . FLG U 7 . ? -31.355 26.636 -34.230 0.50 16.08 ? 460 FLG B C1 1 HETATM 5892 O O1 . FLG U 7 . ? -31.092 27.910 -33.947 0.50 16.25 ? 460 FLG B O1 1 HETATM 5893 O O A HOH V 8 . ? 11.699 3.381 -16.176 0.50 23.67 ? 2001 HOH A O 1 HETATM 5894 O O . HOH V 8 . ? 17.785 3.499 -9.964 1.00 44.00 ? 2002 HOH A O 1 HETATM 5895 O O . HOH V 8 . ? 11.597 4.455 -13.216 1.00 29.55 ? 2003 HOH A O 1 HETATM 5896 O O . HOH V 8 . ? 14.334 6.771 -17.369 1.00 29.75 ? 2004 HOH A O 1 HETATM 5897 O O . HOH V 8 . ? 14.949 10.496 -8.579 1.00 27.89 ? 2005 HOH A O 1 HETATM 5898 O O . HOH V 8 . ? 17.763 8.217 -8.931 1.00 29.60 ? 2006 HOH A O 1 HETATM 5899 O O . HOH V 8 . ? 13.612 10.831 0.513 1.00 24.79 ? 2007 HOH A O 1 HETATM 5900 O O . HOH V 8 . ? 18.522 11.970 -1.865 1.00 33.64 ? 2008 HOH A O 1 HETATM 5901 O O . HOH V 8 . ? 13.908 20.698 6.240 1.00 36.83 ? 2009 HOH A O 1 HETATM 5902 O O . HOH V 8 . ? 12.598 16.361 6.136 1.00 35.10 ? 2010 HOH A O 1 HETATM 5903 O O A HOH V 8 . ? 9.799 15.640 6.846 0.50 24.78 ? 2011 HOH A O 1 HETATM 5904 O O . HOH V 8 . ? 12.950 13.118 4.276 1.00 29.19 ? 2012 HOH A O 1 HETATM 5905 O O . HOH V 8 . ? 5.252 12.122 2.253 1.00 15.30 ? 2013 HOH A O 1 HETATM 5906 O O . HOH V 8 . ? 2.168 18.445 7.781 1.00 15.13 ? 2014 HOH A O 1 HETATM 5907 O O . HOH V 8 . ? 3.493 11.575 8.165 1.00 13.16 ? 2015 HOH A O 1 HETATM 5908 O O A HOH V 8 . ? -6.833 13.058 12.908 0.50 16.86 ? 2016 HOH A O 1 HETATM 5909 O O . HOH V 8 . ? -7.546 7.476 14.110 1.00 34.34 ? 2017 HOH A O 1 HETATM 5910 O O . HOH V 8 . ? 0.817 18.107 22.244 1.00 27.99 ? 2018 HOH A O 1 HETATM 5911 O O . HOH V 8 . ? -8.596 14.136 17.913 1.00 30.44 ? 2019 HOH A O 1 HETATM 5912 O O . HOH V 8 . ? -8.225 13.985 23.260 1.00 18.51 ? 2020 HOH A O 1 HETATM 5913 O O . HOH V 8 . ? -6.749 12.213 24.678 1.00 22.64 ? 2021 HOH A O 1 HETATM 5914 O O B HOH V 8 . ? -27.594 15.384 -14.823 0.50 15.94 ? 2022 HOH A O 1 HETATM 5915 O O . HOH V 8 . ? 5.071 13.916 34.947 1.00 36.26 ? 2023 HOH A O 1 HETATM 5916 O O . HOH V 8 . ? 9.950 9.769 31.815 1.00 18.40 ? 2024 HOH A O 1 HETATM 5917 O O . HOH V 8 . ? 9.543 6.417 30.672 1.00 20.70 ? 2025 HOH A O 1 HETATM 5918 O O . HOH V 8 . ? 2.325 8.422 30.857 1.00 25.03 ? 2026 HOH A O 1 HETATM 5919 O O . HOH V 8 . ? 6.294 9.360 34.580 1.00 25.92 ? 2027 HOH A O 1 HETATM 5920 O O B HOH V 8 . ? 10.218 1.198 -16.898 0.50 24.89 ? 2028 HOH A O 1 HETATM 5921 O O . HOH V 8 . ? 12.951 4.699 -18.531 1.00 32.22 ? 2029 HOH A O 1 HETATM 5922 O O . HOH V 8 . ? 8.359 15.682 27.929 1.00 19.29 ? 2030 HOH A O 1 HETATM 5923 O O . HOH V 8 . ? 12.239 10.956 25.113 1.00 18.67 ? 2031 HOH A O 1 HETATM 5924 O O . HOH V 8 . ? 10.445 15.666 21.276 1.00 19.42 ? 2032 HOH A O 1 HETATM 5925 O O . HOH V 8 . ? 7.624 16.924 25.521 1.00 26.45 ? 2033 HOH A O 1 HETATM 5926 O O A HOH V 8 . ? 9.454 17.236 19.265 0.60 21.09 ? 2034 HOH A O 1 HETATM 5927 O O B HOH V 8 . ? 9.712 17.024 17.344 0.40 19.66 ? 2035 HOH A O 1 HETATM 5928 O O . HOH V 8 . ? 5.562 16.908 16.781 1.00 11.33 ? 2036 HOH A O 1 HETATM 5929 O O . HOH V 8 . ? 5.670 18.916 21.039 1.00 31.18 ? 2037 HOH A O 1 HETATM 5930 O O . HOH V 8 . ? 4.139 18.144 23.091 1.00 28.31 ? 2038 HOH A O 1 HETATM 5931 O O . HOH V 8 . ? 11.291 13.090 14.511 1.00 25.99 ? 2039 HOH A O 1 HETATM 5932 O O . HOH V 8 . ? 3.102 12.961 10.541 1.00 11.98 ? 2040 HOH A O 1 HETATM 5933 O O B HOH V 8 . ? 9.561 15.336 9.159 0.50 13.62 ? 2041 HOH A O 1 HETATM 5934 O O . HOH V 8 . ? 8.933 18.444 11.221 1.00 30.55 ? 2042 HOH A O 1 HETATM 5935 O O . HOH V 8 . ? 11.500 12.841 10.859 1.00 35.02 ? 2043 HOH A O 1 HETATM 5936 O O . HOH V 8 . ? 13.445 12.923 26.623 1.00 33.38 ? 2044 HOH A O 1 HETATM 5937 O O . HOH V 8 . ? 2.140 6.604 29.343 1.00 40.53 ? 2045 HOH A O 1 HETATM 5938 O O . HOH V 8 . ? 8.702 11.480 35.972 1.00 20.47 ? 2046 HOH A O 1 HETATM 5939 O O . HOH V 8 . ? 7.661 6.683 4.726 1.00 9.95 ? 2047 HOH A O 1 HETATM 5940 O O . HOH V 8 . ? 2.919 11.921 4.664 1.00 13.53 ? 2048 HOH A O 1 HETATM 5941 O O . HOH V 8 . ? 4.605 8.702 11.239 1.00 13.24 ? 2049 HOH A O 1 HETATM 5942 O O . HOH V 8 . ? 0.454 8.924 8.207 1.00 10.61 ? 2050 HOH A O 1 HETATM 5943 O O . HOH V 8 . ? -6.138 10.934 3.654 1.00 16.06 ? 2051 HOH A O 1 HETATM 5944 O O . HOH V 8 . ? 12.311 14.103 28.634 1.00 31.74 ? 2052 HOH A O 1 HETATM 5945 O O . HOH V 8 . ? -14.480 2.753 5.914 1.00 21.67 ? 2053 HOH A O 1 HETATM 5946 O O . HOH V 8 . ? -13.861 2.521 3.022 1.00 15.48 ? 2054 HOH A O 1 HETATM 5947 O O . HOH V 8 . ? -11.774 2.622 6.197 1.00 17.70 ? 2055 HOH A O 1 HETATM 5948 O O . HOH V 8 . ? -7.839 8.695 6.010 1.00 29.84 ? 2056 HOH A O 1 HETATM 5949 O O . HOH V 8 . ? -16.388 15.849 1.990 1.00 31.08 ? 2057 HOH A O 1 HETATM 5950 O O . HOH V 8 . ? -16.217 8.856 6.661 1.00 32.97 ? 2058 HOH A O 1 HETATM 5951 O O . HOH V 8 . ? -13.771 10.756 -5.446 1.00 15.88 ? 2059 HOH A O 1 HETATM 5952 O O . HOH V 8 . ? -13.826 13.181 -1.910 1.00 14.84 ? 2060 HOH A O 1 HETATM 5953 O O . HOH V 8 . ? -18.175 9.099 -0.477 1.00 25.81 ? 2061 HOH A O 1 HETATM 5954 O O A HOH V 8 . ? -8.278 17.174 9.978 0.50 22.69 ? 2062 HOH A O 1 HETATM 5955 O O . HOH V 8 . ? -15.664 14.712 -0.510 1.00 29.92 ? 2063 HOH A O 1 HETATM 5956 O O . HOH V 8 . ? -18.828 -9.257 5.314 1.00 41.96 ? 2064 HOH A O 1 HETATM 5957 O O A HOH V 8 . ? -0.685 31.032 4.578 0.50 21.89 ? 2065 HOH A O 1 HETATM 5958 O O B HOH V 8 . ? -3.357 27.989 3.835 0.50 18.86 ? 2066 HOH A O 1 HETATM 5959 O O A HOH V 8 . ? 10.151 28.213 -6.948 0.30 25.24 ? 2067 HOH A O 1 HETATM 5960 O O . HOH V 8 . ? -15.493 16.788 -6.663 1.00 26.68 ? 2068 HOH A O 1 HETATM 5961 O O . HOH V 8 . ? -11.568 19.428 -3.831 1.00 30.88 ? 2069 HOH A O 1 HETATM 5962 O O . HOH V 8 . ? -8.286 20.921 -6.046 1.00 38.13 ? 2070 HOH A O 1 HETATM 5963 O O B HOH V 8 . ? -8.909 18.249 8.229 0.50 22.14 ? 2071 HOH A O 1 HETATM 5964 O O . HOH V 8 . ? -8.402 21.573 1.638 1.00 34.26 ? 2072 HOH A O 1 HETATM 5965 O O . HOH V 8 . ? -22.218 -7.321 -0.461 1.00 31.85 ? 2073 HOH A O 1 HETATM 5966 O O . HOH V 8 . ? -10.844 19.446 4.606 1.00 35.02 ? 2074 HOH A O 1 HETATM 5967 O O . HOH V 8 . ? -18.668 -11.661 3.805 1.00 37.80 ? 2075 HOH A O 1 HETATM 5968 O O . HOH V 8 . ? -0.916 25.659 -2.308 1.00 17.49 ? 2076 HOH A O 1 HETATM 5969 O O . HOH V 8 . ? -16.796 -9.484 6.972 1.00 42.15 ? 2077 HOH A O 1 HETATM 5970 O O . HOH V 8 . ? -20.593 -6.000 8.124 1.00 40.84 ? 2078 HOH A O 1 HETATM 5971 O O . HOH V 8 . ? -18.551 -2.431 8.103 1.00 36.39 ? 2079 HOH A O 1 HETATM 5972 O O . HOH V 8 . ? -18.302 1.106 6.185 1.00 42.66 ? 2080 HOH A O 1 HETATM 5973 O O . HOH V 8 . ? -0.543 17.179 5.621 1.00 12.23 ? 2081 HOH A O 1 HETATM 5974 O O . HOH V 8 . ? -17.704 8.722 4.219 1.00 26.73 ? 2082 HOH A O 1 HETATM 5975 O O . HOH V 8 . ? -16.170 4.454 6.534 1.00 29.47 ? 2083 HOH A O 1 HETATM 5976 O O . HOH V 8 . ? -19.834 -5.332 -10.731 1.00 29.16 ? 2084 HOH A O 1 HETATM 5977 O O . HOH V 8 . ? -2.675 25.300 -4.293 1.00 21.52 ? 2085 HOH A O 1 HETATM 5978 O O . HOH V 8 . ? -4.129 22.843 -8.304 1.00 27.93 ? 2086 HOH A O 1 HETATM 5979 O O B HOH V 8 . ? 1.800 30.741 4.852 0.50 18.92 ? 2087 HOH A O 1 HETATM 5980 O O . HOH V 8 . ? 4.834 29.616 -0.463 1.00 25.91 ? 2088 HOH A O 1 HETATM 5981 O O A HOH V 8 . ? -1.586 29.024 3.058 0.50 19.77 ? 2089 HOH A O 1 HETATM 5982 O O . HOH V 8 . ? 3.676 30.578 2.041 1.00 41.37 ? 2090 HOH A O 1 HETATM 5983 O O . HOH V 8 . ? 1.219 32.034 0.961 1.00 43.64 ? 2091 HOH A O 1 HETATM 5984 O O . HOH V 8 . ? -0.184 25.493 3.075 1.00 30.05 ? 2092 HOH A O 1 HETATM 5985 O O . HOH V 8 . ? -19.377 7.784 -8.180 1.00 23.60 ? 2093 HOH A O 1 HETATM 5986 O O . HOH V 8 . ? 12.996 -23.107 -1.462 1.00 42.08 ? 2094 HOH A O 1 HETATM 5987 O O B HOH V 8 . ? 10.979 27.817 -5.148 0.70 25.32 ? 2095 HOH A O 1 HETATM 5988 O O . HOH V 8 . ? -15.964 14.957 -8.751 1.00 34.27 ? 2096 HOH A O 1 HETATM 5989 O O . HOH V 8 . ? -12.632 12.449 -14.506 1.00 30.20 ? 2097 HOH A O 1 HETATM 5990 O O . HOH V 8 . ? 17.486 -16.387 -9.174 1.00 40.09 ? 2098 HOH A O 1 HETATM 5991 O O . HOH V 8 . ? 0.558 27.824 -3.233 1.00 22.14 ? 2099 HOH A O 1 HETATM 5992 O O . HOH V 8 . ? 0.072 28.318 -6.435 1.00 21.67 ? 2100 HOH A O 1 HETATM 5993 O O . HOH V 8 . ? 3.530 30.329 -2.480 1.00 30.66 ? 2101 HOH A O 1 HETATM 5994 O O B HOH V 8 . ? -8.901 20.270 -8.483 0.50 35.52 ? 2102 HOH A O 1 HETATM 5995 O O . HOH V 8 . ? 12.234 -18.942 21.423 1.00 31.30 ? 2103 HOH A O 1 HETATM 5996 O O A HOH V 8 . ? 7.939 15.065 -10.965 0.50 24.27 ? 2104 HOH A O 1 HETATM 5997 O O . HOH V 8 . ? 7.538 23.967 -9.411 1.00 34.60 ? 2105 HOH A O 1 HETATM 5998 O O . HOH V 8 . ? 11.377 23.661 -3.551 1.00 26.79 ? 2106 HOH A O 1 HETATM 5999 O O . HOH V 8 . ? 5.553 -9.858 23.592 1.00 24.41 ? 2107 HOH A O 1 HETATM 6000 O O . HOH V 8 . ? 14.607 24.029 2.921 1.00 31.39 ? 2108 HOH A O 1 HETATM 6001 O O . HOH V 8 . ? 14.605 18.985 -4.566 1.00 25.48 ? 2109 HOH A O 1 HETATM 6002 O O . HOH V 8 . ? 7.623 17.634 -5.247 1.00 14.13 ? 2110 HOH A O 1 HETATM 6003 O O . HOH V 8 . ? 9.848 20.985 7.888 1.00 29.82 ? 2111 HOH A O 1 HETATM 6004 O O . HOH V 8 . ? 2.085 12.498 2.019 1.00 15.69 ? 2112 HOH A O 1 HETATM 6005 O O . HOH V 8 . ? -17.468 1.801 17.022 1.00 39.76 ? 2113 HOH A O 1 HETATM 6006 O O . HOH V 8 . ? 2.233 -3.279 28.994 1.00 39.89 ? 2114 HOH A O 1 HETATM 6007 O O B HOH V 8 . ? -19.290 -3.846 -13.393 0.70 27.96 ? 2115 HOH A O 1 HETATM 6008 O O . HOH V 8 . ? -8.352 -0.536 -17.891 1.00 25.27 ? 2116 HOH A O 1 HETATM 6009 O O . HOH V 8 . ? -14.516 -0.150 0.005 1.00 13.25 ? 2117 HOH A O 1 HETATM 6010 O O . HOH V 8 . ? -20.430 -7.487 -2.724 1.00 20.52 ? 2118 HOH A O 1 HETATM 6011 O O . HOH V 8 . ? -16.726 -10.709 -3.211 1.00 21.79 ? 2119 HOH A O 1 HETATM 6012 O O . HOH V 8 . ? -17.953 -5.780 1.109 1.00 38.11 ? 2120 HOH A O 1 HETATM 6013 O O . HOH V 8 . ? 10.558 10.469 -9.634 1.00 32.53 ? 2121 HOH A O 1 HETATM 6014 O O . HOH V 8 . ? -8.030 -6.873 8.406 1.00 17.85 ? 2122 HOH A O 1 HETATM 6015 O O . HOH V 8 . ? -13.611 -7.514 4.492 1.00 19.84 ? 2123 HOH A O 1 HETATM 6016 O O . HOH V 8 . ? -7.552 -9.675 3.845 1.00 14.15 ? 2124 HOH A O 1 HETATM 6017 O O . HOH V 8 . ? -7.775 -5.248 0.755 1.00 15.83 ? 2125 HOH A O 1 HETATM 6018 O O . HOH V 8 . ? -13.933 -13.300 3.999 1.00 30.18 ? 2126 HOH A O 1 HETATM 6019 O O . HOH V 8 . ? -9.191 -15.908 5.834 1.00 34.66 ? 2127 HOH A O 1 HETATM 6020 O O . HOH V 8 . ? -15.099 -10.534 5.493 1.00 34.03 ? 2128 HOH A O 1 HETATM 6021 O O . HOH V 8 . ? -16.434 -7.072 8.147 1.00 21.11 ? 2129 HOH A O 1 HETATM 6022 O O . HOH V 8 . ? -18.348 -5.037 7.912 1.00 28.78 ? 2130 HOH A O 1 HETATM 6023 O O . HOH V 8 . ? -15.871 0.409 6.553 1.00 29.31 ? 2131 HOH A O 1 HETATM 6024 O O . HOH V 8 . ? -18.819 -2.901 2.140 1.00 30.83 ? 2132 HOH A O 1 HETATM 6025 O O . HOH V 8 . ? -17.578 5.653 4.615 1.00 25.10 ? 2133 HOH A O 1 HETATM 6026 O O . HOH V 8 . ? -19.714 5.901 1.637 1.00 37.03 ? 2134 HOH A O 1 HETATM 6027 O O . HOH V 8 . ? -16.522 8.243 1.829 1.00 14.98 ? 2135 HOH A O 1 HETATM 6028 O O . HOH V 8 . ? 10.448 0.081 -14.672 1.00 42.56 ? 2136 HOH A O 1 HETATM 6029 O O . HOH V 8 . ? -20.223 6.215 -0.887 1.00 25.35 ? 2137 HOH A O 1 HETATM 6030 O O . HOH V 8 . ? -15.232 -3.135 1.098 1.00 18.73 ? 2138 HOH A O 1 HETATM 6031 O O . HOH V 8 . ? -20.148 -3.275 -8.780 1.00 18.74 ? 2139 HOH A O 1 HETATM 6032 O O . HOH V 8 . ? -27.315 -4.785 -3.613 1.00 22.82 ? 2140 HOH A O 1 HETATM 6033 O O . HOH V 8 . ? -20.956 0.219 -2.649 1.00 20.66 ? 2141 HOH A O 1 HETATM 6034 O O . HOH V 8 . ? -23.810 -3.685 -8.496 1.00 31.22 ? 2142 HOH A O 1 HETATM 6035 O O . HOH V 8 . ? -20.732 -0.902 -10.300 1.00 21.13 ? 2143 HOH A O 1 HETATM 6036 O O . HOH V 8 . ? -17.839 -0.525 -14.836 1.00 33.32 ? 2144 HOH A O 1 HETATM 6037 O O . HOH V 8 . ? 19.240 -3.897 9.124 0.50 28.80 ? 2145 HOH A O 1 HETATM 6038 O O . HOH V 8 . ? 19.395 -2.565 11.720 1.00 37.16 ? 2146 HOH A O 1 HETATM 6039 O O . HOH V 8 . ? 20.239 -19.428 12.597 1.00 28.75 ? 2147 HOH A O 1 HETATM 6040 O O . HOH V 8 . ? -20.505 5.471 -8.966 1.00 24.52 ? 2148 HOH A O 1 HETATM 6041 O O . HOH V 8 . ? -22.952 2.813 -3.886 1.00 35.19 ? 2149 HOH A O 1 HETATM 6042 O O . HOH V 8 . ? -23.337 4.250 -6.304 1.00 33.13 ? 2150 HOH A O 1 HETATM 6043 O O . HOH V 8 . ? -17.015 7.489 -6.511 1.00 15.83 ? 2151 HOH A O 1 HETATM 6044 O O . HOH V 8 . ? 17.378 -11.547 15.684 1.00 38.71 ? 2152 HOH A O 1 HETATM 6045 O O . HOH V 8 . ? -14.736 10.926 -10.798 1.00 12.69 ? 2153 HOH A O 1 HETATM 6046 O O . HOH V 8 . ? -15.595 9.649 -7.185 1.00 16.07 ? 2154 HOH A O 1 HETATM 6047 O O . HOH V 8 . ? 12.767 -18.723 -5.342 1.00 25.50 ? 2155 HOH A O 1 HETATM 6048 O O . HOH V 8 . ? 11.650 -21.085 -2.697 1.00 28.98 ? 2156 HOH A O 1 HETATM 6049 O O . HOH V 8 . ? 17.727 -15.803 -3.332 1.00 36.68 ? 2157 HOH A O 1 HETATM 6050 O O . HOH V 8 . ? 15.110 -17.638 -9.105 1.00 27.30 ? 2158 HOH A O 1 HETATM 6051 O O . HOH V 8 . ? -13.762 15.591 -11.373 0.50 22.13 ? 2159 HOH A O 1 HETATM 6052 O O . HOH V 8 . ? -13.108 12.945 -11.834 1.00 17.33 ? 2160 HOH A O 1 HETATM 6053 O O . HOH V 8 . ? 17.740 -11.329 -12.436 1.00 42.50 ? 2161 HOH A O 1 HETATM 6054 O O . HOH V 8 . ? -2.062 10.734 -19.495 1.00 35.29 ? 2162 HOH A O 1 HETATM 6055 O O . HOH V 8 . ? -7.052 18.011 -13.330 1.00 22.09 ? 2163 HOH A O 1 HETATM 6056 O O . HOH V 8 . ? -7.628 13.111 -17.447 1.00 33.13 ? 2164 HOH A O 1 HETATM 6057 O O . HOH V 8 . ? -10.006 11.677 -14.479 1.00 22.61 ? 2165 HOH A O 1 HETATM 6058 O O . HOH V 8 . ? -6.268 16.893 -17.885 1.00 41.22 ? 2166 HOH A O 1 HETATM 6059 O O . HOH V 8 . ? -2.001 20.605 -14.228 1.00 35.93 ? 2167 HOH A O 1 HETATM 6060 O O A HOH V 8 . ? -8.874 19.167 -9.730 0.50 24.27 ? 2168 HOH A O 1 HETATM 6061 O O . HOH V 8 . ? -6.480 22.325 -11.959 1.00 32.44 ? 2169 HOH A O 1 HETATM 6062 O O . HOH V 8 . ? 0.317 21.760 -11.652 1.00 35.27 ? 2170 HOH A O 1 HETATM 6063 O O . HOH V 8 . ? 6.637 -14.844 21.946 1.00 35.17 ? 2171 HOH A O 1 HETATM 6064 O O . HOH V 8 . ? 9.576 -15.990 18.890 1.00 26.89 ? 2172 HOH A O 1 HETATM 6065 O O . HOH V 8 . ? -2.394 25.256 -12.392 1.00 37.03 ? 2173 HOH A O 1 HETATM 6066 O O . HOH V 8 . ? 0.333 15.151 -7.462 1.00 18.38 ? 2174 HOH A O 1 HETATM 6067 O O B HOH V 8 . ? 6.693 16.873 -10.125 0.50 13.85 ? 2175 HOH A O 1 HETATM 6068 O O . HOH V 8 . ? -2.525 -17.207 8.095 1.00 34.27 ? 2176 HOH A O 1 HETATM 6069 O O . HOH V 8 . ? 5.027 24.613 -7.681 1.00 28.73 ? 2177 HOH A O 1 HETATM 6070 O O . HOH V 8 . ? 6.144 21.337 -5.687 1.00 21.50 ? 2178 HOH A O 1 HETATM 6071 O O . HOH V 8 . ? 