data_4X93 # _entry.id 4X93 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4X93 WWPDB D_1000205258 # loop_ _pdbx_database_related.db_name _pdbx_database_related.details _pdbx_database_related.db_id _pdbx_database_related.content_type PDB . 4X90 unspecified PDB . 4X91 unspecified PDB . 4X92 unspecified PDB . 4X94 unspecified PDB . 4X95 unspecified PDB . 4X96 unspecified PDB . 4X97 unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 4X93 _pdbx_database_status.recvd_initial_deposition_date 2014-12-11 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Glukhova, A.' 1 'Tesmer, J.J.G.' 2 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country UK _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev 'Nat Commun' _citation.journal_id_ASTM ? _citation.journal_id_CSD ? _citation.journal_id_ISSN 2041-1723 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 6 _citation.language ? _citation.page_first 6250 _citation.page_last 6250 _citation.title 'Structure and function of lysosomal phospholipase A2 and lecithin:cholesterol acyltransferase.' _citation.year 2015 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1038/ncomms7250 _citation.pdbx_database_id_PubMed 25727495 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Glukhova, A.' 1 primary 'Hinkovska-Galcheva, V.' 2 primary 'Kelly, R.' 3 primary 'Abe, A.' 4 primary 'Shayman, J.A.' 5 primary 'Tesmer, J.J.' 6 # _cell.length_a 86.820 _cell.length_b 86.820 _cell.length_c 365.848 _cell.angle_alpha 90.000 _cell.angle_beta 90.000 _cell.angle_gamma 90.000 _cell.entry_id 4X93 _cell.Z_PDB 16 _cell.pdbx_unique_axis ? # _symmetry.space_group_name_H-M 'P 43 21 2' _symmetry.entry_id 4X93 _symmetry.Int_Tables_number 96 _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? # 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 'Group XV phospholipase A2' 43121.027 2 2.3.1.- ? 'UNP residues 34-412' ? 2 non-polymer syn N-ACETYL-D-GLUCOSAMINE 221.208 8 ? ? ? ? 3 non-polymer syn '4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID' 238.305 2 ? ? ? ? 4 non-polymer syn 'DI(HYDROXYETHYL)ETHER' 106.120 1 ? ? ? ? 5 non-polymer syn 3,6,9,12,15,18,21-HEPTAOXATRICOSANE-1,23-DIOL 370.436 1 ? ? ? ? 6 water nat water 18.015 91 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name '1-O-acylceramide synthase,ACS,LCAT-like lysophospholipase,LLPL,Lysophospholipase 3,Lysosomal phospholipase A2,LPLA2' # _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 ;GAGRHPPVVLVPGDLGNQLEAKLDKPTVVHYLCSKKTESYFTIWLNLELLLPVIIDCWIDNIRLVYNKTSRATQFPDGVD VRVPGFGKTFSLEFLDPSKSSVGSYFHTMVESLVGWGYTRGEDVRGAPYDWRRAPNENGPYFLALREMIEEMYQLYGGPV VLVAHSMGNMYTLYFLQRQPQAWKDKYIRAFVSLGAPWGGVAKTLRVLASGDNNRIPVIGPLKIREQQRSAVSTSWLLPY NYTWSPEKVFVQTPTINYTLRDYRKFFQDIGFEDGWLMRQDTEGLVEATMPPGVQLHCLYGTGVPTPDSFYYESFPDRDP KICFGDGDGTVNLKSALQCQAWQSRQEHQVLLQELPGSEHIEMLANATTLAYLKRVLLGP ; _entity_poly.pdbx_seq_one_letter_code_can ;GAGRHPPVVLVPGDLGNQLEAKLDKPTVVHYLCSKKTESYFTIWLNLELLLPVIIDCWIDNIRLVYNKTSRATQFPDGVD VRVPGFGKTFSLEFLDPSKSSVGSYFHTMVESLVGWGYTRGEDVRGAPYDWRRAPNENGPYFLALREMIEEMYQLYGGPV VLVAHSMGNMYTLYFLQRQPQAWKDKYIRAFVSLGAPWGGVAKTLRVLASGDNNRIPVIGPLKIREQQRSAVSTSWLLPY NYTWSPEKVFVQTPTINYTLRDYRKFFQDIGFEDGWLMRQDTEGLVEATMPPGVQLHCLYGTGVPTPDSFYYESFPDRDP KICFGDGDGTVNLKSALQCQAWQSRQEHQVLLQELPGSEHIEMLANATTLAYLKRVLLGP ; _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 GLY n 1 2 ALA n 1 3 GLY n 1 4 ARG n 1 5 HIS n 1 6 PRO n 1 7 PRO n 1 8 VAL n 1 9 VAL n 1 10 LEU n 1 11 VAL n 1 12 PRO n 1 13 GLY n 1 14 ASP n 1 15 LEU n 1 16 GLY n 1 17 ASN n 1 18 GLN n 1 19 LEU n 1 20 GLU n 1 21 ALA n 1 22 LYS n 1 23 LEU n 1 24 ASP n 1 25 LYS n 1 26 PRO n 1 27 THR n 1 28 VAL n 1 29 VAL n 1 30 HIS n 1 31 TYR n 1 32 LEU n 1 33 CYS n 1 34 SER n 1 35 LYS n 1 36 LYS n 1 37 THR n 1 38 GLU n 1 39 SER n 1 40 TYR n 1 41 PHE n 1 42 THR n 1 43 ILE n 1 44 TRP n 1 45 LEU n 1 46 ASN n 1 47 LEU n 1 48 GLU n 1 49 LEU n 1 50 LEU n 1 51 LEU n 1 52 PRO n 1 53 VAL n 1 54 ILE n 1 55 ILE n 1 56 ASP n 1 57 CYS n 1 58 TRP n 1 59 ILE n 1 60 ASP n 1 61 ASN n 1 62 ILE n 1 63 ARG n 1 64 LEU n 1 65 VAL n 1 66 TYR n 1 67 ASN n 1 68 LYS n 1 69 THR n 1 70 SER n 1 71 ARG n 1 72 ALA n 1 73 THR n 1 74 GLN n 1 75 PHE n 1 76 PRO n 1 77 ASP n 1 78 GLY n 1 79 VAL n 1 80 ASP n 1 81 VAL n 1 82 ARG n 1 83 VAL n 1 84 PRO n 1 85 GLY n 1 86 PHE n 1 87 GLY n 1 88 LYS n 1 89 THR n 1 90 PHE n 1 91 SER n 1 92 LEU n 1 93 GLU n 1 94 PHE n 1 95 LEU n 1 96 ASP n 1 97 PRO n 1 98 SER n 1 99 LYS n 1 100 SER n 1 101 SER n 1 102 VAL n 1 103 GLY n 1 104 SER n 1 105 TYR n 1 106 PHE n 1 107 HIS n 1 108 THR n 1 109 MET n 1 110 VAL n 1 111 GLU n 1 112 SER n 1 113 LEU n 1 114 VAL n 1 115 GLY n 1 116 TRP n 1 117 GLY n 1 118 TYR n 1 119 THR n 1 120 ARG n 1 121 GLY n 1 122 GLU n 1 123 ASP n 1 124 VAL n 1 125 ARG n 1 126 GLY n 1 127 ALA n 1 128 PRO n 1 129 TYR n 1 130 ASP n 1 131 TRP n 1 132 ARG n 1 133 ARG n 1 134 ALA n 1 135 PRO n 1 136 ASN n 1 137 GLU n 1 138 ASN n 1 139 GLY n 1 140 PRO n 1 141 TYR n 1 142 PHE n 1 143 LEU n 1 144 ALA n 1 145 LEU n 1 146 ARG n 1 147 GLU n 1 148 MET n 1 149 ILE n 1 150 GLU n 1 151 GLU n 1 152 MET n 1 153 TYR n 1 154 GLN n 1 155 LEU n 1 156 TYR n 1 157 GLY n 1 158 GLY n 1 159 PRO n 1 160 VAL n 1 161 VAL n 1 162 LEU n 1 163 VAL n 1 164 ALA n 1 165 HIS n 1 166 SER n 1 167 MET n 1 168 GLY n 1 169 ASN n 1 170 MET n 1 171 TYR n 1 172 THR n 1 173 LEU n 1 174 TYR n 1 175 PHE n 1 176 LEU n 1 177 GLN n 1 178 ARG n 1 179 GLN n 1 180 PRO n 1 181 GLN n 1 182 ALA n 1 183 TRP n 1 184 LYS n 1 185 ASP n 1 186 LYS n 1 187 TYR n 1 188 ILE n 1 189 ARG n 1 190 ALA n 1 191 PHE n 1 192 VAL n 1 193 SER n 1 194 LEU n 1 195 GLY n 1 196 ALA n 1 197 PRO n 1 198 TRP n 1 199 GLY n 1 200 GLY n 1 201 VAL n 1 202 ALA n 1 203 LYS n 1 204 THR n 1 205 LEU n 1 206 ARG n 1 207 VAL n 1 208 LEU n 1 209 ALA n 1 210 SER n 1 211 GLY n 1 212 ASP n 1 213 ASN n 1 214 ASN n 1 215 ARG n 1 216 ILE n 1 217 PRO n 1 218 VAL n 1 219 ILE n 1 220 GLY n 1 221 PRO n 1 222 LEU n 1 223 LYS n 1 224 ILE n 1 225 ARG n 1 226 GLU n 1 227 GLN n 1 