8.164 -10.041 23.074 1.00 27.97 ? 2179 HOH A O 1 HETATM 6072 O O . HOH V 8 . ? 15.352 13.779 -8.008 1.00 35.56 ? 2180 HOH A O 1 HETATM 6073 O O A HOH V 8 . ? -36.999 16.140 -10.565 0.50 26.16 ? 2181 HOH A O 1 HETATM 6074 O O . HOH V 8 . ? 18.512 2.411 11.823 1.00 24.36 ? 2182 HOH A O 1 HETATM 6075 O O . HOH V 8 . ? 17.982 6.917 12.404 1.00 31.38 ? 2183 HOH A O 1 HETATM 6076 O O . HOH V 8 . ? 17.734 7.453 8.195 1.00 29.68 ? 2184 HOH A O 1 HETATM 6077 O O . HOH V 8 . ? 12.331 10.606 10.184 1.00 20.61 ? 2185 HOH A O 1 HETATM 6078 O O . HOH V 8 . ? 12.645 12.299 6.709 1.00 32.65 ? 2186 HOH A O 1 HETATM 6079 O O . HOH V 8 . ? 18.148 2.438 7.699 1.00 27.25 ? 2187 HOH A O 1 HETATM 6080 O O . HOH V 8 . ? 20.235 -1.348 7.169 1.00 44.45 ? 2188 HOH A O 1 HETATM 6081 O O . HOH V 8 . ? 23.112 -5.833 -1.197 1.00 28.93 ? 2189 HOH A O 1 HETATM 6082 O O . HOH V 8 . ? 25.730 -5.184 -0.685 1.00 30.10 ? 2190 HOH A O 1 HETATM 6083 O O . HOH V 8 . ? -1.977 -3.466 -6.014 1.00 17.80 ? 2191 HOH A O 1 HETATM 6084 O O . HOH V 8 . ? -6.892 -3.381 -1.040 1.00 14.03 ? 2192 HOH A O 1 HETATM 6085 O O . HOH V 8 . ? -6.925 -5.227 3.285 1.00 15.13 ? 2193 HOH A O 1 HETATM 6086 O O . HOH V 8 . ? -1.527 -4.823 4.827 1.00 16.88 ? 2194 HOH A O 1 HETATM 6087 O O . HOH V 8 . ? -13.347 -4.735 23.667 1.00 37.12 ? 2195 HOH A O 1 HETATM 6088 O O . HOH V 8 . ? -17.497 -13.102 14.962 1.00 34.39 ? 2196 HOH A O 1 HETATM 6089 O O . HOH V 8 . ? -19.818 -2.171 17.392 1.00 29.54 ? 2197 HOH A O 1 HETATM 6090 O O . HOH V 8 . ? -17.038 -14.230 11.099 1.00 39.92 ? 2198 HOH A O 1 HETATM 6091 O O . HOH V 8 . ? -5.479 -18.961 -3.892 1.00 22.43 ? 2199 HOH A O 1 HETATM 6092 O O . HOH V 8 . ? -9.568 -17.572 18.323 1.00 33.25 ? 2200 HOH A O 1 HETATM 6093 O O . HOH V 8 . ? -3.351 -20.979 -0.146 1.00 39.83 ? 2201 HOH A O 1 HETATM 6094 O O . HOH V 8 . ? -7.592 -17.334 4.672 1.00 27.52 ? 2202 HOH A O 1 HETATM 6095 O O . HOH V 8 . ? -1.941 -2.454 27.379 1.00 26.31 ? 2203 HOH A O 1 HETATM 6096 O O A HOH V 8 . ? -11.644 0.223 22.458 0.50 26.08 ? 2204 HOH A O 1 HETATM 6097 O O . HOH V 8 . ? -15.089 3.501 15.956 1.00 28.94 ? 2205 HOH A O 1 HETATM 6098 O O . HOH V 8 . ? -12.215 4.651 18.928 1.00 27.90 ? 2206 HOH A O 1 HETATM 6099 O O . HOH V 8 . ? -14.665 3.301 13.051 1.00 33.18 ? 2207 HOH A O 1 HETATM 6100 O O A HOH V 8 . ? -17.435 -16.528 -4.560 0.60 22.16 ? 2208 HOH A O 1 HETATM 6101 O O A HOH V 8 . ? -9.550 7.963 19.923 0.50 24.87 ? 2209 HOH A O 1 HETATM 6102 O O . HOH V 8 . ? -11.357 11.134 17.423 1.00 38.55 ? 2210 HOH A O 1 HETATM 6103 O O . HOH V 8 . ? -15.929 -14.909 2.695 1.00 21.70 ? 2211 HOH A O 1 HETATM 6104 O O . HOH V 8 . ? 0.567 -2.559 26.945 1.00 30.46 ? 2212 HOH A O 1 HETATM 6105 O O . HOH V 8 . ? 3.686 0.020 27.382 1.00 26.85 ? 2213 HOH A O 1 HETATM 6106 O O B HOH V 8 . ? -8.039 7.971 21.486 0.50 18.41 ? 2214 HOH A O 1 HETATM 6107 O O . HOH V 8 . ? -14.161 -13.330 -9.603 1.00 26.89 ? 2215 HOH A O 1 HETATM 6108 O O B HOH V 8 . ? -16.473 -17.255 -6.598 0.40 21.68 ? 2216 HOH A O 1 HETATM 6109 O O . HOH V 8 . ? 5.163 -2.229 25.980 1.00 32.94 ? 2217 HOH A O 1 HETATM 6110 O O . HOH V 8 . ? 0.383 -8.060 26.333 1.00 35.00 ? 2218 HOH A O 1 HETATM 6111 O O . HOH V 8 . ? 10.836 6.403 24.785 1.00 40.17 ? 2219 HOH A O 1 HETATM 6112 O O . HOH V 8 . ? 3.077 4.074 30.002 1.00 26.11 ? 2220 HOH A O 1 HETATM 6113 O O . HOH V 8 . ? 17.872 -0.171 12.854 1.00 36.59 ? 2221 HOH A O 1 HETATM 6114 O O . HOH V 8 . ? -11.036 -9.064 -14.747 1.00 32.84 ? 2222 HOH A O 1 HETATM 6115 O O . HOH V 8 . ? -16.642 -13.186 -10.675 1.00 37.16 ? 2223 HOH A O 1 HETATM 6116 O O . HOH V 8 . ? -15.405 -9.993 -9.218 1.00 22.32 ? 2224 HOH A O 1 HETATM 6117 O O . HOH V 8 . ? -8.303 -7.776 -0.180 1.00 18.21 ? 2225 HOH A O 1 HETATM 6118 O O . HOH V 8 . ? -5.448 10.624 6.276 1.00 24.53 ? 2226 HOH A O 1 HETATM 6119 O O . HOH V 8 . ? -6.430 -8.962 -17.973 1.00 34.84 ? 2227 HOH A O 1 HETATM 6120 O O . HOH V 8 . ? -9.345 -2.540 -16.332 1.00 24.00 ? 2228 HOH A O 1 HETATM 6121 O O . HOH V 8 . ? -11.881 -1.712 -16.773 1.00 36.24 ? 2229 HOH A O 1 HETATM 6122 O O A HOH V 8 . ? -17.335 -4.891 -14.050 0.30 21.98 ? 2230 HOH A O 1 HETATM 6123 O O . HOH V 8 . ? -4.675 -3.585 -6.453 1.00 20.08 ? 2231 HOH A O 1 HETATM 6124 O O . HOH V 8 . ? -7.514 8.478 -19.020 1.00 29.39 ? 2232 HOH A O 1 HETATM 6125 O O . HOH V 8 . ? -9.650 5.023 -19.940 1.00 32.35 ? 2233 HOH A O 1 HETATM 6126 O O . HOH V 8 . ? -0.772 3.907 -18.964 1.00 24.99 ? 2234 HOH A O 1 HETATM 6127 O O . HOH V 8 . ? 3.696 8.406 -16.756 1.00 17.57 ? 2235 HOH A O 1 HETATM 6128 O O . HOH V 8 . ? -2.133 7.886 -17.801 1.00 27.67 ? 2236 HOH A O 1 HETATM 6129 O O . HOH V 8 . ? 3.446 4.709 -19.671 1.00 18.84 ? 2237 HOH A O 1 HETATM 6130 O O . HOH V 8 . ? 8.701 10.628 -11.692 1.00 46.57 ? 2238 HOH A O 1 HETATM 6131 O O . HOH V 8 . ? 7.998 7.085 -11.594 1.00 27.02 ? 2239 HOH A O 1 HETATM 6132 O O . HOH V 8 . ? -1.847 -5.644 -4.275 1.00 17.29 ? 2240 HOH A O 1 HETATM 6133 O O . HOH V 8 . ? -1.427 -7.221 -2.054 1.00 14.32 ? 2241 HOH A O 1 HETATM 6134 O O . HOH V 8 . ? -0.040 -6.918 2.172 1.00 16.87 ? 2242 HOH A O 1 HETATM 6135 O O . HOH V 8 . ? 2.930 -5.104 1.628 1.00 13.44 ? 2243 HOH A O 1 HETATM 6136 O O . HOH V 8 . ? 6.272 -21.122 -5.735 1.00 22.99 ? 2244 HOH A O 1 HETATM 6137 O O . HOH V 8 . ? 9.892 -21.707 -4.833 1.00 25.78 ? 2245 HOH A O 1 HETATM 6138 O O . HOH V 8 . ? 10.857 -20.275 -11.416 1.00 28.60 ? 2246 HOH A O 1 HETATM 6139 O O B HOH V 8 . ? 7.210 -24.623 -6.261 0.50 10.76 ? 2247 HOH A O 1 HETATM 6140 O O . HOH V 8 . ? -0.689 -16.757 -10.318 1.00 23.43 ? 2248 HOH A O 1 HETATM 6141 O O . HOH V 8 . ? 3.526 -13.783 -15.594 1.00 26.48 ? 2249 HOH A O 1 HETATM 6142 O O . HOH V 8 . ? 7.187 0.530 -15.397 1.00 21.69 ? 2250 HOH A O 1 HETATM 6143 O O . HOH V 8 . ? 2.565 -11.822 -23.686 1.00 31.67 ? 2251 HOH A O 1 HETATM 6144 O O . HOH V 8 . ? 2.671 -4.940 -22.080 1.00 29.86 ? 2252 HOH A O 1 HETATM 6145 O O . HOH V 8 . ? -0.243 1.558 -20.218 1.00 23.78 ? 2253 HOH A O 1 HETATM 6146 O O . HOH V 8 . ? 4.348 -0.398 -23.124 1.00 32.24 ? 2254 HOH A O 1 HETATM 6147 O O . HOH V 8 . ? 2.281 2.512 -21.147 1.00 29.72 ? 2255 HOH A O 1 HETATM 6148 O O . HOH V 8 . ? 4.780 1.331 -21.397 1.00 30.44 ? 2256 HOH A O 1 HETATM 6149 O O B HOH V 8 . ? 10.381 4.280 -15.468 0.50 18.31 ? 2257 HOH A O 1 HETATM 6150 O O . HOH V 8 . ? 8.765 4.231 -12.424 1.00 24.57 ? 2258 HOH A O 1 HETATM 6151 O O . HOH V 8 . ? 10.458 6.919 -15.711 1.00 38.31 ? 2259 HOH A O 1 HETATM 6152 O O A HOH V 8 . ? 9.567 2.411 -15.838 0.50 19.19 ? 2260 HOH A O 1 HETATM 6153 O O . HOH V 8 . ? 4.712 8.329 -19.402 0.50 26.82 ? 2261 HOH A O 1 HETATM 6154 O O . HOH V 8 . ? 11.560 -0.092 -11.742 1.00 32.38 ? 2262 HOH A O 1 HETATM 6155 O O . HOH V 8 . ? -1.691 -5.868 10.151 1.00 13.91 ? 2263 HOH A O 1 HETATM 6156 O O . HOH V 8 . ? 4.429 -11.146 10.461 1.00 24.46 ? 2264 HOH A O 1 HETATM 6157 O O . HOH V 8 . ? 3.283 -2.067 10.093 1.00 12.07 ? 2265 HOH A O 1 HETATM 6158 O O B HOH V 8 . ? 15.750 -4.750 9.988 0.50 16.44 ? 2266 HOH A O 1 HETATM 6159 O O A HOH V 8 . ? 17.376 -4.631 9.833 0.50 27.13 ? 2267 HOH A O 1 HETATM 6160 O O . HOH V 8 . ? 20.469 -13.281 7.613 1.00 31.40 ? 2268 HOH A O 1 HETATM 6161 O O . HOH V 8 . ? 20.121 -9.553 13.627 1.00 34.04 ? 2269 HOH A O 1 HETATM 6162 O O . HOH V 8 . ? 23.208 -11.313 15.362 1.00 35.77 ? 2270 HOH A O 1 HETATM 6163 O O . HOH V 8 . ? 21.855 -17.672 11.806 1.00 29.50 ? 2271 HOH A O 1 HETATM 6164 O O . HOH V 8 . ? 25.815 -15.370 10.607 1.00 37.15 ? 2272 HOH A O 1 HETATM 6165 O O . HOH V 8 . ? 19.483 -13.070 15.140 1.00 33.07 ? 2273 HOH A O 1 HETATM 6166 O O . HOH V 8 . ? 15.611 -13.121 14.777 1.00 29.30 ? 2274 HOH A O 1 HETATM 6167 O O . HOH V 8 . ? 4.415 -19.360 12.375 1.00 21.92 ? 2275 HOH A O 1 HETATM 6168 O O . HOH V 8 . ? 9.724 -10.849 12.378 1.00 16.69 ? 2276 HOH A O 1 HETATM 6169 O O . HOH V 8 . ? 14.264 -21.585 9.869 1.00 32.61 ? 2277 HOH A O 1 HETATM 6170 O O . HOH V 8 . ? 13.741 -20.314 13.817 1.00 35.78 ? 2278 HOH A O 1 HETATM 6171 O O . HOH V 8 . ? 7.685 -21.860 13.092 1.00 30.26 ? 2279 HOH A O 1 HETATM 6172 O O . HOH V 8 . ? 12.742 -19.502 8.940 1.00 18.08 ? 2280 HOH A O 1 HETATM 6173 O O . HOH V 8 . ? 17.414 -18.638 4.241 1.00 25.03 ? 2281 HOH A O 1 HETATM 6174 O O . HOH V 8 . ? 12.636 -18.687 -2.545 1.00 20.73 ? 2282 HOH A O 1 HETATM 6175 O O . HOH V 8 . ? 10.989 -11.037 9.791 1.00 16.22 ? 2283 HOH A O 1 HETATM 6176 O O . HOH V 8 . ? 20.227 -18.068 7.563 1.00 37.69 ? 2284 HOH A O 1 HETATM 6177 O O . HOH V 8 . ? 18.904 -10.904 6.031 1.00 21.23 ? 2285 HOH A O 1 HETATM 6178 O O . HOH V 8 . ? 16.801 -14.866 -0.922 1.00 21.38 ? 2286 HOH A O 1 HETATM 6179 O O . HOH V 8 . ? 19.865 -11.716 3.607 1.00 33.81 ? 2287 HOH A O 1 HETATM 6180 O O . HOH V 8 . ? 18.574 -11.702 -6.004 1.00 33.84 ? 2288 HOH A O 1 HETATM 6181 O O . HOH V 8 . ? 23.041 -8.269 -1.759 1.00 36.36 ? 2289 HOH A O 1 HETATM 6182 O O . HOH V 8 . ? 20.616 -10.568 -4.458 1.00 43.09 ? 2290 HOH A O 1 HETATM 6183 O O . HOH V 8 . ? 19.004 -13.502 0.488 1.00 30.89 ? 2291 HOH A O 1 HETATM 6184 O O . HOH V 8 . ? 14.167 -16.891 -6.617 1.00 21.44 ? 2292 HOH A O 1 HETATM 6185 O O . HOH V 8 . ? 15.857 -13.059 -13.462 1.00 28.41 ? 2293 HOH A O 1 HETATM 6186 O O . HOH V 8 . ? 16.506 -8.572 -17.507 1.00 34.39 ? 2294 HOH A O 1 HETATM 6187 O O . HOH V 8 . ? 12.728 -15.479 -18.838 1.00 32.45 ? 2295 HOH A O 1 HETATM 6188 O O . HOH V 8 . ? 9.351 -17.311 -17.381 1.00 42.13 ? 2296 HOH A O 1 HETATM 6189 O O . HOH V 8 . ? 5.670 -8.374 -17.215 1.00 25.95 ? 2297 HOH A O 1 HETATM 6190 O O . HOH V 8 . ? 13.195 -1.600 11.411 1.00 14.91 ? 2298 HOH A O 1 HETATM 6191 O O . HOH V 8 . ? 8.839 -4.799 15.835 1.00 14.02 ? 2299 HOH A O 1 HETATM 6192 O O . HOH V 8 . ? 6.807 -2.515 9.747 1.00 9.66 ? 2300 HOH A O 1 HETATM 6193 O O . HOH V 8 . ? 12.738 -9.354 20.806 1.00 26.20 ? 2301 HOH A O 1 HETATM 6194 O O . HOH V 8 . ? 14.763 -7.553 20.993 1.00 29.65 ? 2302 HOH A O 1 HETATM 6195 O O . HOH V 8 . ? 15.416 -6.023 18.103 1.00 25.47 ? 2303 HOH A O 1 HETATM 6196 O O . HOH V 8 . ? 7.496 -14.348 19.281 1.00 24.93 ? 2304 HOH A O 1 HETATM 6197 O O . HOH V 8 . ? 4.236 -13.538 22.488 1.00 30.89 ? 2305 HOH A O 1 HETATM 6198 O O . HOH V 8 . ? 7.110 -10.216 11.860 1.00 14.26 ? 2306 HOH A O 1 HETATM 6199 O O . HOH V 8 . ? 5.092 -20.354 15.718 1.00 30.87 ? 2307 HOH A O 1 HETATM 6200 O O . HOH V 8 . ? 0.997 -11.697 9.688 1.00 13.57 ? 2308 HOH A O 1 HETATM 6201 O O . HOH V 8 . ? 0.824 -18.479 10.861 1.00 19.20 ? 2309 HOH A O 1 HETATM 6202 O O . HOH V 8 . ? -3.157 -14.991 8.973 1.00 26.41 ? 2310 HOH A O 1 HETATM 6203 O O . HOH V 8 . ? -1.547 -10.621 16.887 1.00 18.69 ? 2311 HOH A O 1 HETATM 6204 O O . HOH V 8 . ? -2.068 -1.516 16.408 1.00 14.89 ? 2312 HOH A O 1 HETATM 6205 O O . HOH V 8 . ? 4.523 -6.021 24.316 1.00 33.29 ? 2313 HOH A O 1 HETATM 6206 O O . HOH V 8 . ? 9.218 -8.757 20.943 1.00 16.62 ? 2314 HOH A O 1 HETATM 6207 O O . HOH V 8 . ? 16.793 4.926 8.469 1.00 17.82 ? 2315 HOH A O 1 HETATM 6208 O O . HOH V 8 . ? 13.918 10.440 12.190 1.00 29.28 ? 2316 HOH A O 1 HETATM 6209 O O . HOH V 8 . ? 12.577 4.335 15.132 1.00 23.09 ? 2317 HOH A O 1 HETATM 6210 O O . HOH V 8 . ? 14.959 9.916 16.951 1.00 30.35 ? 2318 HOH A O 1 HETATM 6211 O O . HOH V 8 . ? 16.748 4.641 11.255 1.00 18.40 ? 2319 HOH A O 1 HETATM 6212 O O . HOH V 8 . ? 12.763 9.938 7.815 1.00 25.24 ? 2320 HOH A O 1 HETATM 6213 O O . HOH V 8 . ? 17.995 3.253 -2.784 1.00 19.63 ? 2321 HOH A O 1 HETATM 6214 O O . HOH V 8 . ? 16.599 9.577 2.108 1.00 25.49 ? 2322 HOH A O 1 HETATM 6215 O O B HOH V 8 . ? 19.913 1.992 5.751 0.70 24.64 ? 2323 HOH A O 1 HETATM 6216 O O A HOH V 8 . ? 20.434 3.580 6.002 0.30 17.17 ? 2324 HOH A O 1 HETATM 6217 O O . HOH V 8 . ? 21.727 3.279 -0.786 1.00 39.53 ? 2325 HOH A O 1 HETATM 6218 O O . HOH V 8 . ? 21.139 -2.863 3.318 1.00 30.23 ? 2326 HOH A O 1 HETATM 6219 O O . HOH V 8 . ? 25.584 -2.446 0.451 1.00 44.40 ? 2327 HOH A O 1 HETATM 6220 O O . HOH V 8 . ? 21.981 -5.103 1.468 1.00 32.81 ? 2328 HOH A O 1 HETATM 6221 O O . HOH V 8 . ? 18.970 1.238 -4.177 1.00 34.00 ? 2329 HOH A O 1 HETATM 6222 O O . HOH V 8 . ? 17.129 2.620 -6.212 1.00 24.01 ? 2330 HOH A O 1 HETATM 6223 O O . HOH V 8 . ? 4.415 0.442 9.666 1.00 11.53 ? 2331 HOH A O 1 HETATM 6224 O O . HOH V 8 . ? 4.853 3.340 12.268 1.00 13.51 ? 2332 HOH A O 1 HETATM 6225 O O . HOH V 8 . ? -0.706 0.399 14.955 1.00 13.22 ? 2333 HOH A O 1 HETATM 6226 O O A HOH V 8 . ? -2.154 9.067 9.110 0.40 7.82 ? 2334 HOH A O 1 HETATM 6227 O O . HOH V 8 . ? -3.749 -2.296 9.703 1.00 16.69 ? 2335 HOH A O 1 HETATM 6228 O O . HOH V 8 . ? -6.832 -4.538 9.227 1.00 15.21 ? 2336 HOH A O 1 HETATM 6229 O O . HOH V 8 . ? -11.293 -7.167 14.238 1.00 16.82 ? 2337 HOH A O 1 HETATM 6230 O O . HOH V 8 . ? -11.218 -6.492 23.941 1.00 27.49 ? 2338 HOH A O 1 HETATM 6231 O O . HOH V 8 . ? -11.227 -9.980 22.057 1.00 23.56 ? 2339 HOH A O 1 HETATM 6232 O O . HOH V 8 . ? -19.997 -3.020 22.119 1.00 32.34 ? 2340 HOH A O 1 HETATM 6233 O O . HOH V 8 . ? -14.784 -8.423 23.444 1.00 19.85 ? 2341 HOH A O 1 HETATM 6234 O O . HOH V 8 . ? -17.274 -12.938 17.792 1.00 25.38 ? 2342 HOH A O 1 HETATM 6235 O O . HOH V 8 . ? -19.018 -10.051 15.968 1.00 25.01 ? 2343 HOH A O 1 HETATM 6236 O O . HOH V 8 . ? -21.053 -4.132 19.155 1.00 37.23 ? 2344 HOH A O 1 HETATM 6237 O O . HOH V 8 . ? -20.129 -2.908 14.862 1.00 26.63 ? 2345 HOH A O 1 HETATM 6238 O O . HOH V 8 . ? -20.174 -8.365 10.139 1.00 29.33 ? 2346 HOH A O 1 HETATM 6239 O O . HOH V 8 . ? -11.256 0.856 8.197 1.00 13.00 ? 2347 HOH A O 1 HETATM 6240 O O . HOH V 8 . ? -12.759 -14.895 19.047 1.00 25.38 ? 2348 HOH A O 1 HETATM 6241 O O . HOH V 8 . ? -15.507 -13.006 13.298 1.00 24.99 ? 2349 HOH A O 1 HETATM 6242 O O . HOH V 8 . ? -17.141 -10.093 12.059 1.00 19.86 ? 2350 HOH A O 1 HETATM 6243 O O . HOH V 8 . ? -9.088 -13.151 8.963 1.00 19.07 ? 2351 HOH A O 1 HETATM 6244 O O . HOH V 8 . ? -9.390 -15.038 18.822 1.00 21.42 ? 2352 HOH A O 1 HETATM 6245 O O . HOH V 8 . ? -13.213 -13.926 12.330 1.00 22.38 ? 2353 HOH A O 1 HETATM 6246 O O . HOH V 8 . ? -3.352 -11.471 15.077 1.00 13.07 ? 2354 HOH A O 1 HETATM 6247 O O . HOH V 8 . ? -6.340 -6.667 19.143 1.00 14.35 ? 2355 HOH A O 1 HETATM 6248 O O . HOH V 8 . ? -3.788 -7.282 25.836 1.00 24.53 ? 2356 HOH A O 1 HETATM 6249 O O . HOH V 8 . ? -4.330 -2.261 26.077 1.00 32.12 ? 2357 HOH A O 1 HETATM 6250 O O . HOH V 8 . ? -6.278 -0.599 25.243 1.00 26.64 ? 2358 HOH A O 1 HETATM 6251 O O B HOH V 8 . ? -9.490 0.502 23.000 0.50 25.01 ? 2359 HOH A O 1 HETATM 6252 O O . HOH V 8 . ? -12.664 -2.709 21.853 1.00 31.58 ? 2360 HOH A O 1 HETATM 6253 O O . HOH V 8 . ? -13.467 2.259 17.746 1.00 19.55 ? 2361 HOH A O 1 HETATM 6254 O O . HOH V 8 . ? -15.508 -1.911 17.605 1.00 25.89 ? 2362 HOH A O 1 HETATM 6255 O O . HOH V 8 . ? -17.458 -3.018 13.443 1.00 15.79 ? 2363 HOH A O 1 HETATM 6256 O O . HOH V 8 . ? -12.015 -3.195 12.929 1.00 13.23 ? 2364 HOH A O 1 HETATM 6257 O O . HOH V 8 . ? -12.329 3.363 11.761 1.00 19.51 ? 2365 HOH A O 1 HETATM 6258 O O . HOH V 8 . ? -12.961 8.819 15.279 1.00 38.46 ? 2366 HOH A O 1 HETATM 6259 O O . HOH V 8 . ? -9.327 7.600 16.740 1.00 22.19 ? 2367 HOH A O 1 HETATM 6260 O O . HOH V 8 . ? -9.808 5.284 19.588 1.00 22.75 ? 2368 HOH A O 1 HETATM 6261 O O . HOH V 8 . ? -7.520 2.558 22.385 1.00 30.64 ? 2369 HOH A O 1 HETATM 6262 O O . HOH V 8 . ? -6.688 4.902 22.345 1.00 21.87 ? 2370 HOH A O 1 HETATM 6263 O O . HOH V 8 . ? -5.378 2.124 24.306 1.00 14.88 ? 2371 HOH A O 1 HETATM 6264 O O . HOH V 8 . ? 1.176 0.067 26.373 1.00 20.55 ? 2372 HOH A O 1 HETATM 6265 O O . HOH V 8 . ? -3.435 5.191 27.054 1.00 24.90 ? 2373 HOH A O 1 HETATM 6266 O O . HOH V 8 . ? 2.317 -4.064 25.050 1.00 21.36 ? 2374 HOH A O 1 HETATM 6267 O O . HOH V 8 . ? 11.879 5.290 22.120 1.00 24.06 ? 2375 HOH A O 1 HETATM 6268 O O . HOH V 8 . ? 5.101 2.058 29.043 1.00 28.43 ? 2376 HOH A O 1 HETATM 6269 O O . HOH V 8 . ? 11.096 4.336 26.828 1.00 34.88 ? 2377 HOH A O 1 HETATM 6270 O O . HOH V 8 . ? 7.588 5.319 32.567 1.00 21.20 ? 2378 HOH A O 1 HETATM 6271 O O . HOH V 8 . ? 11.782 1.456 26.588 1.00 27.55 ? 2379 HOH A O 1 HETATM 6272 O O . HOH V 8 . ? 4.779 5.439 31.807 1.00 32.76 ? 2380 HOH A O 1 HETATM 6273 O O . HOH V 8 . ? 6.699 -5.137 24.571 1.00 27.76 ? 2381 HOH A O 1 HETATM 6274 O O . HOH V 8 . ? 13.310 -2.859 20.580 1.00 25.50 ? 2382 HOH A O 1 HETATM 6275 O O . HOH V 8 . ? 16.647 0.269 20.844 1.00 34.00 ? 2383 HOH A O 1 HETATM 6276 O O . HOH V 8 . ? 13.327 1.978 22.687 1.00 29.03 ? 2384 HOH A O 1 HETATM 6277 O O . HOH V 8 . ? 15.371 -1.196 13.325 1.00 21.50 ? 2385 HOH A O 1 HETATM 6278 O O . HOH V 8 . ? 15.229 -3.864 19.448 1.00 26.43 ? 2386 HOH A O 1 HETATM 6279 O O . HOH V 8 . ? 12.539 11.937 22.500 1.00 23.33 ? 2387 HOH A O 1 HETATM 6280 O O . HOH V 8 . ? -21.238 9.191 -6.777 1.00 33.83 ? 2388 HOH A O 1 HETATM 6281 O O . HOH V 8 . ? -22.476 7.167 -1.394 1.00 37.13 ? 2389 HOH A O 1 HETATM 6282 O O . HOH V 8 . ? -21.353 11.658 -2.671 1.00 35.78 ? 2390 HOH A O 1 HETATM 6283 O O . HOH V 8 . ? -18.012 13.513 -8.660 1.00 34.66 ? 2391 HOH A O 1 HETATM 6284 O O . HOH V 8 . ? 0.772 -23.987 1.373 1.00 38.20 ? 2392 HOH A O 1 HETATM 6285 O O . HOH V 8 . ? 6.173 -23.150 1.145 1.00 25.95 ? 2393 HOH A O 1 HETATM 6286 O O . HOH V 8 . ? 5.438 -23.077 10.244 1.00 31.62 ? 2394 HOH A O 1 HETATM 6287 O O . HOH V 8 . ? -1.587 -21.455 1.857 1.00 26.19 ? 2395 HOH A O 1 HETATM 6288 O O . HOH V 8 . ? -3.833 -17.361 2.744 1.00 22.54 ? 2396 HOH A O 1 HETATM 6289 O O . HOH V 8 . ? -5.577 -15.261 7.153 1.00 21.43 ? 2397 HOH A O 1 HETATM 6290 O O . HOH V 8 . ? 1.347 -7.080 4.541 1.00 13.45 ? 2398 HOH A O 1 HETATM 6291 O O . HOH V 8 . ? -6.497 -12.660 7.599 1.00 18.31 ? 2399 HOH A O 1 HETATM 6292 O O . HOH V 8 . ? -3.963 -4.797 8.747 1.00 18.51 ? 2400 HOH A O 1 HETATM 6293 O O . HOH V 8 . ? -3.725 8.577 6.785 1.00 12.34 ? 2401 HOH A O 1 HETATM 6294 O O B HOH V 8 . ? -6.875 11.484 11.747 0.50 15.77 ? 2402 HOH A O 1 HETATM 6295 O O B HOH V 8 . ? -3.941 9.952 10.196 0.60 9.55 ? 2403 HOH A O 1 HETATM 6296 O O . HOH V 8 . ? 6.827 20.120 11.501 1.00 28.38 ? 2404 HOH A O 1 HETATM 6297 O O . HOH W 8 . ? -41.294 34.320 -4.679 1.00 29.50 ? 2001 HOH B O 1 HETATM 6298 O O . HOH W 8 . ? -35.790 32.097 0.171 1.00 30.27 ? 2002 HOH B O 1 HETATM 6299 O O . HOH W 8 . ? -34.780 29.965 -2.050 1.00 24.25 ? 2003 HOH B O 1 HETATM 6300 O O . HOH W 8 . ? -36.096 27.843 -4.462 1.00 33.49 ? 2004 HOH B O 1 HETATM 6301 O O . HOH W 8 . ? -29.369 27.210 -10.789 1.00 24.87 ? 2005 HOH B O 1 HETATM 6302 O O . HOH W 8 . ? -25.731 21.608 -14.824 1.00 33.74 ? 2006 HOH B O 1 HETATM 6303 O O A HOH W 8 . ? -27.119 15.606 -12.623 0.50 15.99 ? 2007 HOH B O 1 HETATM 6304 O O . HOH W 8 . ? -26.938 25.153 -13.369 1.00 33.33 ? 2008 HOH B O 1 HETATM 6305 O O . HOH W 8 . ? -32.584 26.390 -18.732 1.00 14.77 ? 2009 HOH B O 1 HETATM 6306 O O . HOH W 8 . ? -30.077 20.127 -24.615 1.00 14.06 ? 2010 HOH B O 1 HETATM 6307 O O . HOH W 8 . ? -28.557 26.956 -23.512 1.00 14.40 ? 2011 HOH B O 1 HETATM 6308 O O . HOH W 8 . ? -26.915 25.521 -25.080 1.00 12.21 ? 2012 HOH B O 1 HETATM 6309 O O . HOH W 8 . ? -26.355 19.305 -30.724 1.00 14.03 ? 2013 HOH B O 1 HETATM 6310 O O . HOH W 8 . ? -29.561 31.498 -35.804 1.00 30.83 ? 2014 HOH B O 1 HETATM 6311 O O . HOH W 8 . ? -27.596 24.332 -38.758 1.00 31.37 ? 2015 HOH B O 1 HETATM 6312 O O . HOH W 8 . ? -22.248 24.712 -41.520 1.00 17.80 ? 2016 HOH B O 1 HETATM 6313 O O . HOH W 8 . ? -13.352 22.731 -40.317 1.00 29.06 ? 2017 HOH B O 1 HETATM 6314 O O . HOH W 8 . ? -15.456 26.076 -42.688 1.00 25.38 ? 2018 HOH B O 1 HETATM 6315 O O . HOH W 8 . ? -19.869 32.514 -41.567 1.00 38.56 ? 2019 HOH B O 1 HETATM 6316 O O . HOH W 8 . ? -20.280 26.486 -41.122 1.00 31.36 ? 2020 HOH B O 1 HETATM 6317 O O . HOH W 8 . ? -3.968 28.568 -30.623 1.00 28.74 ? 2021 HOH B O 1 HETATM 6318 O O . HOH W 8 . ? -6.774 30.366 -29.444 1.00 30.72 ? 2022 HOH B O 1 HETATM 6319 O O B HOH W 8 . ? -9.504 30.037 -36.274 0.70 19.81 ? 2023 HOH B O 1 HETATM 6320 O O . HOH W 8 . ? -9.779 21.328 -30.303 1.00 24.80 ? 2024 HOH B O 1 HETATM 6321 O O . HOH W 8 . ? -9.498 25.929 -25.324 1.00 31.61 ? 2025 HOH B O 1 HETATM 6322 O O . HOH W 8 . ? -14.161 21.674 -24.781 1.00 23.34 ? 2026 HOH B O 1 HETATM 6323 O O A HOH W 8 . ? 8.575 19.077 15.742 0.40 16.54 ? 2027 HOH B O 1 HETATM 6324 O O . HOH W 8 . ? -18.168 20.710 -23.270 1.00 32.59 ? 2028 HOH B O 1 HETATM 6325 O O . HOH W 8 . ? -16.307 20.216 -24.720 1.00 32.65 ? 2029 HOH B O 1 HETATM 6326 O O . HOH W 8 . ? -18.915 24.433 -20.436 1.00 30.17 ? 2030 HOH B O 1 HETATM 6327 O O . HOH W 8 . ? -22.127 24.900 -18.429 1.00 30.87 ? 2031 HOH B O 1 HETATM 6328 O O . HOH W 8 . ? -20.635 21.045 -26.698 1.00 13.75 ? 2032 HOH B O 1 HETATM 6329 O O . HOH W 8 . ? -24.659 22.731 -18.924 1.00 24.65 ? 2033 HOH B O 1 HETATM 6330 O O A HOH W 8 . ? -11.017 31.027 -36.700 0.30 19.14 ? 2034 HOH B O 1 HETATM 6331 O O . HOH W 8 . ? -12.392 20.385 -29.791 1.00 26.97 ? 2035 HOH B O 1 HETATM 6332 O O . HOH W 8 . ? -28.859 31.687 -17.973 1.00 12.84 ? 2036 HOH B O 1 HETATM 6333 O O . HOH W 8 . ? -12.519 22.616 -23.169 1.00 36.15 ? 2037 HOH B O 1 HETATM 6334 O O . HOH W 8 . ? -25.288 29.614 -24.114 1.00 13.97 ? 2038 HOH B O 1 HETATM 6335 O O . HOH W 8 . ? -31.762 26.769 -22.139 1.00 12.24 ? 2039 HOH B O 1 HETATM 6336 O O B HOH W 8 . ? 8.912 19.814 13.962 0.60 17.68 ? 2040 HOH B O 1 HETATM 6337 O O . HOH W 8 . ? -30.103 29.767 -25.948 1.00 11.01 ? 2041 HOH B O 1 HETATM 6338 O O . HOH W 8 . ? -37.491 28.300 -29.083 1.00 17.88 ? 2042 HOH B O 1 HETATM 6339 O O . HOH W 8 . ? -19.767 27.105 -16.918 1.00 41.25 ? 2043 HOH B O 1 HETATM 6340 O O . HOH W 8 . ? -38.042 36.923 -34.862 1.00 20.68 ? 2044 HOH B O 1 HETATM 6341 O O A HOH W 8 . ? -36.282 30.407 -31.870 0.40 13.13 ? 2045 HOH B O 1 HETATM 6342 O O . HOH W 8 . ? -49.077 29.284 -30.322 1.00 18.63 ? 2046 HOH B O 1 HETATM 6343 O O . HOH W 8 . ? -47.268 31.096 -36.697 1.00 30.88 ? 2047 HOH B O 1 HETATM 6344 O O . HOH W 8 . ? -46.079 25.222 -34.783 1.00 31.88 ? 2048 HOH B O 1 HETATM 6345 O O . HOH W 8 . ? -58.146 45.038 -30.693 1.00 40.68 ? 2049 HOH B O 1 HETATM 6346 O O . HOH W 8 . ? -47.224 20.314 -29.683 1.00 28.14 ? 2050 HOH B O 1 HETATM 6347 O O . HOH W 8 . ? -51.668 23.617 -31.270 1.00 29.30 ? 2051 HOH B O 1 HETATM 6348 O O . HOH W 8 . ? -39.537 7.267 -20.156 1.00 41.23 ? 2052 HOH B O 1 HETATM 6349 O O . HOH W 8 . ? -41.088 17.839 -30.118 1.00 31.82 ? 2053 HOH B O 1 HETATM 6350 O O . HOH W 8 . ? -40.562 13.499 -22.011 1.00 18.99 ? 2054 HOH B O 1 HETATM 6351 O O . HOH W 8 . ? -43.777 15.350 -24.911 1.00 32.25 ? 2055 HOH B O 1 HETATM 6352 O O . HOH W 8 . ? -33.277 21.631 -25.579 1.00 12.96 ? 2056 HOH B O 1 HETATM 6353 O O . HOH W 8 . ? -39.779 37.061 -36.818 1.00 20.56 ? 2057 HOH B O 1 HETATM 6354 O O . HOH W 8 . ? -43.125 31.454 -38.836 1.00 26.15 ? 2058 HOH B O 1 HETATM 6355 O O . HOH W 8 . ? -40.335 35.340 -39.007 1.00 32.07 ? 2059 HOH B O 1 HETATM 6356 O O . HOH W 8 . ? -55.972 46.052 -31.675 1.00 28.64 ? 2060 HOH B O 1 HETATM 6357 O O . HOH W 8 . ? -43.116 13.994 -22.224 1.00 26.03 ? 2061 HOH B O 1 HETATM 6358 O O . HOH W 8 . ? -36.187 9.089 -18.251 1.00 23.33 ? 2062 HOH B O 1 HETATM 6359 O O . HOH W 8 . ? -35.713 13.385 -24.352 1.00 32.68 ? 2063 HOH B O 1 HETATM 6360 O O . HOH W 8 . ? -30.899 12.220 -15.237 1.00 23.85 ? 2064 HOH B O 1 HETATM 6361 O O . HOH W 8 . ? -36.710 11.034 -10.268 1.00 35.42 ? 2065 HOH B O 1 HETATM 6362 O O . HOH W 8 . ? -40.634 11.343 -20.341 1.00 23.46 ? 2066 HOH B O 1 HETATM 6363 O O . HOH W 8 . ? -43.736 10.904 -18.855 1.00 24.29 ? 2067 HOH B O 1 HETATM 6364 O O . HOH W 8 . ? -38.640 8.545 -18.302 1.00 32.48 ? 2068 HOH B O 1 HETATM 6365 O O . HOH W 8 . ? -54.878 23.836 -20.008 1.00 28.56 ? 2069 HOH B O 1 HETATM 6366 O O . HOH W 8 . ? -13.071 47.691 -29.405 1.00 31.30 ? 2070 HOH B O 1 HETATM 6367 O O . HOH W 8 . ? -34.739 14.611 -10.831 1.00 30.70 ? 2071 HOH B O 1 HETATM 6368 O O . HOH W 8 . ? -28.021 13.761 -11.566 0.50 19.69 ? 2072 HOH B O 1 HETATM 6369 O O . HOH W 8 . ? -30.739 15.809 -2.218 1.00 37.07 ? 2073 HOH B O 1 HETATM 6370 O O . HOH W 8 . ? -33.983 19.173 -7.422 1.00 26.68 ? 2074 HOH B O 1 HETATM 6371 O O . HOH W 8 . ? -37.877 20.995 -12.902 1.00 14.39 ? 2075 HOH B O 1 HETATM 6372 O O B HOH W 8 . ? -38.375 17.435 -10.690 0.50 21.89 ? 2076 HOH B O 1 HETATM 6373 O O . HOH W 8 . ? -34.524 26.342 -21.439 1.00 16.92 ? 2077 HOH B O 1 HETATM 6374 O O . HOH W 8 . ? -40.295 57.236 -36.118 1.00 28.80 ? 2078 HOH B O 1 HETATM 6375 O O . HOH W 8 . ? -14.520 40.474 -38.479 1.00 29.61 ? 2079 HOH B O 1 HETATM 6376 O O . HOH W 8 . ? -55.848 40.617 -18.476 1.00 28.31 ? 2080 HOH B O 1 HETATM 6377 O O . HOH W 8 . ? -44.429 40.168 -33.365 1.00 16.18 ? 2081 HOH B O 1 HETATM 6378 O O . HOH W 8 . ? -47.587 51.082 -33.160 1.00 22.44 ? 2082 HOH B O 1 HETATM 6379 O O . HOH W 8 . ? -39.714 47.276 -34.957 1.00 22.59 ? 2083 HOH B O 1 HETATM 6380 O O . HOH W 8 . ? -41.234 28.616 -9.180 1.00 44.90 ? 2084 HOH B O 1 HETATM 6381 O O . HOH W 8 . ? -33.459 46.026 -32.600 1.00 20.39 ? 2085 HOH B O 1 HETATM 6382 O O . HOH W 8 . ? -39.863 44.695 -28.117 1.00 19.16 ? 2086 HOH B O 1 HETATM 6383 O O . HOH W 8 . ? -39.950 52.983 -34.857 1.00 28.17 ? 2087 HOH B O 1 HETATM 6384 O O . HOH W 8 . ? -35.474 55.236 -31.789 1.00 24.71 ? 2088 HOH B O 1 HETATM 6385 O O . HOH W 8 . ? -37.432 54.052 -35.172 1.00 33.81 ? 2089 HOH B O 1 HETATM 6386 O O . HOH W 8 . ? -39.443 50.443 -36.399 1.00 34.73 ? 2090 HOH B O 1 HETATM 6387 O O . HOH W 8 . ? -38.244 46.774 -39.394 1.00 20.57 ? 2091 HOH B O 1 HETATM 6388 O O . HOH W 8 . ? -32.186 42.460 -38.471 1.00 12.75 ? 2092 HOH B O 1 HETATM 6389 O O . HOH W 8 . ? -39.754 39.433 -38.275 1.00 34.51 ? 2093 HOH B O 1 HETATM 6390 O O . HOH W 8 . ? -39.677 45.133 -40.897 1.00 33.19 ? 2094 HOH B O 1 HETATM 6391 O O . HOH W 8 . ? -44.843 42.976 -38.350 1.00 28.72 ? 2095 HOH B O 1 HETATM 6392 O O . HOH W 8 . ? -41.144 41.173 -40.419 1.00 35.03 ? 2096 HOH B O 1 HETATM 6393 O O . HOH W 8 . ? -42.674 34.388 -38.911 1.00 29.35 ? 2097 HOH B O 1 HETATM 6394 O O . HOH W 8 . ? -46.713 42.071 -39.865 1.00 34.56 ? 2098 HOH B O 1 HETATM 6395 O O . HOH W 8 . ? -44.561 31.884 -36.457 1.00 18.66 ? 2099 HOH B O 1 HETATM 6396 O O . HOH W 8 . ? -41.766 37.336 -34.854 1.00 14.83 ? 2100 HOH B O 1 HETATM 6397 O O . HOH W 8 . ? -48.261 33.908 -37.884 1.00 28.74 ? 2101 HOH B O 1 HETATM 6398 O O . HOH W 8 . ? -43.754 43.034 -34.817 1.00 23.47 ? 2102 HOH B O 1 HETATM 6399 O O . HOH W 8 . ? -54.569 44.102 -32.943 1.00 20.04 ? 2103 HOH B O 1 HETATM 6400 O O . HOH W 8 . ? -49.564 48.115 -36.512 1.00 23.76 ? 2104 HOH B O 1 HETATM 6401 O O . HOH W 8 . ? -49.659 38.543 -39.673 1.00 32.48 ? 2105 HOH B O 1 HETATM 6402 O O . HOH W 8 . ? -50.109 40.440 -37.489 1.00 23.60 ? 2106 HOH B O 1 HETATM 6403 O O . HOH W 8 . ? -61.821 40.049 -32.083 1.00 27.14 ? 2107 HOH B O 1 HETATM 6404 O O . HOH W 8 . ? -57.035 35.426 -29.480 1.00 23.92 ? 2108 HOH B O 1 HETATM 6405 O O . HOH W 8 . ? -56.396 41.733 -32.935 1.00 19.07 ? 2109 HOH B O 1 HETATM 6406 O O . HOH W 8 . ? -55.627 35.499 -33.926 1.00 28.35 ? 2110 HOH B O 1 HETATM 6407 O O . HOH W 8 . ? -52.300 37.810 -38.878 1.00 30.37 ? 2111 HOH B O 1 HETATM 6408 O O . HOH W 8 . ? -51.577 32.918 -32.283 1.00 16.58 ? 2112 HOH B O 1 HETATM 6409 O O . HOH W 8 . ? -59.280 38.674 -22.647 1.00 29.40 ? 2113 HOH B O 1 HETATM 6410 O O . HOH W 8 . ? -54.334 29.486 -28.043 1.00 18.12 ? 2114 HOH B O 1 HETATM 6411 O O . HOH W 8 . ? -51.653 30.515 -30.732 1.00 17.42 ? 2115 HOH B O 1 HETATM 6412 O O . HOH W 8 . ? -54.719 28.587 -21.896 1.00 29.09 ? 2116 HOH B O 1 HETATM 6413 O O B HOH W 8 . ? -50.675 20.674 -24.511 0.60 23.36 ? 2117 HOH B O 1 HETATM 6414 O O . HOH W 8 . ? -56.495 26.816 -18.054 1.00 38.88 ? 2118 HOH B O 1 HETATM 6415 O O . HOH W 8 . ? -54.429 27.643 -26.138 1.00 28.47 ? 2119 HOH B O 1 HETATM 6416 O O . HOH W 8 . ? -52.819 21.958 -20.923 1.00 26.07 ? 2120 HOH B O 1 HETATM 6417 O O . HOH W 8 . ? -54.625 24.158 -28.091 1.00 27.18 ? 2121 HOH B O 1 HETATM 6418 O O . HOH W 8 . ? -50.922 19.163 -15.908 1.00 35.79 ? 2122 HOH B O 1 HETATM 6419 O O A HOH W 8 . ? -48.633 19.917 -24.161 0.40 23.88 ? 2123 HOH B O 1 HETATM 6420 O O . HOH W 8 . ? -12.482 47.780 -26.905 1.00 32.50 ? 2124 HOH B O 1 HETATM 6421 O O . HOH W 8 . ? -51.465 17.471 -21.295 1.00 36.92 ? 2125 HOH B O 1 HETATM 6422 O O . HOH W 8 . ? -43.562 24.118 -17.577 1.00 19.22 ? 2126 HOH B O 1 HETATM 6423 O O . HOH W 8 . ? -14.460 53.712 -23.667 1.00 30.59 ? 2127 HOH B O 1 HETATM 6424 O O . HOH W 8 . ? -42.406 22.027 -11.133 1.00 25.54 ? 2128 HOH B O 1 HETATM 6425 O O . HOH W 8 . ? -39.333 17.410 -14.122 1.00 21.60 ? 2129 HOH B O 1 HETATM 6426 O O . HOH W 8 . ? -41.478 14.797 -14.242 1.00 32.10 ? 2130 HOH B O 1 HETATM 6427 O O . HOH W 8 . ? -12.266 46.166 -31.408 1.00 38.15 ? 2131 HOH B O 1 HETATM 6428 O O . HOH W 8 . ? -39.382 22.563 -5.525 1.00 34.12 ? 2132 HOH B O 1 HETATM 6429 O O . HOH W 8 . ? -35.828 25.114 -4.705 1.00 31.38 ? 2133 HOH B O 1 HETATM 6430 O O . HOH W 8 . ? -16.916 34.906 -12.781 1.00 26.74 ? 2134 HOH B O 1 HETATM 6431 O O . HOH W 8 . ? -20.403 30.271 -11.113 1.00 34.66 ? 2135 HOH B O 1 HETATM 6432 O O . HOH W 8 . ? -20.422 34.984 -10.709 1.00 28.45 ? 2136 HOH B O 1 HETATM 6433 O O . HOH W 8 . ? -25.009 25.664 -14.927 1.00 29.85 ? 2137 HOH B O 1 HETATM 6434 O O . HOH W 8 . ? -22.074 27.309 -17.254 1.00 22.02 ? 2138 HOH B O 1 HETATM 6435 O O . HOH W 8 . ? -42.329 42.767 -19.584 1.00 18.04 ? 2139 HOH B O 1 HETATM 6436 O O . HOH W 8 . ? -40.998 42.882 -26.505 1.00 14.73 ? 2140 HOH B O 1 HETATM 6437 O O . HOH W 8 . ? -37.178 44.548 -28.805 1.00 19.09 ? 2141 HOH B O 1 HETATM 6438 O O . HOH W 8 . ? -33.007 43.742 -25.125 1.00 18.37 ? 2142 HOH B O 1 HETATM 6439 O O . HOH W 8 . ? 9.888 -24.662 -5.255 1.00 34.69 ? 2143 HOH B O 1 HETATM 6440 O O . HOH W 8 . ? -41.401 58.564 -23.078 1.00 22.33 ? 2144 HOH B O 1 HETATM 6441 O O . HOH W 8 . ? -41.920 58.417 -18.919 1.00 27.04 ? 2145 HOH B O 1 HETATM 6442 O O . HOH W 8 . ? -29.711 56.396 -27.181 1.00 34.92 ? 2146 HOH B O 1 HETATM 6443 O O . HOH W 8 . ? -35.424 56.395 -29.433 1.00 26.97 ? 2147 HOH B O 1 HETATM 6444 O O . HOH W 8 . ? -39.417 60.781 -33.290 1.00 35.45 ? 2148 HOH B O 1 HETATM 6445 O O . HOH W 8 . ? -37.540 60.226 -31.695 1.00 34.11 ? 2149 HOH B O 1 HETATM 6446 O O . HOH W 8 . ? -42.338 62.400 -32.085 1.00 34.17 ? 2150 HOH B O 1 HETATM 6447 O O . HOH W 8 . ? -32.122 35.868 -42.832 1.00 31.07 ? 2151 HOH B O 1 HETATM 6448 O O . HOH W 8 . ? -27.911 34.519 -42.328 1.00 30.73 ? 2152 HOH B O 1 HETATM 6449 O O . HOH W 8 . ? -36.970 41.134 -42.934 1.00 37.96 ? 2153 HOH B O 1 HETATM 6450 O O . HOH W 8 . ? -41.977 55.059 -35.369 1.00 20.13 ? 2154 HOH B O 1 HETATM 6451 O O . HOH W 8 . ? -42.619 48.626 -38.468 1.00 39.50 ? 2155 HOH B O 1 HETATM 6452 O O . HOH W 8 . ? -22.241 35.900 -40.600 1.00 37.74 ? 2156 HOH B O 1 HETATM 6453 O O . HOH W 8 . ? -18.009 34.562 -40.890 1.00 33.91 ? 2157 HOH B O 1 HETATM 6454 O O . HOH W 8 . ? -13.659 40.376 -35.768 1.00 26.91 ? 2158 HOH B O 1 HETATM 6455 O O . HOH W 8 . ? -51.205 53.699 -27.117 1.00 25.56 ? 2159 HOH B O 1 HETATM 6456 O O . HOH W 8 . ? -4.515 32.851 -33.440 1.00 32.52 ? 2160 HOH B O 1 HETATM 6457 O O . HOH W 8 . ? -53.957 49.400 -21.982 1.00 26.60 ? 2161 HOH B O 1 HETATM 6458 O O . HOH W 8 . ? -51.914 50.478 -28.600 1.00 21.32 ? 2162 HOH B O 1 HETATM 6459 O O . HOH W 8 . ? -40.676 47.332 -27.862 1.00 17.96 ? 2163 HOH B O 1 HETATM 6460 O O . HOH W 8 . ? -55.158 42.701 -20.077 1.00 25.01 ? 2164 HOH B O 1 HETATM 6461 O O . HOH W 8 . ? -44.188 43.292 -21.644 1.00 24.17 ? 2165 HOH B O 1 HETATM 6462 O O . HOH W 8 . ? -56.768 30.510 -21.067 1.00 43.66 ? 2166 HOH B O 1 HETATM 6463 O O . HOH W 8 . ? -57.014 31.621 -16.934 1.00 34.57 ? 2167 HOH B O 1 HETATM 6464 O O . HOH W 8 . ? -53.089 35.869 -11.868 1.00 32.40 ? 2168 HOH B O 1 HETATM 6465 O O . HOH W 8 . ? -53.110 31.698 -13.872 1.00 29.60 ? 2169 HOH B O 1 HETATM 6466 O O . HOH W 8 . ? -49.110 30.997 -9.514 1.00 22.07 ? 2170 HOH B O 1 HETATM 6467 O O . HOH W 8 . ? -51.331 34.680 -7.968 1.00 19.92 ? 2171 HOH B O 1 HETATM 6468 O O . HOH W 8 . ? -42.419 31.690 -8.779 1.00 32.39 ? 2172 HOH B O 1 HETATM 6469 O O . HOH W 8 . ? -40.696 44.888 -20.288 1.00 21.69 ? 2173 HOH B O 1 HETATM 6470 O O . HOH W 8 . ? -38.491 46.343 -21.245 1.00 15.95 ? 2174 HOH B O 1 HETATM 6471 O O . HOH W 8 . ? -33.246 43.761 -19.803 1.00 16.64 ? 2175 HOH B O 1 HETATM 6472 O O . HOH W 8 . ? -34.255 45.852 -22.337 1.00 16.95 ? 2176 HOH B O 1 HETATM 6473 O O . HOH W 8 . ? -33.902 60.021 -9.979 1.00 36.96 ? 2177 HOH B O 1 HETATM 6474 O O . HOH W 8 . ? -36.516 59.796 -12.393 1.00 30.55 ? 2178 HOH B O 1 HETATM 6475 O O . HOH W 8 . ? -37.628 60.418 -17.850 1.00 26.11 ? 2179 HOH B O 1 HETATM 6476 O O . HOH W 8 . ? -36.946 59.361 -20.880 1.00 35.59 ? 2180 HOH B O 1 HETATM 6477 O O . HOH W 8 . ? -44.300 55.937 -15.570 1.00 25.72 ? 2181 HOH B O 1 HETATM 6478 O O . HOH W 8 . ? -46.037 60.352 -10.801 1.00 40.86 ? 2182 HOH B O 1 HETATM 6479 O O . HOH W 8 . ? -47.278 47.449 -7.133 1.00 25.12 ? 2183 HOH B O 1 HETATM 6480 O O . HOH W 8 . ? -45.474 38.419 -6.951 1.00 20.55 ? 2184 HOH B O 1 HETATM 6481 O O . HOH W 8 . ? -49.299 48.175 -5.182 1.00 36.33 ? 2185 HOH B O 1 HETATM 6482 O O . HOH W 8 . ? -53.490 38.086 -10.399 1.00 29.16 ? 2186 HOH B O 1 HETATM 6483 O O . HOH W 8 . ? -53.240 36.909 -8.070 1.00 30.53 ? 2187 HOH B O 1 HETATM 6484 O O A HOH W 8 . ? -53.546 39.827 -5.416 0.55 17.58 ? 2188 HOH B O 1 HETATM 6485 O O B HOH W 8 . ? -51.622 38.175 -5.698 0.45 17.28 ? 2189 HOH B O 1 HETATM 6486 O O . HOH W 8 . ? -44.497 31.920 -4.361 1.00 31.53 ? 2190 HOH B O 1 HETATM 6487 O O . HOH W 8 . ? -42.337 34.654 -7.429 1.00 23.84 ? 2191 HOH B O 1 HETATM 6488 O O . HOH W 8 . ? -34.330 34.988 -1.905 1.00 37.63 ? 2192 HOH B O 1 HETATM 6489 O O . HOH W 8 . ? -28.668 44.554 -28.353 1.00 16.96 ? 2193 HOH B O 1 HETATM 6490 O O . HOH W 8 . ? -26.210 40.446 -24.243 1.00 12.56 ? 2194 HOH B O 1 HETATM 6491 O O . HOH W 8 . ? -22.091 48.268 -21.711 1.00 18.50 ? 2195 HOH B O 1 HETATM 6492 O O . HOH W 8 . ? -21.499 48.907 -17.303 1.00 19.74 ? 2196 HOH B O 1 HETATM 6493 O O . HOH W 8 . ? -19.913 38.818 -8.388 1.00 41.25 ? 2197 HOH B O 1 HETATM 6494 O O . HOH W 8 . ? -19.522 44.410 -6.245 1.00 36.55 ? 2198 HOH B O 1 HETATM 6495 O O . HOH W 8 . ? -20.273 48.292 -8.467 1.00 23.42 ? 2199 HOH B O 1 HETATM 6496 O O A HOH W 8 . ? -18.941 42.588 -13.220 0.50 18.58 ? 2200 HOH B O 1 HETATM 6497 O O . HOH W 8 . ? -13.328 46.630 -11.465 1.00 33.89 ? 2201 HOH B O 1 HETATM 6498 O O . HOH W 8 . ? -12.992 49.166 -13.504 1.00 33.25 ? 2202 HOH B O 1 HETATM 6499 O O . HOH W 8 . ? -12.808 52.355 -17.681 1.00 29.86 ? 2203 HOH B O 1 HETATM 6500 O O . HOH W 8 . ? -14.264 56.750 -16.364 1.00 29.85 ? 2204 HOH B O 1 HETATM 6501 O O . HOH W 8 . ? -19.911 59.681 -21.427 1.00 28.79 ? 2205 HOH B O 1 HETATM 6502 O O . HOH W 8 . ? -20.216 48.653 -19.863 1.00 16.80 ? 2206 HOH B O 1 HETATM 6503 O O . HOH W 8 . ? -15.738 59.162 -17.793 1.00 35.63 ? 2207 HOH B O 1 HETATM 6504 O O . HOH W 8 . ? -19.624 63.428 -18.901 1.00 31.74 ? 2208 HOH B O 1 HETATM 6505 O O . HOH W 8 . ? -20.961 57.345 -15.030 1.00 23.22 ? 2209 HOH B O 1 HETATM 6506 O O . HOH W 8 . ? -21.981 56.225 -8.900 1.00 22.28 ? 2210 HOH B O 1 HETATM 6507 O O . HOH W 8 . ? -30.381 56.891 -8.731 1.00 28.71 ? 2211 HOH B O 1 HETATM 6508 O O . HOH W 8 . ? -26.725 55.303 -7.530 1.00 30.55 ? 2212 HOH B O 1 HETATM 6509 O O . HOH W 8 . ? -22.727 42.703 -4.334 1.00 29.96 ? 2213 HOH B O 1 HETATM 6510 O O . HOH W 8 . ? -27.080 52.693 -6.479 1.00 24.16 ? 2214 HOH B O 1 HETATM 6511 O O . HOH W 8 . ? -33.228 55.196 -5.311 1.00 31.04 ? 2215 HOH B O 1 HETATM 6512 O O . HOH W 8 . ? -41.122 40.478 -0.590 1.00 35.07 ? 2216 HOH B O 1 HETATM 6513 O O . HOH W 8 . ? -43.322 49.037 1.083 1.00 42.32 ? 2217 HOH B O 1 HETATM 6514 O O . HOH W 8 . ? -26.049 38.014 -23.167 1.00 11.11 ? 2218 HOH B O 1 HETATM 6515 O O . HOH W 8 . ? -19.697 39.256 -16.650 1.00 15.34 ? 2219 HOH B O 1 HETATM 6516 O O . HOH W 8 . ? -18.148 42.554 -22.721 1.00 14.26 ? 2220 HOH B O 1 HETATM 6517 O O . HOH W 8 . ? -24.481 40.707 -21.071 1.00 10.88 ? 2221 HOH B O 1 HETATM 6518 O O B HOH W 8 . ? -18.592 42.474 -15.932 0.50 22.99 ? 2222 HOH B O 1 HETATM 6519 O O . HOH W 8 . ? -11.568 46.709 -22.047 1.00 25.30 ? 2223 HOH B O 1 HETATM 6520 O O . HOH W 8 . ? -10.525 44.617 -20.572 1.00 37.38 ? 2224 HOH B O 1 HETATM 6521 O O . HOH W 8 . ? -12.688 43.441 -18.425 1.00 24.07 ? 2225 HOH B O 1 HETATM 6522 O O . HOH W 8 . ? -13.391 46.495 -25.036 1.00 20.68 ? 2226 HOH B O 1 HETATM 6523 O O . HOH W 8 . ? -15.437 52.045 -25.546 1.00 21.65 ? 2227 HOH B O 1 HETATM 6524 O O . HOH W 8 . ? -22.354 57.552 -24.164 1.00 22.06 ? 2228 HOH B O 1 HETATM 6525 O O . HOH W 8 . ? -27.173 50.254 -25.520 1.00 15.72 ? 2229 HOH B O 1 HETATM 6526 O O . HOH W 8 . ? -25.649 57.018 -26.154 1.00 26.51 ? 2230 HOH B O 1 HETATM 6527 O O . HOH W 8 . ? -29.787 53.954 -28.422 1.00 21.64 ? 2231 HOH B O 1 HETATM 6528 O O . HOH W 8 . ? -22.634 49.036 -31.611 1.00 18.41 ? 2232 HOH B O 1 HETATM 6529 O O . HOH W 8 . ? -24.001 40.036 -32.174 1.00 15.67 ? 2233 HOH B O 1 HETATM 6530 O O . HOH W 8 . ? -13.400 43.937 -30.908 1.00 25.34 ? 2234 HOH B O 1 HETATM 6531 O O . HOH W 8 . ? -20.651 32.698 -12.399 1.00 20.96 ? 2235 HOH B O 1 HETATM 6532 O O . HOH W 8 . ? -18.287 32.863 -13.802 1.00 20.96 ? 2236 HOH B O 1 HETATM 6533 O O . HOH W 8 . ? -23.929 27.869 -15.383 1.00 26.27 ? 2237 HOH B O 1 HETATM 6534 O O . HOH W 8 . ? -26.337 28.229 -9.237 1.00 28.27 ? 2238 HOH B O 1 HETATM 6535 O O . HOH W 8 . ? -29.115 34.650 -5.194 1.00 23.89 ? 2239 HOH B O 1 HETATM 6536 O O . HOH W 8 . ? -20.745 34.779 -8.218 1.00 36.63 ? 2240 HOH B O 1 HETATM 6537 O O . HOH W 8 . ? -21.859 40.401 -5.675 1.00 41.72 ? 2241 HOH B O 1 HETATM 6538 O O . HOH W 8 . ? -25.317 34.408 -3.153 1.00 36.06 ? 2242 HOH B O 1 HETATM 6539 O O . HOH W 8 . ? -30.018 36.573 -3.535 1.00 33.53 ? 2243 HOH B O 1 HETATM 6540 O O . HOH W 8 . ? -28.536 46.699 -1.213 1.00 38.58 ? 2244 HOH B O 1 HETATM 6541 O O . HOH W 8 . ? -32.329 35.523 -3.931 1.00 28.99 ? 2245 HOH B O 1 HETATM 6542 O O . HOH W 8 . ? -23.845 34.902 -24.421 1.00 13.23 ? 2246 HOH B O 1 HETATM 6543 O O . HOH W 8 . ? -30.897 29.707 -28.452 1.00 25.85 ? 2247 HOH B O 1 HETATM 6544 O O . HOH W 8 . ? -24.413 38.051 -30.320 1.00 11.27 ? 2248 HOH B O 1 HETATM 6545 O O . HOH W 8 . ? -30.305 41.135 -29.821 1.00 18.42 ? 2249 HOH B O 1 HETATM 6546 O O . HOH W 8 . ? -32.236 43.576 -32.083 1.00 15.68 ? 2250 HOH B O 1 HETATM 6547 O O . HOH W 8 . ? -29.981 41.196 -44.117 1.00 32.68 ? 2251 HOH B O 1 HETATM 6548 O O . HOH W 8 . ? -30.395 46.263 -38.421 1.00 12.25 ? 2252 HOH B O 1 HETATM 6549 O O . HOH W 8 . ? -24.693 47.539 -46.292 1.00 24.91 ? 2253 HOH B O 1 HETATM 6550 O O . HOH W 8 . ? -23.725 49.092 -42.532 1.00 24.43 ? 2254 HOH B O 1 HETATM 6551 O O . HOH W 8 . ? -22.479 45.256 -44.116 1.00 28.78 ? 2255 HOH B O 1 HETATM 6552 O O . HOH W 8 . ? -28.855 42.392 -50.196 1.00 28.83 ? 2256 HOH B O 1 HETATM 6553 O O . HOH W 8 . ? -25.224 52.643 -48.624 1.00 42.79 ? 2257 HOH B O 1 HETATM 6554 O O . HOH W 8 . ? -32.042 52.180 -44.846 1.00 32.22 ? 2258 HOH B O 1 HETATM 6555 O O . HOH W 8 . ? -28.888 44.495 -51.882 1.00 28.21 ? 2259 HOH B O 1 HETATM 6556 O O . HOH W 8 . ? -33.517 49.532 -45.770 1.00 35.17 ? 2260 HOH B O 1 HETATM 6557 O O . HOH W 8 . ? -35.227 42.621 -46.329 1.00 24.17 ? 2261 HOH B O 1 HETATM 6558 O O . HOH W 8 . ? -35.350 49.740 -41.952 1.00 19.49 ? 2262 HOH B O 1 HETATM 6559 O O . HOH W 8 . ? -39.949 50.634 -43.075 1.00 41.71 ? 2263 HOH B O 1 HETATM 6560 O O . HOH W 8 . ? -35.882 38.616 -35.371 1.00 16.17 ? 2264 HOH B O 1 HETATM 6561 O O . HOH W 8 . ? -26.440 54.108 -41.295 1.00 25.84 ? 2265 HOH B O 1 HETATM 6562 O O A HOH W 8 . ? 7.838 -25.182 -3.887 0.50 25.66 ? 2266 HOH B O 1 HETATM 6563 O O . HOH W 8 . ? -33.113 52.442 -33.329 1.00 21.46 ? 2267 HOH B O 1 HETATM 6564 O O . HOH W 8 . ? -25.059 54.129 -39.123 1.00 22.50 ? 2268 HOH B O 1 HETATM 6565 O O . HOH W 8 . ? -32.881 55.677 -31.587 1.00 26.72 ? 2269 HOH B O 1 HETATM 6566 O O . HOH W 8 . ? -25.080 50.137 -32.065 1.00 14.36 ? 2270 HOH B O 1 HETATM 6567 O O . HOH W 8 . ? -28.055 55.875 -30.318 1.00 31.28 ? 2271 HOH B O 1 HETATM 6568 O O . HOH W 8 . ? -23.567 45.333 -37.189 1.00 13.98 ? 2272 HOH B O 1 HETATM 6569 O O . HOH W 8 . ? -16.588 45.589 -38.664 1.00 27.18 ? 2273 HOH B O 1 HETATM 6570 O O . HOH W 8 . ? -18.889 39.203 -40.704 1.00 29.74 ? 2274 HOH B O 1 HETATM 6571 O O . HOH W 8 . ? -22.488 38.073 -41.966 1.00 29.75 ? 2275 HOH B O 1 HETATM 6572 O O . HOH W 8 . ? -25.068 41.754 -43.974 1.00 32.50 ? 2276 HOH B O 1 HETATM 6573 O O . HOH W 8 . ? -34.829 42.693 -43.351 1.00 20.37 ? 2277 HOH B O 1 HETATM 6574 O O . HOH W 8 . ? -29.308 36.961 -42.619 1.00 19.55 ? 2278 HOH B O 1 HETATM 6575 O O . HOH W 8 . ? -33.629 35.928 -38.368 1.00 22.75 ? 2279 HOH B O 1 HETATM 6576 O O . HOH W 8 . ? -31.362 30.279 -40.770 1.00 36.56 ? 2280 HOH B O 1 HETATM 6577 O O . HOH W 8 . ? -28.191 31.411 -38.764 1.00 22.45 ? 2281 HOH B O 1 HETATM 6578 O O . HOH W 8 . ? -25.934 33.530 -40.510 1.00 22.55 ? 2282 HOH B O 1 HETATM 6579 O O . HOH W 8 . ? -16.094 33.071 -39.502 1.00 34.77 ? 2283 HOH B O 1 HETATM 6580 O O . HOH W 8 . ? -21.901 33.636 -39.592 1.00 20.35 ? 2284 HOH B O 1 HETATM 6581 O O . HOH W 8 . ? -14.051 37.660 -35.109 1.00 20.88 ? 2285 HOH B O 1 HETATM 6582 O O . HOH W 8 . ? -19.274 36.293 -39.402 1.00 17.97 ? 2286 HOH B O 1 HETATM 6583 O O . HOH W 8 . ? -14.049 41.945 -33.114 1.00 23.67 ? 2287 HOH B O 1 HETATM 6584 O O . HOH W 8 . ? -11.899 32.004 -24.004 1.00 30.49 ? 2288 HOH B O 1 HETATM 6585 O O . HOH W 8 . ? -8.078 34.891 -26.678 1.00 37.28 ? 2289 HOH B O 1 HETATM 6586 O O . HOH W 8 . ? -6.679 31.886 -31.721 1.00 35.48 ? 2290 HOH B O 1 HETATM 6587 O O . HOH W 8 . ? -11.902 37.687 -33.558 1.00 31.17 ? 2291 HOH B O 1 HETATM 6588 O O . HOH W 8 . ? -11.757 40.119 -21.823 1.00 27.61 ? 2292 HOH B O 1 HETATM 6589 O O . HOH W 8 . ? -11.923 42.460 -29.458 1.00 27.88 ? 2293 HOH B O 1 HETATM 6590 O O . HOH W 8 . ? -12.027 41.001 -19.265 1.00 37.87 ? 2294 HOH B O 1 HETATM 6591 O O . HOH W 8 . ? -16.935 38.800 -16.053 1.00 21.02 ? 2295 HOH B O 1 HETATM 6592 O O . HOH W 8 . ? -14.671 27.645 -18.532 1.00 31.83 ? 2296 HOH B O 1 HETATM 6593 O O . HOH W 8 . ? -46.564 26.896 -32.402 1.00 19.79 ? 2297 HOH B O 1 HETATM 6594 O O . HOH W 8 . ? -30.911 61.427 -15.960 1.00 28.77 ? 2298 HOH B O 1 HETATM 6595 O O . HOH W 8 . ? -34.091 63.063 -19.326 1.00 26.16 ? 2299 HOH B O 1 HETATM 6596 O O . HOH W 8 . ? -34.826 60.155 -22.827 1.00 27.38 ? 2300 HOH B O 1 HETATM 6597 O O . HOH W 8 . ? -35.173 56.497 -25.440 1.00 22.53 ? 2301 HOH B O 1 HETATM 6598 O O . HOH W 8 . ? -32.637 54.333 -29.518 1.00 23.03 ? 2302 HOH B O 1 HETATM 6599 O O . HOH W 8 . ? -30.989 43.645 -29.386 1.00 19.41 ? 2303 HOH B O 1 HETATM 6600 O O . HOH W 8 . ? -36.725 49.037 -29.430 1.00 18.24 ? 2304 HOH B O 1 HETATM 6601 O O . HOH W 8 . ? -32.902 51.740 -30.659 1.00 18.08 ? 2305 HOH B O 1 HETATM 6602 O O . HOH W 8 . ? -31.610 45.837 -22.605 1.00 16.50 ? 2306 HOH B O 1 HETATM 6603 O O . HOH W 8 . ? -34.851 28.355 -29.961 1.00 24.94 ? 2307 HOH B O 1 HETATM 6604 O O . HOH W 8 . ? -30.807 28.930 -30.796 1.00 20.87 ? 2308 HOH B O 1 HETATM 6605 O O . HOH W 8 . ? -33.502 30.357 -28.597 1.00 12.13 ? 2309 HOH B O 1 HETATM 6606 O O B HOH W 8 . ? -35.206 28.754 -32.610 0.60 15.35 ? 2310 HOH B O 1 HETATM 6607 O O . HOH W 8 . ? -33.088 17.131 -31.870 1.00 40.81 ? 2311 HOH B O 1 # 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 TYR 1 89 ? ? ? A . n A 1 2 ASN 2 90 90 ASN ASN A . n A 1 3 GLY 3 91 91 GLY GLY A . n A 1 4 ASN 4 92 92 ASN ASN A . n A 1 5 PRO 5 93 93 PRO PRO A . n A 1 6 PHE 6 94 94 PHE PHE A . n A 1 7 GLU 7 95 95 GLU GLU A . n A 1 8 GLY 8 96 96 GLY GLY A . n A 1 9 VAL 9 97 97 VAL VAL A . n A 1 10 GLN 10 98 98 GLN GLN A . n A 1 11 LEU 11 99 99 LEU LEU A . n A 1 12 TRP 12 100 100 TRP TRP A . n A 1 13 ALA 13 101 101 ALA ALA A . n A 1 14 ASN 14 102 102 ASN ASN A . n A 1 15 ASN 15 103 103 ASN ASN A . n A 1 16 TYR 16 104 104 TYR TYR A . n A 1 17 TYR 17 105 105 TYR TYR A . n A 1 18 ARG 18 106 106 ARG ARG A . n A 1 19 SER 19 107 107 SER SER A . n A 1 20 GLU 20 108 108 GLU GLU A . n A 1 21 VAL 21 109 109 VAL VAL A . n A 1 22 HIS 22 110 110 HIS HIS A . n A 1 23 THR 23 111 111 THR THR A . n A 1 24 LEU 24 112 112 LEU LEU A . n A 1 25 ALA 25 113 113 ALA ALA A . n A 1 26 ILE 26 114 114 ILE ILE A . n A 1 27 PRO 27 115 115 PRO PRO A . n A 1 28 GLN 28 116 116 GLN GLN A . n A 1 29 ILE 29 117 117 ILE ILE A . n A 1 30 THR 30 118 118 THR THR A . n A 1 31 ASP 31 119 119 ASP ASP A . n A 1 32 PRO 32 120 120 PRO PRO A . n A 1 33 ALA 33 121 121 ALA ALA A . n A 1 34 LEU 34 122 122 LEU LEU A . n A 1 35 ARG 35 123 123 ARG ARG A . n A 1 36 ALA 36 124 124 ALA ALA A . n A 1 37 ALA 37 125 125 ALA ALA A . n A 1 38 ALA 38 126 126 ALA ALA A . n A 1 39 SER 39 127 127 SER SER A . n A 1 40 ALA 40 128 128 ALA ALA A . n A 1 41 VAL 41 129 129 VAL VAL A . n A 1 42 ALA 42 130 130 ALA ALA A . n A 1 43 GLU 43 131 131 GLU GLU A . n A 1 44 VAL 44 132 132 VAL VAL A . n A 1 45 PRO 45 133 133 PRO PRO A . n A 1 46 SER 46 134 134 SER SER A . n A 1 47 PHE 47 135 135 PHE PHE A . n A 1 48 GLN 48 136 136 GLN GLN A . n A 1 49 TRP 49 137 137 TRP TRP A . n A 1 50 LEU 50 138 138 LEU LEU A . n A 1 51 ASP 51 139 139 ASP ASP A . n A 1 52 ARG 52 140 140 ARG ARG A . n A 1 53 ASN 53 141 141 ASN ASN A . n A 1 54 VAL 54 142 142 VAL VAL A . n A 1 55 THR 55 143 143 THR THR A . n A 1 56 VAL 56 144 144 VAL VAL A . n A 1 57 ASP 57 145 145 ASP ASP A . n A 1 58 THR 58 146 146 THR THR A . n A 1 59 LEU 59 147 147 LEU LEU A . n A 1 60 LEU 60 148 148 LEU LEU A . n A 1 61 VAL 61 149 149 VAL VAL A . n A 1 62 GLN 62 150 150 GLN GLN A . n A 1 63 THR 63 151 151 THR THR A . n A 1 64 LEU 64 152 152 LEU LEU A . n A 1 65 SER 65 153 153 SER SER A . n A 1 66 GLU 66 154 154 GLU GLU A . n A 1 67 ILE 67 155 155 ILE ILE A . n A 1 68 ARG 68 156 156 ARG ARG A . n A 1 69 GLU 69 157 157 GLU GLU A . n A 1 70 ALA 70 158 158 ALA ALA A . n A 1 71 ASN 71 159 159 ASN ASN A . n A 1 72 GLN 72 160 160 GLN GLN A . n A 1 73 ALA 73 161 161 ALA ALA A . n A 1 74 GLY 74 162 162 GLY GLY A . n A 1 75 ALA 75 163 163 ALA ALA A . n A 1 76 ASN 76 164 164 ASN ASN A . n A 1 77 PRO 77 165 165 PRO PRO A . n A 1 78 GLN 78 166 166 GLN GLN A . n A 1 79 TYR 79 167 167 TYR TYR A . n A 1 80 ALA 80 168 168 ALA ALA A . n A 1 81 ALA 81 169 169 ALA ALA A . n A 1 82 GLN 82 170 170 GLN GLN A . n A 1 83 ILE 83 171 171 ILE ILE A . n A 1 84 VAL 84 172 172 VAL VAL A . n A 1 85 VAL 85 173 173 VAL VAL A . n A 1 86 TYR 86 174 174 TYR TYR A . n A 1 87 ASP 87 175 175 ASP ASP A . n A 1 88 LEU 88 176 176 LEU LEU A . n A 1 89 PRO 89 177 177 PRO PRO A . n A 1 90 ASP 90 178 178 ASP ASP A . n A 1 91 ARG 91 179 179 ARG ARG A . n A 1 92 ASP 92 180 180 ASP ASP A . n A 1 93 CYS 93 181 181 CYS CYS A . n A 1 94 ALA 94 182 182 ALA ALA A . n A 1 95 ALA 95 183 183 ALA ALA A . n A 1 96 ALA 96 184 184 ALA ALA A . n A 1 97 ALA 97 185 185 ALA ALA A . n A 1 98 SER 98 186 186 SER SER A . n A 1 99 ASN 99 187 187 ASN ASN A . n A 1 100 GLY 100 188 188 GLY GLY A . n A 1 101 GLU 101 189 189 GLU GLU A . n A 1 102 TRP 102 190 190 TRP TRP A . n A 1 103 ALA 103 191 191 ALA ALA A . n A 1 104 ILE 104 192 192 ILE ILE A . n A 1 105 ALA 105 193 193 ALA ALA A . n A 1 106 ASN 106 194 194 ASN ASN A . n A 1 107 ASN 107 195 195 ASN ASN A . n A 1 108 GLY 108 196 196 GLY GLY A . n A 1 109 VAL 109 197 197 VAL VAL A . n A 1 110 ASN 110 198 198 ASN ASN A . n A 1 111 ASN 111 199 199 ASN ASN A . n A 1 112 TYR 112 200 200 TYR TYR A . n A 1 113 LYS 113 201 201 LYS LYS A . n A 1 114 ALA 114 202 202 ALA ALA A . n A 1 115 TYR 115 203 203 TYR TYR A . n A 1 116 ILE 116 204 204 ILE ILE A . n A 1 117 ASN 117 205 205 ASN ASN A . n A 1 118 ARG 118 206 206 ARG ARG A . n A 1 119 ILE 119 207 207 ILE ILE A . n A 1 120 ARG 120 208 208 ARG ARG A . n A 1 121 GLU 121 209 209 GLU GLU A . n A 1 122 ILE 122 210 210 ILE ILE A . n A 1 123 LEU 123 211 211 LEU LEU A . n A 1 124 ILE 124 212 212 ILE ILE A . n A 1 125 SER 125 213 213 SER SER A . n A 1 126 PHE 126 214 214 PHE PHE A . n A 1 127 SER 127 215 215 SER SER A . n A 1 128 ASP 128 216 216 ASP ASP A . n A 1 129 VAL 129 217 217 VAL VAL A . n A 1 130 ARG 130 218 218 ARG ARG A . n A 1 131 THR 131 219 219 THR THR A . n A 1 132 ILE 132 220 220 ILE ILE A . n A 1 133 LEU 133 221 221 LEU LEU A . n A 1 134 VAL 134 222 222 VAL VAL A . n A 1 135 ILE 135 223 223 ILE ILE A . n A 1 136 GLU 136 224 224 GLU GLU A . n A 1 137 PRO 137 225 225 PRO PRO A . n A 1 138 ASP 138 226 226 ASP ASP A . n A 1 139 SER 139 227 227 SER SER A . n A 1 140 LEU 140 228 228 LEU LEU A . n A 1 141 ALA 141 229 229 ALA ALA A . n A 1 142 ASN 142 230 230 ASN ASN A . n A 1 143 MET 143 231 231 MET MET A . n A 1 144 VAL 144 232 232 VAL VAL A . n A 1 145 THR 145 233 233 THR THR A . n A 1 146 ASN 146 234 234 ASN ASN A . n A 1 147 MET 147 235 235 MET MET A . n A 1 148 ASN 148 236 236 ASN ASN A . n A 1 149 VAL 149 237 237 VAL VAL A . n A 1 150 PRO 150 238 238 PRO PRO A . n A 1 151 LYS 151 239 239 LYS LYS A . n A 1 152 CYS 152 240 240 CYS CYS A . n A 1 153 SER 153 241 241 SER SER A . n A 1 154 GLY 154 242 242 GLY GLY A . n A 1 155 ALA 155 243 243 ALA ALA A . n A 1 156 ALA 156 244 244 ALA ALA A . n A 1 157 SER 157 245 245 SER SER A . n A 1 158 THR 158 246 246 THR THR A . n A 1 159 TYR 159 247 247 TYR TYR A . n A 1 160 ARG 160 248 248 ARG ARG A . n A 1 161 GLU 161 249 249 GLU GLU A . n A 1 162 LEU 162 250 250 LEU LEU A . n A 1 163 THR 163 251 251 THR THR A . n A 1 164 ILE 164 252 252 ILE ILE A . n A 1 165 TYR 165 253 253 TYR TYR A . n A 1 166 ALA 166 254 254 ALA ALA A . n A 1 167 LEU 167 255 255 LEU LEU A . n A 1 168 LYS 168 256 256 LYS LYS A . n A 1 169 GLN 169 257 257 GLN GLN A . n A 1 170 LEU 170 258 258 LEU LEU A . n A 1 171 ASP 171 259 259 ASP ASP A . n A 1 172 LEU 172 260 260 LEU LEU A . n A 1 173 PRO 173 261 261 PRO PRO A . n A 1 174 HIS 174 262 262 HIS HIS A . n A 1 175 VAL 175 263 263 VAL VAL A . n A 1 176 ALA 176 264 264 ALA ALA A . n A 1 177 MET 177 265 265 MET MET A . n A 1 178 TYR 178 266 266 TYR TYR A . n A 1 179 MET 179 267 267 MET MET A . n A 1 180 ASP 180 268 268 ASP ASP A . n A 1 181 ALA 181 269 269 ALA ALA A . n A 1 182 GLY 182 270 270 GLY GLY A . n A 1 183 HIS 183 271 271 HIS HIS A . n A 1 184 ALA 184 272 272 ALA ALA A . n A 1 185 GLY 185 273 273 GLY GLY A . n A 1 186 TRP 186 274 274 TRP TRP A . n A 1 187 LEU 187 275 275 LEU LEU A . n A 1 188 GLY 188 276 276 GLY GLY A . n A 1 189 TRP 189 277 277 TRP TRP A . n A 1 190 PRO 190 278 278 PRO PRO A . n A 1 191 ALA 191 279 279 ALA ALA A . n A 1 192 ASN 192 280 280 ASN ASN A . n A 1 193 ILE 193 281 281 ILE ILE A . n A 1 194 GLN 194 282 282 GLN GLN A . n A 1 195 PRO 195 283 283 PRO PRO A . n A 1 196 ALA 196 284 284 ALA ALA A . n A 1 197 ALA 197 285 285 ALA ALA A . n A 1 198 GLU 198 286 286 GLU GLU A . n A 1 199 LEU 199 287 287 LEU LEU A . n A 1 200 PHE 200 288 288 PHE PHE A . n A 1 201 ALA 201 289 289 ALA ALA A . n A 1 202 LYS 202 290 290 LYS LYS A . n A 1 203 ILE 203 291 291 ILE ILE A . n A 1 204 TYR 204 292 292 TYR TYR A . n A 1 205 GLU 205 293 293 GLU GLU A . n A 1 206 ASP 206 294 294 ASP ASP A . n A 1 207 ALA 207 295 295 ALA ALA A . n A 1 208 GLY 208 296 296 GLY GLY A . n A 1 209 LYS 209 297 297 LYS LYS A . n A 1 210 PRO 210 298 298 PRO PRO A . n A 1 211 ARG 211 299 299 ARG ARG A . n A 1 212 ALA 212 300 300 ALA ALA A . n A 1 213 VAL 213 301 301 VAL VAL A . n A 1 214 ARG 214 302 302 ARG ARG A . n A 1 215 GLY 215 303 303 GLY GLY A . n A 1 216 LEU 216 304 304 LEU LEU A . n A 1 217 ALA 217 305 305 ALA ALA A . n A 1 218 THR 218 306 306 THR THR A . n A 1 219 ASN 219 307 307 ASN ASN A . n A 1 220 VAL 220 308 308 VAL VAL A . n A 1 221 ALA 221 309 309 ALA ALA A . n A 1 222 ASN 222 310 310 ASN ASN A . n A 1 223 TYR 223 311 311 TYR TYR A . n A 1 224 ASN 224 312 312 ASN ASN A . n A 1 225 ALA 225 313 313 ALA ALA A . n A 1 226 TRP 226 314 314 TRP TRP A . n A 1 227 SER 227 315 315 SER SER A . n A 1 228 VAL 228 316 316 VAL VAL A . n A 1 229 SER 229 317 317 SER SER A . n A 1 230 SER 230 318 318 SER SER A . n A 1 231 PRO 231 319 319 PRO PRO A . n A 1 232 PRO 232 320 320 PRO PRO A . n A 1 233 PRO 233 321 321 PRO PRO A . n A 1 234 TYR 234 322 322 TYR TYR A . n A 1 235 THR 235 323 323 THR THR A . n A 1 236 SER 236 324 324 SER SER A . n A 1 237 PRO 237 325 325 PRO PRO A . n A 1 238 ASN 238 326 326 ASN ASN A . n A 1 239 PRO 239 327 327 PRO PRO A . n A 1 240 ASN 240 328 328 ASN ASN A . n A 1 241 TYR 241 329 329 TYR TYR A . n A 1 242 ASP 242 330 330 ASP ASP A . n A 1 243 GLU 243 331 331 GLU GLU A . n A 1 244 LYS 244 332 332 LYS LYS A . n A 1 245 HIS 245 333 333 HIS HIS A . n A 1 246 TYR 246 334 334 TYR TYR A . n A 1 247 ILE 247 335 335 ILE ILE A . n A 1 248 GLU 248 336 336 GLU GLU A . n A 1 249 ALA 249 337 337 ALA ALA A . n A 1 250 PHE 250 338 338 PHE PHE A . n A 1 251 ARG 251 339 339 ARG ARG A . n A 1 252 PRO 252 340 340 PRO PRO A . n A 1 253 LEU 253 341 341 LEU LEU A . n A 1 254 LEU 254 342 342 LEU LEU A . n A 1 255 GLU 255 343 343 GLU GLU A . n A 1 256 ALA 256 344 344 ALA ALA A . n A 1 257 ARG 257 345 345 ARG ARG A . n A 1 258 GLY 258 346 346 GLY GLY A . n A 1 259 PHE 259 347 347 PHE PHE A . n A 1 260 PRO 260 348 348 PRO PRO A . n A 1 261 ALA 261 349 349 ALA ALA A . n A 1 262 GLN 262 350 350 GLN GLN A . n A 1 263 PHE 263 351 351 PHE PHE A . n A 1 264 ILE 264 352 352 ILE ILE A . n A 1 265 VAL 265 353 353 VAL VAL A . n A 1 266 ASP 266 354 354 ASP ASP A . n A 1 267 GLN 267 355 355 GLN GLN A . n A 1 268 GLY 268 356 356 GLY GLY A . n A 1 269 ARG 269 357 357 ARG ARG A . n A 1 270 SER 270 358 358 SER SER A . n A 1 271 GLY 271 359 359 GLY GLY A . n A 1 272 LYS 272 360 360 LYS LYS A . n A 1 273 GLN 273 361 361 GLN GLN A . n A 1 274 PRO 274 362 362 PRO PRO A . n A 1 275 THR 275 363 363 THR THR A . n A 1 276 GLY 276 364 364 GLY GLY A . n A 1 277 GLN 277 365 365 GLN GLN A . n A 1 278 LYS 278 366 366 LYS LYS A . n A 1 279 GLU 279 367 367 GLU GLU A . n A 1 280 TRP 280 368 368 TRP TRP A . n A 1 281 GLY 281 369 369 GLY GLY A . n A 1 282 HIS 282 370 370 HIS HIS A . n A 1 283 TRP 283 371 371 TRP TRP A . n A 1 284 CYS 284 372 372 CYS CYS A . n A 1 285 ASN 285 373 373 ASN ASN A . n A 1 286 ALA 286 374 374 ALA ALA A . n A 1 287 ILE 287 375 375 ILE ILE A . n A 1 288 GLY 288 376 376 GLY GLY A . n A 1 289 THR 289 377 377 THR THR A . n A 1 290 GLY 290 378 378 GLY GLY A . n A 1 291 PHE 291 379 379 PHE PHE A . n A 1 292 GLY 292 380 380 GLY GLY A . n A 1 293 MET 293 381 381 MET MET A . n A 1 294 ARG 294 382 382 ARG ARG A . n A 1 295 PRO 295 383 383 PRO PRO A . n A 1 296 THR 296 384 384 THR THR A . n A 1 297 ALA 297 385 385 ALA ALA A . n A 1 298 ASN 298 386 386 ASN ASN A . n A 1 299 THR 299 387 387 THR THR A . n A 1 300 GLY 300 388 388 GLY GLY A . n A 1 301 HIS 301 389 389 HIS HIS A . n A 1 302 GLN 302 390 390 GLN GLN A . n A 1 303 TYR 303 391 391 TYR TYR A . n A 1 304 VAL 304 392 392 VAL VAL A . n A 1 305 ASP 305 393 393 ASP ASP A . n A 1 306 ALA 306 394 394 ALA ALA A . n A 1 307 PHE 307 395 395 PHE PHE A . n A 1 308 VAL 308 396 396 VAL VAL A . n A 1 309 TRP 309 397 397 TRP TRP A . n A 1 310 VAL 310 398 398 VAL VAL A . n A 1 311 LYS 311 399 399 LYS LYS A . n A 1 312 PRO 312 400 400 PRO PRO A . n A 1 313 GLY 313 401 401 GLY GLY A . n A 1 314 GLY 314 402 402 GLY GLY A . n A 1 315 GLU 315 403 403 GLU GLU A . n A 1 316 CYS 316 404 404 CYS CYS A . n A 1 317 ASP 317 405 405 ASP ASP A . n A 1 318 GLY 318 406 406 GLY GLY A . n A 1 319 THR 319 407 407 THR THR A . n A 1 320 SER 320 408 408 SER SER A . n A 1 321 ASP 321 409 409 ASP ASP A . n A 1 322 THR 322 410 410 THR THR A . n A 1 323 THR 323 411 411 THR THR A . n A 1 324 ALA 324 412 412 ALA ALA A . n A 1 325 ALA 325 413 413 ALA ALA A . n A 1 326 ARG 326 414 414 ARG ARG A . n A 1 327 TYR 327 415 415 TYR TYR A . n A 1 328 ASP 328 416 416 ASP ASP A . n A 1 329 TYR 329 417 417 TYR TYR A . n A 1 330 HIS 330 418 418 HIS HIS A . n A 1 331 CYS 331 419 419 CYS CYS A . n A 1 332 GLY 332 420 420 GLY GLY A . n A 1 333 LEU 333 421 421 LEU LEU A . n A 1 334 GLU 334 422 422 GLU GLU A . n A 1 335 ASP 335 423 423 ASP ASP A . n A 1 336 ALA 336 424 424 ALA ALA A . n A 1 337 LEU 337 425 425 LEU LEU A . n A 1 338 LYS 338 426 426 LYS LYS A . n A 1 339 PRO 339 427 427 PRO PRO A . n A 1 340 ALA 340 428 428 ALA ALA A . n A 1 341 PRO 341 429 429 PRO PRO A . n A 1 342 GLU 342 430 430 GLU GLU A . n A 1 343 ALA 343 431 431 ALA ALA A . n A 1 344 GLY 344 432 432 GLY GLY A . n A 1 345 GLN 345 433 433 GLN GLN A . n A 1 346 TRP 346 434 434 TRP TRP A . n A 1 347 PHE 347 435 435 PHE PHE A . n A 1 348 ASN 348 436 436 ASN ASN A . n A 1 349 GLU 349 437 437 GLU GLU A . n A 1 350 TYR 350 438 438 TYR TYR A . n A 1 351 PHE 351 439 439 PHE PHE A . n A 1 352 ILE 352 440 440 ILE ILE A . n A 1 353 GLN 353 441 441 GLN GLN A . n A 1 354 LEU 354 442 442 LEU LEU A . n A 1 355 LEU 355 443 443 LEU LEU A . n A 1 356 ARG 356 444 444 ARG ARG A . n A 1 357 ASN 357 445 445 ASN ASN A . n A 1 358 ALA 358 446 446 ALA ALA A . n A 1 359 ASN 359 447 447 ASN ASN A . n A 1 360 PRO 360 448 448 PRO PRO A . n A 1 361 PRO 361 449 449 PRO PRO A . n A 1 362 PHE 362 450 450 PHE PHE A . n B 1 1 TYR 1 89 ? ? ? B . n B 1 2 ASN 2 90 90 ASN ASN B . n B 1 3 GLY 3 91 91 GLY GLY B . n B 1 4 ASN 4 92 92 ASN ASN B . n B 1 5 PRO 5 93 93 PRO PRO B . n B 1 6 PHE 6 94 94 PHE PHE B . n B 1 7 GLU 7 95 95 GLU GLU B . n B 1 8 GLY 8 96 96 GLY GLY B . n B 1 9 VAL 9 97 97 VAL VAL B . n B 1 10 GLN 10 98 98 GLN GLN B . n B 1 11 LEU 11 99 99 LEU LEU B . n B 1 12 TRP 12 100 100 TRP TRP B . n B 1 13 ALA 13 101 101 ALA ALA B . n B 1 14 ASN 14 102 102 ASN ASN B . n B 1 15 ASN 15 103 103 ASN ASN B . n B 1 16 TYR 16 104 104 TYR TYR B . n B 1 17 TYR 17 105 105 TYR TYR B . n B 1 18 ARG 18 106 106 ARG ARG B . n B 1 19 SER 19 107 107 SER SER B . n B 1 20 GLU 20 108 108 GLU GLU B . n B 1 21 VAL 21 109 109 VAL VAL B . n B 1 22 HIS 22 110 110 HIS HIS B . n B 1 23 THR 23 111 111 THR THR B . n B 1 24 LEU 24 112 112 LEU LEU B . n B 1 25 ALA 25 113 113 ALA ALA B . n B 1 26 ILE 26 114 114 ILE ILE B . n B 1 27 PRO 27 115 115 PRO PRO B . n B 1 28 GLN 28 116 116 GLN GLN B . n B 1 29 ILE 29 117 117 ILE ILE B . n B 1 30 THR 30 118 118 THR THR B . n B 1 31 ASP 31 119 119 ASP ASP B . n B 1 32 PRO 32 120 120 PRO PRO B . n B 1 33 ALA 33 121 121 ALA ALA B . n B 1 34 LEU 34 122 122 LEU LEU B . n B 1 35 ARG 35 123 123 ARG ARG B . n B 1 36 ALA 36 124 124 ALA ALA B . n B 1 37 ALA 37 125 125 ALA ALA B . n B 1 38 ALA 38 126 126 ALA ALA B . n B 1 39 SER 39 127 127 SER SER B . n B 1 40 ALA 40 128 128 ALA ALA B . n B 1 41 VAL 41 129 129 VAL VAL B . n B 1 42 ALA 42 130 130 ALA ALA B . n B 1 43 GLU 43 131 131 GLU GLU B . n B 1 44 VAL 44 132 132 VAL VAL B . n B 1 45 PRO 45 133 133 PRO PRO B . n B 1 46 SER 46 134 134 SER SER B . n B 1 47 PHE 47 135 135 PHE PHE B . n B 1 48 GLN 48 136 136 GLN GLN B . n B 1 49 TRP 49 137 137 TRP TRP B . n B 1 50 LEU 50 138 138 LEU LEU B . n B 1 51 ASP 51 139 139 ASP ASP B . n B 1 52 ARG 52 140 140 ARG ARG B . n B 1 53 ASN 53 141 141 ASN ASN B . n B 1 54 VAL 54 142 142 VAL VAL B . n B 1 55 THR 55 143 143 THR THR B . n B 1 56 VAL 56 144 144 VAL VAL B . n B 1 57 ASP 57 145 145 ASP ASP B . n B 1 58 THR 58 146 146 THR THR B . n B 1 59 LEU 59 147 147 LEU LEU B . n B 1 60 LEU 60 148 148 LEU LEU B . n B 1 61 VAL 61 149 149 VAL VAL B . n B 1 62 GLN 62 150 150 GLN GLN B . n B 1 63 THR 63 151 151 THR THR B . n B 1 64 LEU 64 152 152 LEU LEU B . n B 1 65 SER 65 153 153 SER SER B . n B 1 66 GLU 66 154 154 GLU GLU B . n B 1 67 ILE 67 155 155 ILE ILE B . n B 1 68 ARG 68 156 156 ARG ARG B . n B 1 69 GLU 69 157 157 GLU GLU B . n B 1 70 ALA 70 158 158 ALA ALA B . n B 1 71 ASN 71 159 159 ASN ASN B . n B 1 72 GLN 72 160 160 GLN GLN B . n B 1 73 ALA 73 161 161 ALA ALA B . n B 1 74 GLY 74 162 162 GLY GLY B . n B 1 75 ALA 75 163 163 ALA ALA B . n B 1 76 ASN 76 164 164 ASN ASN B . n B 1 77 PRO 77 165 165 PRO PRO B . n B 1 78 GLN 78 166 166 GLN GLN B . n B 1 79 TYR 79 167 167 TYR TYR B . n B 1 80 ALA 80 168 168 ALA ALA B . n B 1 81 ALA 81 169 169 ALA ALA B . n B 1 82 GLN 82 170 170 GLN GLN B . n B 1 83 ILE 83 171 171 ILE ILE B . n B 1 84 VAL 84 172 172 VAL VAL B . n B 1 85 VAL 85 173 173 VAL VAL B . n B 1 86 TYR 86 174 174 TYR TYR B . n B 1 87 ASP 87 175 175 ASP ASP B . n B 1 88 LEU 88 176 176 LEU LEU B . n B 1 89 PRO 89 177 177 PRO PRO B . n B 1 90 ASP 90 178 178 ASP ASP B . n B 1 91 ARG 91 179 179 ARG ARG B . n B 1 92 ASP 92 180 180 ASP ASP B . n B 1 93 CYS 93 181 181 CYS CYS B . n B 1 94 ALA 94 182 182 ALA ALA B . n B 1 95 ALA 95 183 183 ALA ALA B . n B 1 96 ALA 96 184 184 ALA ALA B . n B 1 97 ALA 97 185 185 ALA ALA B . n B 1 98 SER 98 186 186 SER SER B . n B 1 99 ASN 99 187 187 ASN ASN B . n B 1 100 GLY 100 188 188 GLY GLY B . n B 1 101 GLU 101 189 189 GLU GLU B . n B 1 102 TRP 102 190 190 TRP TRP B . n B 1 103 ALA 103 191 191 ALA ALA B . n B 1 104 ILE 104 192 192 ILE ILE B . n B 1 105 ALA 105 193 193 ALA ALA B . n B 1 106 ASN 106 194 194 ASN ASN B . n B 1 107 ASN 107 195 195 ASN ASN B . n B 1 108 GLY 108 196 196 GLY GLY B . n B 1 109 VAL 109 197 197 VAL VAL B . n B 1 110 ASN 110 198 198 ASN ASN B . n B 1 111 ASN 111 199 199 ASN ASN B . n B 1 112 TYR 112 200 200 TYR TYR B . n B 1 113 LYS 113 201 201 LYS LYS B . n B 1 114 ALA 114 202 202 ALA ALA B . n B 1 115 TYR 115 203 203 TYR TYR B . n B 1 116 ILE 116 204 204 ILE ILE B . n B 1 117 ASN 117 205 205 ASN ASN B . n B 1 118 ARG 118 206 206 ARG ARG B . n B 1 119 ILE 119 207 207 ILE ILE B . n B 1 120 ARG 120 208 208 ARG ARG B . n B 1 121 GLU 121 209 209 GLU GLU B . n B 1 122 ILE 122 210 210 ILE ILE B . n B 1 123 LEU 123 211 211 LEU LEU B . n B 1 124 ILE 124 212 212 ILE ILE B . n B 1 125 SER 125 213 213 SER SER B . n B 1 126 PHE 126 214 214 PHE PHE B . n B 1 127 SER 127 215 215 SER SER B . n B 1 128 ASP 128 216 216 ASP ASP B . n B 1 129 VAL 129 217 217 VAL VAL B . n B 1 130 ARG 130 218 218 ARG ARG B . n B 1 131 THR 131 219 219 THR THR B . n B 1 132 ILE 132 220 220 ILE ILE B . n B 1 133 LEU 133 221 221 LEU LEU B . n B 1 134 VAL 134 222 222 VAL VAL B . n B 1 135 ILE 135 223 223 ILE ILE B . n B 1 136 GLU 136 224 224 GLU GLU B . n B 1 137 PRO 137 225 225 PRO PRO B . n B 1 138 ASP 138 226 226 ASP ASP B . n B 1 139 SER 139 227 227 SER SER B . n B 1 140 LEU 140 228 228 LEU LEU B . n B 1 141 ALA 141 229 229 ALA ALA B . n B 1 142 ASN 142 230 230 ASN ASN B . n B 1 143 MET 143 231 231 MET MET B . n B 1 144 VAL 144 232 232 VAL VAL B . n B 1 145 THR 145 233 233 THR THR B . n B 1 146 ASN 146 234 234 ASN ASN B . n B 1 147 MET 147 235 235 MET MET B . n B 1 148 ASN 148 236 236 ASN ASN B . n B 1 149 VAL 149 237 237 VAL VAL B . n B 1 150 PRO 150 238 238 PRO PRO B . n B 1 151 LYS 151 239 239 LYS LYS B . n B 1 152 CYS 152 240 240 CYS CYS B . n B 1 153 SER 153 241 241 SER SER B . n B 1 154 GLY 154 242 242 GLY GLY B . n B 1 155 ALA 155 243 243 ALA ALA B . n B 1 156 ALA 156 244 244 ALA ALA B . n B 1 157 SER 157 245 245 SER SER B . n B 1 158 THR 158 246 246 THR THR B . n B 1 159 TYR 159 247 247 TYR TYR B . n B 1 160 ARG 160 248 248 ARG ARG B . n B 1 161 GLU 161 249 249 GLU GLU B . n B 1 162 LEU 162 250 250 LEU LEU B . n B 1 163 THR 163 251 251 THR THR B . n B 1 164 ILE 164 252 252 ILE ILE B . n B 1 165 TYR 165 253 253 TYR TYR B . n B 1 166 ALA 166 254 254 ALA ALA B . n B 1 167 LEU 167 255 255 LEU LEU B . n B 1 168 LYS 168 256 256 LYS LYS B . n B 1 169 GLN 169 257 257 GLN GLN B . n B 1 170 LEU 170 258 258 LEU LEU B . n B 1 171 ASP 171 259 259 ASP ASP B . n B 1 172 LEU 172 260 260 LEU LEU B . n B 1 173 PRO 173 261 261 PRO PRO B . n B 1 174 HIS 174 262 262 HIS HIS B . n B 1 175 VAL 175 263 263 VAL VAL B . n B 1 176 ALA 176 264 264 ALA ALA B . n B 1 177 MET 177 265 265 MET MET B . n B 1 178 TYR 178 266 266 TYR TYR B . n B 1 179 MET 179 267 267 MET MET B . n B 1 180 ASP 180 268 268 ASP ASP B . n B 1 181 ALA 181 269 269 ALA ALA B . n B 1 182 GLY 182 270 270 GLY GLY B . n B 1 183 HIS 183 271 271 HIS HIS B . n B 1 184 ALA 184 272 272 ALA ALA B . n B 1 185 GLY 185 273 273 GLY GLY B . n B 1 186 TRP 186 274 274 TRP TRP B . n B 1 187 LEU 187 275 275 LEU LEU B . n B 1 188 GLY 188 276 276 GLY GLY B . n B 1 189 TRP 189 277 277 TRP TRP B . n B 1 190 PRO 190 278 278 PRO PRO B . n B 1 191 ALA 191 279 279 ALA ALA B . n B 1 192 ASN 192 280 280 ASN ASN B . n B 1 193 ILE 193 281 281 ILE ILE B . n B 1 194 GLN 194 282 282 GLN GLN B . n B 1 195 PRO 195 283 283 PRO PRO B . n B 1 196 ALA 196 284 284 ALA ALA B . n B 1 197 ALA 197 285 285 ALA ALA B . n B 1 198 GLU 198 286 286 GLU GLU B . n B 1 199 LEU 199 287 287 LEU LEU B . n B 1 200 PHE 200 288 288 PHE PHE B . n B 1 201 ALA 201 289 289 ALA ALA B . n B 1 202 LYS 202 290 290 LYS LYS B . n B 1 203 ILE 203 291 291 ILE ILE B . n B 1 204 TYR 204 292 292 TYR TYR B . n B 1 205 GLU 205 293 293 GLU GLU B . n B 1 206 ASP 206 294 294 ASP ASP B . n B 1 207 ALA 207 295 295 ALA ALA B . n B 1 208 GLY 208 296 296 GLY GLY B . n B 1 209 LYS 209 297 297 LYS LYS B . n B 1 210 PRO 210 298 298 PRO PRO B . n B 1 211 ARG 211 299 299 ARG ARG B . n B 1 212 ALA 212 300 300 ALA ALA B . n B 1 213 VAL 213 301 301 VAL VAL B . n B 1 214 ARG 214 302 302 ARG ARG B . n B 1 215 GLY 215 303 303 GLY GLY B . n B 1 216 LEU 216 304 304 LEU LEU B . n B 1 217 ALA 217 305 305 ALA ALA B . n B 1 218 THR 218 306 306 THR THR B . n B 1 219 ASN 219 307 307 ASN ASN B . n B 1 220 VAL 220 308 308 VAL VAL B . n B 1 221 ALA 221 309 309 ALA ALA B . n B 1 222 ASN 222 310 310 ASN ASN B . n B 1 223 TYR 223 311 311 TYR TYR B . n B 1 224 ASN 224 312 312 ASN ASN B . n B 1 225 ALA 225 313 313 ALA ALA B . n B 1 226 TRP 226 314 314 TRP TRP B . n B 1 227 SER 227 315 315 SER SER B . n B 1 228 VAL 228 316 316 VAL VAL B . n B 1 229 SER 229 317 317 SER SER B . n B 1 230 SER 230 318 318 SER SER B . n B 1 231 PRO 231 319 319 PRO PRO B . n B 1 232 PRO 232 320 320 PRO PRO B . n B 1 233 PRO 233 321 321 PRO PRO B . n B 1 234 TYR 234 322 322 TYR TYR B . n B 1 235 THR 235 323 323 THR THR B . n B 1 236 SER 236 324 324 SER SER B . n B 1 237 PRO 237 325 325 PRO PRO B . n B 1 238 ASN 238 326 326 ASN ASN B . n B 1 239 PRO 239 327 327 PRO PRO B . n B 1 240 ASN 240 328 328 ASN ASN B . n B 1 241 TYR 241 329 329 TYR TYR B . n B 1 242 ASP 242 330 330 ASP ASP B . n B 1 243 GLU 243 331 331 GLU GLU B . n B 1 244 LYS 244 332 332 LYS LYS B . n B 1 245 HIS 245 333 333 HIS HIS B . n B 1 246 TYR 246 334 334 TYR TYR B . n B 1 247 ILE 247 335 335 ILE ILE B . n B 1 248 GLU 248 336 336 GLU GLU B . n B 1 249 ALA 249 337 337 ALA ALA B . n B 1 250 PHE 250 338 338 PHE PHE B . n B 1 251 ARG 251 339 339 ARG ARG B . n B 1 252 PRO 252 340 340 PRO PRO B . n B 1 253 LEU 253 341 341 LEU LEU B . n B 1 254 LEU 254 342 342 LEU LEU B . n B 1 255 GLU 255 343 343 GLU GLU B . n B 1 256 ALA 256 344 344 ALA ALA B . n B 1 257 ARG 257 345 345 ARG ARG B . n B 1 258 GLY 258 346 346 GLY GLY B . n B 1 259 PHE 259 347 347 PHE PHE B . n B 1 260 PRO 260 348 348 PRO PRO B . n B 1 261 ALA 261 349 349 ALA ALA B . n B 1 262 GLN 262 350 350 GLN GLN B . n B 1 263 PHE 263 351 351 PHE PHE B . n B 1 264 ILE 264 352 352 ILE ILE B . n B 1 265 VAL 265 353 353 VAL VAL B . n B 1 266 ASP 266 354 354 ASP ASP B . n B 1 267 GLN 267 355 355 GLN GLN B . n B 1 268 GLY 268 356 356 GLY GLY B . n B 1 269 ARG 269 357 357 ARG ARG B . n B 1 270 SER 270 358 358 SER SER B . n B 1 271 GLY 271 359 359 GLY GLY B . n B 1 272 LYS 272 360 360 LYS LYS B . n B 1 273 GLN 273 361 361 GLN GLN B . n B 1 274 PRO 274 362 362 PRO PRO B . n B 1 275 THR 275 363 363 THR THR B . n B 1 276 GLY 276 364 364 GLY GLY B . n B 1 277 GLN 277 365 365 GLN GLN B . n B 1 278 LYS 278 366 366 LYS LYS B . n B 1 279 GLU 279 367 367 GLU GLU B . n B 1 280 TRP 280 368 368 TRP TRP B . n B 1 281 GLY 281 369 369 GLY GLY B . n B 1 282 HIS 282 370 370 HIS HIS B . n B 1 283 TRP 283 371 371 TRP TRP B . n B 1 284 CYS 284 372 372 CYS CYS B . n B 1 285 ASN 285 373 373 ASN ASN B . n B 1 286 ALA 286 374 374 ALA ALA B . n B 1 287 ILE 287 375 375 ILE ILE B . n B 1 288 GLY 288 376 376 GLY GLY B . n B 1 289 THR 289 377 377 THR THR B . n B 1 290 GLY 290 378 378 GLY GLY B . n B 1 291 PHE 291 379 379 PHE PHE B . n B 1 292 GLY 292 380 380 GLY GLY B . n B 1 293 MET 293 381 381 MET MET B . n B 1 294 ARG 294 382 382 ARG ARG B . n B 1 295 PRO 295 383 383 PRO PRO B . n B 1 296 THR 296 384 384 THR THR B . n B 1 297 ALA 297 385 385 ALA ALA B . n B 1 298 ASN 298 386 386 ASN ASN B . n B 1 299 THR 299 387 387 THR THR B . n B 1 300 GLY 300 388 388 GLY GLY B . n B 1 301 HIS 301 389 389 HIS HIS B . n B 1 302 GLN 302 390 390 GLN GLN B . n B 1 303 TYR 303 391 391 TYR TYR B . n B 1 304 VAL 304 392 392 VAL VAL B . n B 1 305 ASP 305 393 393 ASP ASP B . n B 1 306 ALA 306 394 394 ALA ALA B . n B 1 307 PHE 307 395 395 PHE PHE B . n B 1 308 VAL 308 396 396 VAL VAL B . n B 1 309 TRP 309 397 397 TRP TRP B . n B 1 310 VAL 310 398 398 VAL VAL B . n B 1 311 LYS 311 399 399 LYS LYS B . n B 1 312 PRO 312 400 400 PRO PRO B . n B 1 313 GLY 313 401 401 GLY GLY B . n B 1 314 GLY 314 402 402 GLY GLY B . n B 1 315 GLU 315 403 403 GLU GLU B . n B 1 316 CYS 316 404 404 CYS CYS B . n B 1 317 ASP 317 405 405 ASP ASP B . n B 1 318 GLY 318 406 406 GLY GLY B . n B 1 319 THR 319 407 407 THR THR B . n B 1 320 SER 320 408 408 SER SER B . n B 1 321 ASP 321 409 409 ASP ASP B . n B 1 322 THR 322 410 410 THR THR B . n B 1 323 THR 323 411 411 THR THR B . n B 1 324 ALA 324 412 412 ALA ALA B . n B 1 325 ALA 325 413 413 ALA ALA B . n B 1 326 ARG 326 414 414 ARG ARG B . n B 1 327 TYR 327 415 415 TYR TYR B . n B 1 328 ASP 328 416 416 ASP ASP B . n B 1 329 TYR 329 417 417 TYR TYR B . n B 1 330 HIS 330 418 418 HIS HIS B . n B 1 331 CYS 331 419 419 CYS CYS B . n B 1 332 GLY 332 420 420 GLY GLY B . n B 1 333 LEU 333 421 421 LEU LEU B . n B 1 334 GLU 334 422 422 GLU GLU B . n B 1 335 ASP 335 423 423 ASP ASP B . n B 1 336 ALA 336 424 424 ALA ALA B . n B 1 337 LEU 337 425 425 LEU LEU B . n B 1 338 LYS 338 426 426 LYS LYS B . n B 1 339 PRO 339 427 427 PRO PRO B . n B 1 340 ALA 340 428 428 ALA ALA B . n B 1 341 PRO 341 429 429 PRO PRO B . n B 1 342 GLU 342 430 430 GLU GLU B . n B 1 343 ALA 343 431 431 ALA ALA B . n B 1 344 GLY 344 432 432 GLY GLY B . n B 1 345 GLN 345 433 433 GLN GLN B . n B 1 346 TRP 346 434 434 TRP TRP B . n B 1 347 PHE 347 435 435 PHE PHE B . n B 1 348 ASN 348 436 436 ASN ASN B . n B 1 349 GLU 349 437 437 GLU GLU B . n B 1 350 TYR 350 438 438 TYR TYR B . n B 1 351 PHE 351 439 439 PHE PHE B . n B 1 352 ILE 352 440 440 ILE ILE B . n B 1 353 GLN 353 441 441 GLN GLN B . n B 1 354 LEU 354 442 442 LEU LEU B . n B 1 355 LEU 355 443 443 LEU LEU B . n B 1 356 ARG 356 444 444 ARG ARG B . n B 1 357 ASN 357 445 445 ASN ASN B . n B 1 358 ALA 358 446 446 ALA ALA B . n B 1 359 ASN 359 447 447 ASN ASN B . n B 1 360 PRO 360 448 448 PRO PRO B . n B 1 361 PRO 361 449 449 PRO PRO B . n B 1 362 PHE 362 450 450 PHE PHE B . 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 C 2 NAG 1 451 451 NAG NAG A . D 3 GTM 1 452 452 GTM GTM A . E 4 BGC 2 453 453 BGC BGC A . F 4 BGC 3 454 454 BGC BGC A . G 5 GDA 1 455 455 GDA GDA A . H 3 GTM 1 456 456 GTM GTM A . I 4 BGC 2 457 457 BGC BGC A . J 4 BGC 3 458 458 BGC BGC A . K 6 GOL 1 459 459 GOL GOL A . L 2 NAG 1 451 451 NAG NAG B . M 3 GTM 1 452 452 GTM GTM B . N 4 BGC 2 453 453 BGC BGC B . O 4 BGC 3 454 454 BGC BGC B . P 5 GDA 1 455 455 GDA GDA B . Q 3 GTM 1 456 456 GTM GTM B . R 4 BGC 2 457 457 BGC BGC B . S 4 BGC 3 458 458 BGC BGC B . T 6 GOL 1 459 459 GOL GOL B . U 7 FLG 1 460 460 FLG FLG B . V 8 HOH 1 2001 2001 HOH HOH A . V 8 HOH 2 2002 2002 HOH HOH A . V 8 HOH 3 2003 2003 HOH HOH A . V 8 HOH 4 2004 2004 HOH HOH A . V 8 HOH 5 2005 2005 HOH HOH A . V 8 HOH 6 2006 2006 HOH HOH A . V 8 HOH 7 2007 2007 HOH HOH A . V 8 HOH 8 2008 2008 HOH HOH A . V 8 HOH 9 2009 2009 HOH HOH A . V 8 HOH 10 2010 2010 HOH HOH A . V 8 HOH 11 2011 2011 HOH HOH A . V 8 HOH 12 2012 2012 HOH HOH A . V 8 HOH 13 2013 2013 HOH HOH A . V 8 HOH 14 2014 2014 HOH HOH A . V 8 HOH 15 2015 2015 HOH HOH A . V 8 HOH 16 2016 2016 HOH HOH A . V 8 HOH 17 2017 2017 HOH HOH A . V 8 HOH 18 2018 2018 HOH HOH A . V 8 HOH 19 2019 2019 HOH HOH A . V 8 HOH 20 2020 2020 HOH HOH A . V 8 HOH 21 2021 2021 HOH HOH A . V 8 HOH 22 2022 2022 HOH HOH A . V 8 HOH 23 2023 2023 HOH HOH A . V 8 HOH 24 2024 2024 HOH HOH A . V 8 HOH 25 2025 2025 HOH HOH A . V 8 HOH 26 2026 2026 HOH HOH A . V 8 HOH 27 2027 2027 HOH HOH A . V 8 HOH 28 2028 2028 HOH HOH A . V 8 HOH 29 2029 2029 HOH HOH A . V 8 HOH 30 2030 2030 HOH HOH A . V 8 HOH 31 2031 2031 HOH HOH A . V 8 HOH 32 2032 2032 HOH HOH A . V 8 HOH 33 2033 2033 HOH HOH A . V 8 HOH 34 2034 2034 HOH HOH A . V 8 HOH 35 2035 2035 HOH HOH A . V 8 HOH 36 2036 2036 HOH HOH A . V 8 HOH 37 2037 2037 HOH HOH A . V 8 HOH 38 2038 2038 HOH HOH A . V 8 HOH 39 2039 2039 HOH HOH A . V 8 HOH 40 2040 2040 HOH HOH A . V 8 HOH 41 2041 2041 HOH HOH A . V 8 HOH 42 2042 2042 HOH HOH A . V 8 HOH 43 2043 2043 HOH HOH A . V 8 HOH 44 2044 2044 HOH HOH A . V 8 HOH 45 2045 2045 HOH HOH A . V 8 HOH 46 2046 2046 HOH HOH A . V 8 HOH 47 2047 2047 HOH HOH A . V 8 HOH 48 2048 2048 HOH HOH A . V 8 HOH 49 2049 2049 HOH HOH A . V 8 HOH 50 2050 2050 HOH HOH A . V 8 HOH 51 2051 2051 HOH HOH A . V 8 HOH 52 2052 2052 HOH HOH A . V 8 HOH 53 2053 2053 HOH HOH A . V 8 HOH 54 2054 2054 HOH HOH A . V 8 HOH 55 2055 2055 HOH HOH A . V 8 HOH 56 2056 2056 HOH HOH A . V 8 HOH 57 2057 2057 HOH HOH A . V 8 HOH 58 2058 2058 HOH HOH A . V 8 HOH 59 2059 2059 HOH HOH A . V 8 HOH 60 2060 2060 HOH HOH A . V 8 HOH 61 2061 2061 HOH HOH A . V 8 HOH 62 2062 2062 HOH HOH A . V 8 HOH 63 2063 2063 HOH HOH A . V 8 HOH 64 2064 2064 HOH HOH A . V 8 HOH 65 2065 2065 HOH HOH A . V 8 HOH 66 2066 2066 HOH HOH A . V 8 HOH 67 2067 2067 HOH HOH A . V 8 HOH 68 2068 2068 HOH HOH A . V 8 HOH 69 2069 2069 HOH HOH A . V 8 HOH 70 2070 2070 HOH HOH A . V 8 HOH 71 2071 2071 HOH HOH A . V 8 HOH 72 2072 2072 HOH HOH A . V 8 HOH 73 2073 2073 HOH HOH A . V 8 HOH 74 2074 2074 HOH HOH A . V 8 HOH 75 2075 2075 HOH HOH A . V 8 HOH 76 2076 2076 HOH HOH A . V 8 HOH 77 2077 2077 HOH HOH A . V 8 HOH 78 2078 2078 HOH HOH A . V 8 HOH 79 2079 2079 HOH HOH A . V 8 HOH 80 2080 2080 HOH HOH A . V 8 HOH 81 2081 2081 HOH HOH A . V 8 HOH 82 2082 2082 HOH HOH A . V 8 HOH 83 2083 2083 HOH HOH A . V 8 HOH 84 2084 2084 HOH HOH A . V 8 HOH 85 2085 2085 HOH HOH A . V 8 HOH 86 2086 2086 HOH HOH A . V 8 HOH 87 2087 2087 HOH HOH A . V 8 HOH 88 2088 2088 HOH HOH A . V 8 HOH 89 2089 2089 HOH HOH A . V 8 HOH 90 2090 2090 HOH HOH A . V 8 HOH 91 2091 2091 HOH HOH A . V 8 HOH 92 2092 2092 HOH HOH A . V 8 HOH 93 2093 2093 HOH HOH A . V 8 HOH 94 2094 2094 HOH HOH A . V 8 HOH 95 2095 2095 HOH HOH A . V 8 HOH 96 2096 2096 HOH HOH A . V 8 HOH 97 2097 2097 HOH HOH A . V 8 HOH 98 2098 2098 HOH HOH A . V 8 HOH 99 2099 2099 HOH HOH A . V 8 HOH 100 2100 2100 HOH HOH A . V 8 HOH 101 2101 2101 HOH HOH A . V 8 HOH 102 2102 2102 HOH HOH A . V 8 HOH 103 2103 2103 HOH HOH A . V 8 HOH 104 2104 2104 HOH HOH A . V 8 HOH 105 2105 2105 HOH HOH A . V 8 HOH 106 2106 2106 HOH HOH A . V 8 HOH 107 2107 2107 HOH HOH A . V 8 HOH 108 2108 2108 HOH HOH A . V 8 HOH 109 2109 2109 HOH HOH A . V 8 HOH 110 2110 2110 HOH HOH A . V 8 HOH 111 2111 2111 HOH HOH A . V 8 HOH 112 2112 2112 HOH HOH A . V 8 HOH 113 2113 2113 HOH HOH A . V 8 HOH 114 2114 2114 HOH HOH A . V 8 HOH 115 2115 2115 HOH HOH A . V 8 HOH 116 2116 2116 HOH HOH A . V 8 HOH 117 2117 2117 HOH HOH A . V 8 HOH 118 2118 2118 HOH HOH A . V 8 HOH 119 2119 2119 HOH HOH A . V 8 HOH 120 2120 2120 HOH HOH A . V 8 HOH 121 2121 2121 HOH HOH A . V 8 HOH 122 2122 2122 HOH HOH A . V 8 HOH 123 2123 2123 HOH HOH A . V 8 HOH 124 2124 2124 HOH HOH A . V 8 HOH 125 2125 2125 HOH HOH A . V 8 HOH 126 2126 2126 HOH HOH A . V 8 HOH 127 2127 2127 HOH HOH A . V 8 HOH 128 2128 2128 HOH HOH A . V 8 HOH 129 2129 2129 HOH HOH A . V 8 HOH 130 2130 2130 HOH HOH A . V 8 HOH 131 2131 2131 HOH HOH A . V 8 HOH 132 2132 2132 HOH HOH A . V 8 HOH 133 2133 2133 HOH HOH A . V 8 HOH 134 2134 2134 HOH HOH A . V 8 HOH 135 2135 2135 HOH HOH A . V 8 HOH 136 2136 2136 HOH HOH A . V 8 HOH 137 2137 2137 HOH HOH A . V 8 HOH 138 2138 2138 HOH HOH A . V 8 HOH 139 2139 2139 HOH HOH A . V 8 HOH 140 2140 2140 HOH HOH A . V 8 HOH 141 2141 2141 HOH HOH A . V 8 HOH 142 2142 2142 HOH HOH A . V 8 HOH 143 2143 2143 HOH HOH A . V 8 HOH 144 2144 2144 HOH HOH A . V 8 HOH 145 2145 2145 HOH HOH A . V 8 HOH 146 2146 2146 HOH HOH A . V 8 HOH 147 2147 2147 HOH HOH A . V 8 HOH 148 2148 2148 HOH HOH A . V 8 HOH 149 2149 2149 HOH HOH A . V 8 HOH 150 2150 2150 HOH HOH A . V 8 HOH 151 2151 2151 HOH HOH A . V 8 HOH 152 2152 2152 HOH HOH A . V 8 HOH 153 2153 2153 HOH HOH A . V 8 HOH 154 2154 2154 HOH HOH A . V 8 HOH 155 2155 2155 HOH HOH A . V 8 HOH 156 2156 2156 HOH HOH A . V 8 HOH 157 2157 2157 HOH HOH A . V 8 HOH 158 2158 2158 HOH HOH A . V 8 HOH 159 2159 2159 HOH HOH A . V 8 HOH 160 2160 2160 HOH HOH A . V 8 HOH 161 2161 2161 HOH HOH A . V 8 HOH 162 2162 2162 HOH HOH A . V 8 HOH 163 2163 2163 HOH HOH A . V 8 HOH 164 2164 2164 HOH HOH A . V 8 HOH 165 2165 2165 HOH HOH A . V 8 HOH 166 2166 2166 HOH HOH A . V 8 HOH 167 2167 2167 HOH HOH A . V 8 HOH 168 2168 2168 HOH HOH A . V 8 HOH 169 2169 2169 HOH HOH A . V 8 HOH 170 2170 2170 HOH HOH A . V 8 HOH 171 2171 2171 HOH HOH A . V 8 HOH 172 2172 2172 HOH HOH A . V 8 HOH 173 2173 2173 HOH HOH A . V 8 HOH 174 2174 2174 HOH HOH A . V 8 HOH 175 2175 2175 HOH HOH A . V 8 HOH 176 2176 2176 HOH HOH A . V 8 HOH 177 2177 2177 HOH HOH A . V 8 HOH 178 2178 2178 HOH HOH A . V 8 HOH 179 2179 2179 HOH HOH A . V 8 HOH 180 2180 2180 HOH HOH A . V 8 HOH 181 2181 2181 HOH HOH A . V 8 HOH 182 2182 2182 HOH HOH A . V 8 HOH 183 2183 2183 HOH HOH A . V 8 HOH 184 2184 2184 HOH HOH A . V 8 HOH 185 2185 2185 HOH HOH A . V 8 HOH 186 2186 2186 HOH HOH A . V 8 HOH 187 2187 2187 HOH HOH A . V 8 HOH 188 2188 2188 HOH HOH A . V 8 HOH 189 2189 2189 HOH HOH A . V 8 HOH 190 2190 2190 HOH HOH A . V 8 HOH 191 2191 2191 HOH HOH A . V 8 HOH 192 2192 2192 HOH HOH A . V 8 HOH 193 2193 2193 HOH HOH A . V 8 HOH 194 2194 2194 HOH HOH A . V 8 HOH 195 2195 2195 HOH HOH A . V 8 HOH 196 2196 2196 HOH HOH A . V 8 HOH 197 2197 2197 HOH HOH A . V 8 HOH 198 2198 2198 HOH HOH A . V 8 HOH 199 2199 2199 HOH HOH A . V 8 HOH 200 2200 2200 HOH HOH A . V 8 HOH 201 2201 2201 HOH HOH A . V 8 HOH 202 2202 2202 HOH HOH A . V 8 HOH 203 2203 2203 HOH HOH A . V 8 HOH 204 2204 2204 HOH HOH A . V 8 HOH 205 2205 2205 HOH HOH A . V 8 HOH 206 2206 2206 HOH HOH A . V 8 HOH 207 2207 2207 HOH HOH A . V 8 HOH 208 2208 2208 HOH HOH A . V 8 HOH 209 2209 2209 HOH HOH A . V 8 HOH 210 2210 2210 HOH HOH A . V 8 HOH 211 2211 2211 HOH HOH A . V 8 HOH 212 2212 2212 HOH HOH A . V 8 HOH 213 2213 2213 HOH HOH A . V 8 HOH 214 2214 2214 HOH HOH A . V 8 HOH 215 2215 2215 HOH HOH A . V 8 HOH 216 2216 2216 HOH HOH A . V 8 HOH 217 2217 2217 HOH HOH A . V 8 HOH 218 2218 2218 HOH HOH A . V 8 HOH 219 2219 2219 HOH HOH A . V 8 HOH 220 2220 2220 HOH HOH A . V 8 HOH 221 2221 2221 HOH HOH A . V 8 HOH 222 2222 2222 HOH HOH A . V 8 HOH 223 2223 2223 HOH HOH A . V 8 HOH 224 2224 2224 HOH HOH A . V 8 HOH 225 2225 2225 HOH HOH A . V 8 HOH 226 2226 2226 HOH HOH A . V 8 HOH 227 2227 2227 HOH HOH A . V 8 HOH 228 2228 2228 HOH HOH A . V 8 HOH 229 2229 2229 HOH HOH A . V 8 HOH 230 2230 2230 HOH HOH A . V 8 HOH 231 2231 2231 HOH HOH A . V 8 HOH 232 2232 2232 HOH HOH A . V 8 HOH 233 2233 2233 HOH HOH A . V 8 HOH 234 2234 2234 HOH HOH A . V 8 HOH 235 2235 2235 HOH HOH A . V 8 HOH 236 2236 2236 HOH HOH A . V 8 HOH 237 2237 2237 HOH HOH A . V 8 HOH 238 2238 2238 HOH HOH A . V 8 HOH 239 2239 2239 HOH HOH A . V 8 HOH 240 2240 2240 HOH HOH A . V 8 HOH 241 2241 2241 HOH HOH A . V 8 HOH 242 2242 2242 HOH HOH A . V 8 HOH 243 2243 2243 HOH HOH A . V 8 HOH 244 2244 2244 HOH HOH A . V 8 HOH 245 2245 2245 HOH HOH A . V 8 HOH 246 2246 2246 HOH HOH A . V 8 HOH 247 2247 2247 HOH HOH A . V 8 HOH 248 2248 2248 HOH HOH A . V 8 HOH 249 2249 2249 HOH HOH A . V 8 HOH 250 2250 2250 HOH HOH A . V 8 HOH 251 2251 2251 HOH HOH A . V 8 HOH 252 2252 2252 HOH HOH A . V 8 HOH 253 2253 2253 HOH HOH A . V 8 HOH 254 2254 2254 HOH HOH A . V 8 HOH 255 2255 2255 HOH HOH A . V 8 HOH 256 2256 2256 HOH HOH A . V 8 HOH 257 2257 2257 HOH HOH A . V 8 HOH 258 2258 2258 HOH HOH A . V 8 HOH 259 2259 2259 HOH HOH A . V 8 HOH 260 2260 2260 HOH HOH A . V 8 HOH 261 2261 2261 HOH HOH A . V 8 HOH 262 2262 2262 HOH HOH A . V 8 HOH 263 2263 2263 HOH HOH A . V 8 HOH 264 2264 2264 HOH HOH A . V 8 HOH 265 2265 2265 HOH HOH A . V 8 HOH 266 2266 2266 HOH HOH A . V 8 HOH 267 2267 2267 HOH HOH A . V 8 HOH 268 2268 2268 HOH HOH A . V 8 HOH 269 2269 2269 HOH HOH A . V 8 HOH 270 2270 2270 HOH HOH A . V 8 HOH 271 2271 2271 HOH HOH A . V 8 HOH 272 2272 2272 HOH HOH A . V 8 HOH 273 2273 2273 HOH HOH A . V 8 HOH 274 2274 2274 HOH HOH A . V 8 HOH 275 2275 2275 HOH HOH A . V 8 HOH 276 2276 2276 HOH HOH A . V 8 HOH 277 2277 2277 HOH HOH A . V 8 HOH 278 2278 2278 HOH HOH A . V 8 HOH 279 2279 2279 HOH HOH A . V 8 HOH 280 2280 2280 HOH HOH A . V 8 HOH 281 2281 2281 HOH HOH A . V 8 HOH 282 2282 2282 HOH HOH A . V 8 HOH 283 2283 2283 HOH HOH A . V 8 HOH 284 2284 2284 HOH HOH A . V 8 HOH 285 2285 2285 HOH HOH A . V 8 HOH 286 2286 2286 HOH HOH A . V 8 HOH 287 2287 2287 HOH HOH A . V 8 HOH 288 2288 2288 HOH HOH A . V 8 HOH 289 2289 2289 HOH HOH A . V 8 HOH 290 2290 2290 HOH HOH A . V 8 HOH 291 2291 2291 HOH HOH A . V 8 HOH 292 2292 2292 HOH HOH A . V 8 HOH 293 2293 2293 HOH HOH A . V 8 HOH 294 2294 2294 HOH HOH A . V 8 HOH 295 2295 2295 HOH HOH A . V 8 HOH 296 2296 2296 HOH HOH A . V 8 HOH 297 2297 2297 HOH HOH A . V 8 HOH 298 2298 2298 HOH HOH A . V 8 HOH 299 2299 2299 HOH HOH A . V 8 HOH 300 2300 2300 HOH HOH A . V 8 HOH 301 2301 2301 HOH HOH A . V 8 HOH 302 2302 2302 HOH HOH A . V 8 HOH 303 2303 2303 HOH HOH A . V 8 HOH 304 2304 2304 HOH HOH A . V 8 HOH 305 2305 2305 HOH HOH A . V 8 HOH 306 2306 2306 HOH HOH A . V 8 HOH 307 2307 2307 HOH HOH A . V 8 HOH 308 2308 2308 HOH HOH A . V 8 HOH 309 2309 2309 HOH HOH A . V 8 HOH 310 2310 2310 HOH HOH A . V 8 HOH 311 2311 2311 HOH HOH A . V 8 HOH 312 2312 2312 HOH HOH A . V 8 HOH 313 2313 2313 HOH HOH A . V 8 HOH 314 2314 2314 HOH HOH A . V 8 HOH 315 2315 2315 HOH HOH A . V 8 HOH 316 2316 2316 HOH HOH A . V 8 HOH 317 2317 2317 HOH HOH A . V 8 HOH 318 2318 2318 HOH HOH A . V 8 HOH 319 2319 2319 HOH HOH A . V 8 HOH 320 2320 2320 HOH HOH A . V 8 HOH 321 2321 2321 HOH HOH A . V 8 HOH 322 2322 2322 HOH HOH A . V 8 HOH 323 2323 2323 HOH HOH A . V 8 HOH 324 2324 2324 HOH HOH A . V 8 HOH 325 2325 2325 HOH HOH A . V 8 HOH 326 2326 2326 HOH HOH A . V 8 HOH 327 2327 2327 HOH HOH A . V 8 HOH 328 2328 2328 HOH HOH A . V 8 HOH 329 2329 2329 HOH HOH A . V 8 HOH 330 2330 2330 HOH HOH A . V 8 HOH 331 2331 2331 HOH HOH A . V 8 HOH 332 2332 2332 HOH HOH A . V 8 HOH 333 2333 2333 HOH HOH A . V 8 HOH 334 2334 2334 HOH HOH A . V 8 HOH 335 2335 2335 HOH HOH A . V 8 HOH 336 2336 2336 HOH HOH A . V 8 HOH 337 2337 2337 HOH HOH A . V 8 HOH 338 2338 2338 HOH HOH A . V 8 HOH 339 2339 2339 HOH HOH A . V 8 HOH 340 2340 2340 HOH HOH A . V 8 HOH 341 2341 2341 HOH HOH A . V 8 HOH 342 2342 2342 HOH HOH A . V 8 HOH 343 2343 2343 HOH HOH A . V 8 HOH 344 2344 2344 HOH HOH A . V 8 HOH 345 2345 2345 HOH HOH A . V 8 HOH 346 2346 2346 HOH HOH A . V 8 HOH 347 2347 2347 HOH HOH A . V 8 HOH 348 2348 2348 HOH HOH A . V 8 HOH 349 2349 2349 HOH HOH A . V 8 HOH 350 2350 2350 HOH HOH A . V 8 HOH 351 2351 2351 HOH HOH A . V 8 HOH 352 2352 2352 HOH HOH A . V 8 HOH 353 2353 2353 HOH HOH A . V 8 HOH 354 2354 2354 HOH HOH A . V 8 HOH 355 2355 2355 HOH HOH A . V 8 HOH 356 2356 2356 HOH HOH A . V 8 HOH 357 2357 2357 HOH HOH A . V 8 HOH 358 2358 2358 HOH HOH A . V 8 HOH 359 2359 2359 HOH HOH A . V 8 HOH 360 2360 2360 HOH HOH A . V 8 HOH 361 2361 2361 HOH HOH A . V 8 HOH 362 2362 2362 HOH HOH A . V 8 HOH 363 2363 2363 HOH HOH A . V 8 HOH 364 2364 2364 HOH HOH A . V 8 HOH 365 2365 2365 HOH HOH A . V 8 HOH 366 2366 2366 HOH HOH A . V 8 HOH 367 2367 2367 HOH HOH A . V 8 HOH 368 2368 2368 HOH HOH A . V 8 HOH 369 2369 2369 HOH HOH A . V 8 HOH 370 2370 2370 HOH HOH A . V 8 HOH 371 2371 2371 HOH HOH A . V 8 HOH 372 2372 2372 HOH HOH A . V 8 HOH 373 2373 2373 HOH HOH A . V 8 HOH 374 2374 2374 HOH HOH A . V 8 HOH 375 2375 2375 HOH HOH A . V 8 HOH 376 2376 2376 HOH HOH A . V 8 HOH 377 2377 2377 HOH HOH A . V 8 HOH 378 2378 2378 HOH HOH A . V 8 HOH 379 2379 2379 HOH HOH A . V 8 HOH 380 2380 2380 HOH HOH A . V 8 HOH 381 2381 2381 HOH HOH A . V 8 HOH 382 2382 2382 HOH HOH A . V 8 HOH 383 2383 2383 HOH HOH A . V 8 HOH 384 2384 2384 HOH HOH A . V 8 HOH 385 2385 2385 HOH HOH A . V 8 HOH 386 2386 2386 HOH HOH A . V 8 HOH 387 2387 2387 HOH HOH A . V 8 HOH 388 2388 2388 HOH HOH A . V 8 HOH 389 2389 2389 HOH HOH A . V 8 HOH 390 2390 2390 HOH HOH A . V 8 HOH 391 2391 2391 HOH HOH A . V 8 HOH 392 2392 2392 HOH HOH A . V 8 HOH 393 2393 2393 HOH HOH A . V 8 HOH 394 2394 2394 HOH HOH A . V 8 HOH 395 2395 2395 HOH HOH A . V 8 HOH 396 2396 2396 HOH HOH A . V 8 HOH 397 2397 2397 HOH HOH A . V 8 HOH 398 2398 2398 HOH HOH A . V 8 HOH 399 2399 2399 HOH HOH A . V 8 HOH 400 2400 2400 HOH HOH A . V 8 HOH 401 2401 2401 HOH HOH A . V 8 HOH 402 2402 2402 HOH HOH A . V 8 HOH 403 2403 2403 HOH HOH A . V 8 HOH 404 2404 2404 HOH HOH A . W 8 HOH 1 2001 2001 HOH HOH B . W 8 HOH 2 2002 2002 HOH HOH B . W 8 HOH 3 2003 2003 HOH HOH B . W 8 HOH 4 2004 2004 HOH HOH B . W 8 HOH 5 2005 2005 HOH HOH B . W 8 HOH 6 2006 2006 HOH HOH B . W 8 HOH 7 2007 2007 HOH HOH B . W 8 HOH 8 2008 2008 HOH HOH B . W 8 HOH 9 2009 2009 HOH HOH B . W 8 HOH 10 2010 2010 HOH HOH B . W 8 HOH 11 2011 2011 HOH HOH B . W 8 HOH 12 2012 2012 HOH HOH B . W 8 HOH 13 2013 2013 HOH HOH B . W 8 HOH 14 2014 2014 HOH HOH B . W 8 HOH 15 2015 2015 HOH HOH B . W 8 HOH 16 2016 2016 HOH HOH B . W 8 HOH 17 2017 2017 HOH HOH B . W 8 HOH 18 2018 2018 HOH HOH B . W 8 HOH 19 2019 2019 HOH HOH B . W 8 HOH 20 2020 2020 HOH HOH B . W 8 HOH 21 2021 2021 HOH HOH B . W 8 HOH 22 2022 2022 HOH HOH B . W 8 HOH 23 2023 2023 HOH HOH B . W 8 HOH 24 2024 2024 HOH HOH B . W 8 HOH 25 2025 2025 HOH HOH B . W 8 HOH 26 2026 2026 HOH HOH B . W 8 HOH 27 2027 2027 HOH HOH B . W 8 HOH 28 2028 2028 HOH HOH B . W 8 HOH 29 2029 2029 HOH HOH B . W 8 HOH 30 2030 2030 HOH HOH B . W 8 HOH 31 2031 2031 HOH HOH B . W 8 HOH 32 2032 2032 HOH HOH B . W 8 HOH 33 2033 2033 HOH HOH B . W 8 HOH 34 2034 2034 HOH HOH B . W 8 HOH 35 2035 2035 HOH HOH B . W 8 HOH 36 2036 2036 HOH HOH B . W 8 HOH 37 2037 2037 HOH HOH B . W 8 HOH 38 2038 2038 HOH HOH B . W 8 HOH 39 2039 2039 HOH HOH B . W 8 HOH 40 2040 2040 HOH HOH B . W 8 HOH 41 2041 2041 HOH HOH B . W 8 HOH 42 2042 2042 HOH HOH B . W 8 HOH 43 2043 2043 HOH HOH B . W 8 HOH 44 2044 2044 HOH HOH B . W 8 HOH 45 2045 2045 HOH HOH B . W 8 HOH 46 2046 2046 HOH HOH B . W 8 HOH 47 2047 2047 HOH HOH B . W 8 HOH 48 2048 2048 HOH HOH B . W 8 HOH 49 2049 2049 HOH HOH B . W 8 HOH 50 2050 2050 HOH HOH B . W 8 HOH 51 2051 2051 HOH HOH B . W 8 HOH 52 2052 2052 HOH HOH B . W 8 HOH 53 2053 2053 HOH HOH B . W 8 HOH 54 2054 2054 HOH HOH B . W 8 HOH 55 2055 2055 HOH HOH B . W 8 HOH 56 2056 2056 HOH HOH B . W 8 HOH 57 2057 2057 HOH HOH B . W 8 HOH 58 2058 2058 HOH HOH B . W 8 HOH 59 2059 2059 HOH HOH B . W 8 HOH 60 2060 2060 HOH HOH B . W 8 HOH 61 2061 2061 HOH HOH B . W 8 HOH 62 2062 2062 HOH HOH B . W 8 HOH 63 2063 2063 HOH HOH B . W 8 HOH 64 2064 2064 HOH HOH B . W 8 HOH 65 2065 2065 HOH HOH B . W 8 HOH 66 2066 2066 HOH HOH B . W 8 HOH 67 2067 2067 HOH HOH B . W 8 HOH 68 2068 2068 HOH HOH B . W 8 HOH 69 2069 2069 HOH HOH B . W 8 HOH 70 2070 2070 HOH HOH B . W 8 HOH 71 2071 2071 HOH HOH B . W 8 HOH 72 2072 2072 HOH HOH B . W 8 HOH 73 2073 2073 HOH HOH B . W 8 HOH 74 2074 2074 HOH HOH B . W 8 HOH 75 2075 2075 HOH HOH B . W 8 HOH 76 2076 2076 HOH HOH B . W 8 HOH 77 2077 2077 HOH HOH B . W 8 HOH 78 2078 2078 HOH HOH B . W 8 HOH 79 2079 2079 HOH HOH B . W 8 HOH 80 2080 2080 HOH HOH B . W 8 HOH 81 2081 2081 HOH HOH B . W 8 HOH 82 2082 2082 HOH HOH B . W 8 HOH 83 2083 2083 HOH HOH B . W 8 HOH 84 2084 2084 HOH HOH B . W 8 HOH 85 2085 2085 HOH HOH B . W 8 HOH 86 2086 2086 HOH HOH B . W 8 HOH 87 2087 2087 HOH HOH B . W 8 HOH 88 2088 2088 HOH HOH B . W 8 HOH 89 2089 2089 HOH HOH B . W 8 HOH 90 2090 2090 HOH HOH B . W 8 HOH 91 2091 2091 HOH HOH B . W 8 HOH 92 2092 2092 HOH HOH B . W 8 HOH 93 2093 2093 HOH HOH B . W 8 HOH 94 2094 2094 HOH HOH B . W 8 HOH 95 2095 2095 HOH HOH B . W 8 HOH 96 2096 2096 HOH HOH B . W 8 HOH 97 2097 2097 HOH HOH B . W 8 HOH 98 2098 2098 HOH HOH B . W 8 HOH 99 2099 2099 HOH HOH B . W 8 HOH 100 2100 2100 HOH HOH B . W 8 HOH 101 2101 2101 HOH HOH B . W 8 HOH 102 2102 2102 HOH HOH B . W 8 HOH 103 2103 2103 HOH HOH B . W 8 HOH 104 2104 2104 HOH HOH B . W 8 HOH 105 2105 2105 HOH HOH B . W 8 HOH 106 2106 2106 HOH HOH B . W 8 HOH 107 2107 2107 HOH HOH B . W 8 HOH 108 2108 2108 HOH HOH B . W 8 HOH 109 2109 2109 HOH HOH B . W 8 HOH 110 2110 2110 HOH HOH B . W 8 HOH 111 2111 2111 HOH HOH B . W 8 HOH 112 2112 2112 HOH HOH B . W 8 HOH 113 2113 2113 HOH HOH B . W 8 HOH 114 2114 2114 HOH HOH B . W 8 HOH 115 2115 2115 HOH HOH B . W 8 HOH 116 2116 2116 HOH HOH B . W 8 HOH 117 2117 2117 HOH HOH B . W 8 HOH 118 2118 2118 HOH HOH B . W 8 HOH 119 2119 2119 HOH HOH B . W 8 HOH 120 2120 2120 HOH HOH B . W 8 HOH 121 2121 2121 HOH HOH B . W 8 HOH 122 2122 2122 HOH HOH B . W 8 HOH 123 2123 2123 HOH HOH B . W 8 HOH 124 2124 2124 HOH HOH B . W 8 HOH 125 2125 2125 HOH HOH B . W 8 HOH 126 2126 2126 HOH HOH B . W 8 HOH 127 2127 2127 HOH HOH B . W 8 HOH 128 2128 2128 HOH HOH B . W 8 HOH 129 2129 2129 HOH HOH B . W 8 HOH 130 2130 2130 HOH HOH B . W 8 HOH 131 2131 2131 HOH HOH B . W 8 HOH 132 2132 2132 HOH HOH B . W 8 HOH 133 2133 2133 HOH HOH B . W 8 HOH 134 2134 2134 HOH HOH B . W 8 HOH 135 2135 2135 HOH HOH B . W 8 HOH 136 2136 2136 HOH HOH B . W 8 HOH 137 2137 2137 HOH HOH B . W 8 HOH 138 2138 2138 HOH HOH B . W 8 HOH 139 2139 2139 HOH HOH B . W 8 HOH 140 2140 2140 HOH HOH B . W 8 HOH 141 2141 2141 HOH HOH B . W 8 HOH 142 2142 2142 HOH HOH B . W 8 HOH 143 2143 2143 HOH HOH B . W 8 HOH 144 2144 2144 HOH HOH B . W 8 HOH 145 2145 2145 HOH HOH B . W 8 HOH 146 2146 2146 HOH HOH B . W 8 HOH 147 2147 2147 HOH HOH B . W 8 HOH 148 2148 2148 HOH HOH B . W 8 HOH 149 2149 2149 HOH HOH B . W 8 HOH 150 2150 2150 HOH HOH B . W 8 HOH 151 2151 2151 HOH HOH B . W 8 HOH 152 2152 2152 HOH HOH B . W 8 HOH 153 2153 2153 HOH HOH B . W 8 HOH 154 2154 2154 HOH HOH B . W 8 HOH 155 2155 2155 HOH HOH B . W 8 HOH 156 2156 2156 HOH HOH B . W 8 HOH 157 2157 2157 HOH HOH B . W 8 HOH 158 2158 2158 HOH HOH B . W 8 HOH 159 2159 2159 HOH HOH B . W 8 HOH 160 2160 2160 HOH HOH B . W 8 HOH 161 2161 2161 HOH HOH B . W 8 HOH 162 2162 2162 HOH HOH B . W 8 HOH 163 2163 2163 HOH HOH B . W 8 HOH 164 2164 2164 HOH HOH B . W 8 HOH 165 2165 2165 HOH HOH B . W 8 HOH 166 2166 2166 HOH HOH B . W 8 HOH 167 2167 2167 HOH HOH B . W 8 HOH 168 2168 2168 HOH HOH B . W 8 HOH 169 2169 2169 HOH HOH B . W 8 HOH 170 2170 2170 HOH HOH B . W 8 HOH 171 2171 2171 HOH HOH B . W 8 HOH 172 2172 2172 HOH HOH B . W 8 HOH 173 2173 2173 HOH HOH B . W 8 HOH 174 2174 2174 HOH HOH B . W 8 HOH 175 2175 2175 HOH HOH B . W 8 HOH 176 2176 2176 HOH HOH B . W 8 HOH 177 2177 2177 HOH HOH B . W 8 HOH 178 2178 2178 HOH HOH B . W 8 HOH 179 2179 2179 HOH HOH B . W 8 HOH 180 2180 2180 HOH HOH B . W 8 HOH 181 2181 2181 HOH HOH B . W 8 HOH 182 2182 2182 HOH HOH B . W 8 HOH 183 2183 2183 HOH HOH B . W 8 HOH 184 2184 2184 HOH HOH B . W 8 HOH 185 2185 2185 HOH HOH B . W 8 HOH 186 2186 2186 HOH HOH B . W 8 HOH 187 2187 2187 HOH HOH B . W 8 HOH 188 2188 2188 HOH HOH B . W 8 HOH 189 2189 2189 HOH HOH B . W 8 HOH 190 2190 2190 HOH HOH B . W 8 HOH 191 2191 2191 HOH HOH B . W 8 HOH 192 2192 2192 HOH HOH B . W 8 HOH 193 2193 2193 HOH HOH B . W 8 HOH 194 2194 2194 HOH HOH B . W 8 HOH 195 2195 2195 HOH HOH B . W 8 HOH 196 2196 2196 HOH HOH B . W 8 HOH 197 2197 2197 HOH HOH B . W 8 HOH 198 2198 2198 HOH HOH B . W 8 HOH 199 2199 2199 HOH HOH B . W 8 HOH 200 2200 2200 HOH HOH B . W 8 HOH 201 2201 2201 HOH HOH B . W 8 HOH 202 2202 2202 HOH HOH B . W 8 HOH 203 2203 2203 HOH HOH B . W 8 HOH 204 2204 2204 HOH HOH B . W 8 HOH 205 2205 2205 HOH HOH B . W 8 HOH 206 2206 2206 HOH HOH B . W 8 HOH 207 2207 2207 HOH HOH B . W 8 HOH 208 2208 2208 HOH HOH B . W 8 HOH 209 2209 2209 HOH HOH B . W 8 HOH 210 2210 2210 HOH HOH B . W 8 HOH 211 2211 2211 HOH HOH B . W 8 HOH 212 2212 2212 HOH HOH B . W 8 HOH 213 2213 2213 HOH HOH B . W 8 HOH 214 2214 2214 HOH HOH B . W 8 HOH 215 2215 2215 HOH HOH B . W 8 HOH 216 2216 2216 HOH HOH B . W 8 HOH 217 2217 2217 HOH HOH B . W 8 HOH 218 2218 2218 HOH HOH B . W 8 HOH 219 2219 2219 HOH HOH B . W 8 HOH 220 2220 2220 HOH HOH B . W 8 HOH 221 2221 2221 HOH HOH B . W 8 HOH 222 2222 2222 HOH HOH B . W 8 HOH 223 2223 2223 HOH HOH B . W 8 HOH 224 2224 2224 HOH HOH B . W 8 HOH 225 2225 2225 HOH HOH B . W 8 HOH 226 2226 2226 HOH HOH B . W 8 HOH 227 2227 2227 HOH HOH B . W 8 HOH 228 2228 2228 HOH HOH B . W 8 HOH 229 2229 2229 HOH HOH B . W 8 HOH 230 2230 2230 HOH HOH B . W 8 HOH 231 2231 2231 HOH HOH B . W 8 HOH 232 2232 2232 HOH HOH B . W 8 HOH 233 2233 2233 HOH HOH B . W 8 HOH 234 2234 2234 HOH HOH B . W 8 HOH 235 2235 2235 HOH HOH B . W 8 HOH 236 2236 2236 HOH HOH B . W 8 HOH 237 2237 2237 HOH HOH B . W 8 HOH 238 2238 2238 HOH HOH B . W 8 HOH 239 2239 2239 HOH HOH B . W 8 HOH 240 2240 2240 HOH HOH B . W 8 HOH 241 2241 2241 HOH HOH B . W 8 HOH 242 2242 2242 HOH HOH B . W 8 HOH 243 2243 2243 HOH HOH B . W 8 HOH 244 2244 2244 HOH HOH B . W 8 HOH 245 2245 2245 HOH HOH B . W 8 HOH 246 2246 2246 HOH HOH B . W 8 HOH 247 2247 2247 HOH HOH B . W 8 HOH 248 2248 2248 HOH HOH B . W 8 HOH 249 2249 2249 HOH HOH B . W 8 HOH 250 2250 2250 HOH HOH B . W 8 HOH 251 2251 2251 HOH HOH B . W 8 HOH 252 2252 2252 HOH HOH B . W 8 HOH 253 2253 2253 HOH HOH B . W 8 HOH 254 2254 2254 HOH HOH B . W 8 HOH 255 2255 2255 HOH HOH B . W 8 HOH 256 2256 2256 HOH HOH B . W 8 HOH 257 2257 2257 HOH HOH B . W 8 HOH 258 2258 2258 HOH HOH B . W 8 HOH 259 2259 2259 HOH HOH B . W 8 HOH 260 2260 2260 HOH HOH B . W 8 HOH 261 2261 2261 HOH HOH B . W 8 HOH 262 2262 2262 HOH HOH B . W 8 HOH 263 2263 2263 HOH HOH B . W 8 HOH 264 2264 2264 HOH HOH B . W 8 HOH 265 2265 2265 HOH HOH B . W 8 HOH 266 2266 2266 HOH HOH B . W 8 HOH 267 2267 2267 HOH HOH B . W 8 HOH 268 2268 2268 HOH HOH B . W 8 HOH 269 2269 2269 HOH HOH B . W 8 HOH 270 2270 2270 HOH HOH B . W 8 HOH 271 2271 2271 HOH HOH B . W 8 HOH 272 2272 2272 HOH HOH B . W 8 HOH 273 2273 2273 HOH HOH B . W 8 HOH 274 2274 2274 HOH HOH B . W 8 HOH 275 2275 2275 HOH HOH B . W 8 HOH 276 2276 2276 HOH HOH B . W 8 HOH 277 2277 2277 HOH HOH B . W 8 HOH 278 2278 2278 HOH HOH B . W 8 HOH 279 2279 2279 HOH HOH B . W 8 HOH 280 2280 2280 HOH HOH B . W 8 HOH 281 2281 2281 HOH HOH B . W 8 HOH 282 2282 2282 HOH HOH B . W 8 HOH 283 2283 2283 HOH HOH B . W 8 HOH 284 2284 2284 HOH HOH B . W 8 HOH 285 2285 2285 HOH HOH B . W 8 HOH 286 2286 2286 HOH HOH B . W 8 HOH 287 2287 2287 HOH HOH B . W 8 HOH 288 2288 2288 HOH HOH B . W 8 HOH 289 2289 2289 HOH HOH B . W 8 HOH 290 2290 2290 HOH HOH B . W 8 HOH 291 2291 2291 HOH HOH B . W 8 HOH 292 2292 2292 HOH HOH B . W 8 HOH 293 2293 2293 HOH HOH B . W 8 HOH 294 2294 2294 HOH HOH B . W 8 HOH 295 2295 2295 HOH HOH B . W 8 HOH 296 2296 2296 HOH HOH B . W 8 HOH 297 2297 2297 HOH HOH B . W 8 HOH 298 2298 2298 HOH HOH B . W 8 HOH 299 2299 2299 HOH HOH B . W 8 HOH 300 2300 2300 HOH HOH B . W 8 HOH 301 2301 2301 HOH HOH B . W 8 HOH 302 2302 2302 HOH HOH B . W 8 HOH 303 2303 2303 HOH HOH B . W 8 HOH 304 2304 2304 HOH HOH B . W 8 HOH 305 2305 2305 HOH HOH B . W 8 HOH 306 2306 2306 HOH HOH B . W 8 HOH 307 2307 2307 HOH HOH B . W 8 HOH 308 2308 2308 HOH HOH B . W 8 HOH 309 2309 2309 HOH HOH B . W 8 HOH 310 2310 2310 HOH HOH B . W 8 HOH 311 2311 2311 HOH HOH B . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 53 A ASN 141 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 53 B ASN 141 ? ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PQS monomeric 1 2 author_and_software_defined_assembly PQS monomeric 1 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,C,D,E,F,G,H,I,J,K,V 2 1 B,L,M,N,O,P,Q,R,S,T,U,W # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _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 2003-07-10 2 'Structure model' 1 1 2011-07-13 # _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 ? # 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' Advisory 2 2 'Structure model' 'Version format compliance' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.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[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined 1.1000 0.1990 3.0400 0.0155 0.0437 0.0229 -0.0066 -0.0174 -0.0004 0.5618 0.9599 1.0552 0.0595 0.0866 0.0830 0.0204 0.0248 -0.0568 -0.0616 0.0263 -0.0360 0.1350 0.0103 -0.0468 'X-RAY DIFFRACTION' 2 ? refined -33.3550 38.6180 -22.2750 0.0041 0.0518 0.0619 0.0052 0.0065 -0.0016 0.8781 1.4555 0.7922 -0.0815 -0.1881 -0.1061 -0.0046 -0.0365 0.1401 0.1491 0.0745 0.0529 -0.0562 -0.0165 -0.0699 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 A 90 ? ? A 450 ? ? ? ? 'X-RAY DIFFRACTION' 2 2 B 91 ? ? B 450 ? ? ? ? # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal REFMAC refinement 5.1.24 ? 1 DENZO 'data reduction' . ? 2 SCALEPACK 'data scaling' . ? 3 AMoRE phasing . ? 4 # _pdbx_database_remark.id 700 _pdbx_database_remark.text ; SHEET THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN ORDER TO REPRESENT THIS FEATURE IN THE SHEET RECORDS BELOW, TWO SHEETS ARE DEFINED. ; # _pdbx_entry_details.entry_id 1OCB _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ;THERE IS A PRO-SEQUENCE OF 23 AMINO-ACIDS WHICH ARE POST-TRANSLATIONALLY CLEAVED TO YIELD A MATURE PROTEIN OF 450 RESIDUES. THE NUMBERING OF THE PROTEIN STRUCTURE ASSUMES THAT RESIDUE 1 IS THE FIRST RESIDUE OF THE MATURE PROTEIN AND HENCE DOES NOT INCLUDE THE LEADER SEQUENCE IN THE NUMBERING.ALSO, THIS STRUCTURE IS OF THE CATALYTIC CORE DOMAIN ONLY, WHICH COMMENCES AT RESIDUE TYR 89. IN THE CHAIN A THE FIRST RESIDUE OF THE CORE IS DISORDERED AND NOT VISIBLE IN THE ELECTRON DENSITY,HENCE THIS ENTRY BEGINS AT HENCE THIS ENTRY BEGINS AT RESIDUE ASN 90. THIS PROTEIN IS CLOSELY RELATED TO AVICELASE 2 (SWISS-PROT ACCESSION ID:Q9C1S9) WITH WHICH IT HAS 96% SEQUENCE IDENTITY. ; # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 CB A ASP 145 ? ? CG A ASP 145 ? ? OD2 A ASP 145 ? ? 124.17 118.30 5.87 0.90 N 2 1 CB B ASP 268 ? ? CG B ASP 268 ? ? OD2 B ASP 268 ? ? 124.39 118.30 6.09 0.90 N 3 1 NE B ARG 382 ? ? CZ B ARG 382 ? ? NH1 B ARG 382 ? ? 123.41 120.30 3.11 0.50 N 4 1 NE B ARG 382 ? ? CZ B ARG 382 ? ? NH2 B ARG 382 ? ? 116.27 120.30 -4.03 0.50 N # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 THR A 146 ? ? -112.57 -79.28 2 1 TYR A 174 ? ? -151.97 69.16 3 1 ASP A 175 ? ? -151.79 34.88 4 1 GLU A 224 ? ? 47.64 73.41 5 1 ASP A 226 ? ? 83.03 -22.87 6 1 TRP A 274 ? ? -119.33 -74.40 7 1 ASN A 310 ? ? -123.68 -168.75 8 1 THR B 146 ? ? -112.85 -80.94 9 1 TYR B 174 ? ? -150.81 72.42 10 1 ASP B 175 ? ? -154.77 35.47 11 1 PHE B 214 ? ? -105.33 41.06 12 1 GLU B 224 ? ? 49.28 72.23 13 1 ASP B 226 ? ? 80.93 -19.58 14 1 TRP B 274 ? ? -114.28 -71.39 15 1 ASN B 310 ? ? -124.16 -166.02 # loop_ _pdbx_validate_chiral.id _pdbx_validate_chiral.PDB_model_num _pdbx_validate_chiral.auth_atom_id _pdbx_validate_chiral.label_alt_id _pdbx_validate_chiral.auth_asym_id _pdbx_validate_chiral.auth_comp_id _pdbx_validate_chiral.auth_seq_id _pdbx_validate_chiral.PDB_ins_code _pdbx_validate_chiral.details _pdbx_validate_chiral.omega 1 1 C1 ? A GDA 455 ? 'WRONG HAND' . 2 1 C1 ? B GDA 455 ? 'WRONG HAND' . # _pdbx_distant_solvent_atoms.id 1 _pdbx_distant_solvent_atoms.PDB_model_num 1 _pdbx_distant_solvent_atoms.auth_atom_id O _pdbx_distant_solvent_atoms.label_alt_id ? _pdbx_distant_solvent_atoms.auth_asym_id A _pdbx_distant_solvent_atoms.auth_comp_id HOH _pdbx_distant_solvent_atoms.auth_seq_id 2103 _pdbx_distant_solvent_atoms.PDB_ins_code ? _pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 6.16 _pdbx_distant_solvent_atoms.neighbor_ligand_distance . # 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 N 1 B FLG 460 ? N2 ? U FLG 1 N2 2 1 N 1 B FLG 460 ? C22 ? U FLG 1 C22 3 1 N 1 B FLG 460 ? C23 ? U FLG 1 C23 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A TYR 89 ? A TYR 1 2 1 Y 1 B TYR 89 ? B TYR 1 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 O1-METHYL-4-DEOXY-4-THIO-BETA-D-GLUCOSE GTM 4 BETA-D-GLUCOSE BGC 5 4-DEOXY-4-AMINO-BETA-D-GLUCOSE GDA 6 GLYCEROL GOL 7 FLUORESCEINYLTHIOUREIDO FLG 8 water HOH #