228 GLN n 1 229 ARG n 1 230 SER n 1 231 ALA n 1 232 VAL n 1 233 SER n 1 234 THR n 1 235 SER n 1 236 TRP n 1 237 LEU n 1 238 LEU n 1 239 PRO n 1 240 TYR n 1 241 ASN n 1 242 TYR n 1 243 THR n 1 244 TRP n 1 245 SER n 1 246 PRO n 1 247 GLU n 1 248 LYS n 1 249 VAL n 1 250 PHE n 1 251 VAL n 1 252 GLN n 1 253 THR n 1 254 PRO n 1 255 THR n 1 256 ILE n 1 257 ASN n 1 258 TYR n 1 259 THR n 1 260 LEU n 1 261 ARG n 1 262 ASP n 1 263 TYR n 1 264 ARG n 1 265 LYS n 1 266 PHE n 1 267 PHE n 1 268 GLN n 1 269 ASP n 1 270 ILE n 1 271 GLY n 1 272 PHE n 1 273 GLU n 1 274 ASP n 1 275 GLY n 1 276 TRP n 1 277 LEU n 1 278 MET n 1 279 ARG n 1 280 GLN n 1 281 ASP n 1 282 THR n 1 283 GLU n 1 284 GLY n 1 285 LEU n 1 286 VAL n 1 287 GLU n 1 288 ALA n 1 289 THR n 1 290 MET n 1 291 PRO n 1 292 PRO n 1 293 GLY n 1 294 VAL n 1 295 GLN n 1 296 LEU n 1 297 HIS n 1 298 CYS n 1 299 LEU n 1 300 TYR n 1 301 GLY n 1 302 THR n 1 303 GLY n 1 304 VAL n 1 305 PRO n 1 306 THR n 1 307 PRO n 1 308 ASP n 1 309 SER n 1 310 PHE n 1 311 TYR n 1 312 TYR n 1 313 GLU n 1 314 SER n 1 315 PHE n 1 316 PRO n 1 317 ASP n 1 318 ARG n 1 319 ASP n 1 320 PRO n 1 321 LYS n 1 322 ILE n 1 323 CYS n 1 324 PHE n 1 325 GLY n 1 326 ASP n 1 327 GLY n 1 328 ASP n 1 329 GLY n 1 330 THR n 1 331 VAL n 1 332 ASN n 1 333 LEU n 1 334 LYS n 1 335 SER n 1 336 ALA n 1 337 LEU n 1 338 GLN n 1 339 CYS n 1 340 GLN n 1 341 ALA n 1 342 TRP n 1 343 GLN n 1 344 SER n 1 345 ARG n 1 346 GLN n 1 347 GLU n 1 348 HIS n 1 349 GLN n 1 350 VAL n 1 351 LEU n 1 352 LEU n 1 353 GLN n 1 354 GLU n 1 355 LEU n 1 356 PRO n 1 357 GLY n 1 358 SER n 1 359 GLU n 1 360 HIS n 1 361 ILE n 1 362 GLU n 1 363 MET n 1 364 LEU n 1 365 ALA n 1 366 ASN n 1 367 ALA n 1 368 THR n 1 369 THR n 1 370 LEU n 1 371 ALA n 1 372 TYR n 1 373 LEU n 1 374 LYS n 1 375 ARG n 1 376 VAL n 1 377 LEU n 1 378 LEU n 1 379 GLY n 1 380 PRO n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type 'Biological sequence' _entity_src_gen.pdbx_beg_seq_num 1 _entity_src_gen.pdbx_end_seq_num 380 _entity_src_gen.gene_src_common_name Human _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene 'PLA2G15, LYPLA3, UNQ341/PRO540' _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _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 'HEK293S GnTI-' _entity_src_gen.pdbx_host_org_atcc CRL-3022 _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.db_code PAG15_HUMAN _struct_ref.db_name UNP _struct_ref.details ? _struct_ref.entity_id 1 _struct_ref.id 1 _struct_ref.seq_align ? _struct_ref.seq_dif ? _struct_ref.pdbx_db_accession Q8NCC3 _struct_ref.pdbx_db_isoform ? _struct_ref.pdbx_seq_one_letter_code ;AGRHPPVVLVPGDLGNQLEAKLDKPTVVHYLCSKKTESYFTIWLNLELLLPVIIDCWIDNIRLVYNKTSRATQFPDGVDV RVPGFGKTFSLEFLDPSKSSVGSYFHTMVESLVGWGYTRGEDVRGAPYDWRRAPNENGPYFLALREMIEEMYQLYGGPVV LVAHSMGNMYTLYFLQRQPQAWKDKYIRAFVSLGAPWGGVAKTLRVLASGDNNRIPVIGPLKIREQQRSAVSTSWLLPYN YTWSPEKVFVQTPTINYTLRDYRKFFQDIGFEDGWLMRQDTEGLVEATMPPGVQLHCLYGTGVPTPDSFYYESFPDRDPK ICFGDGDGTVNLKSALQCQAWQSRQEHQVLLQELPGSEHIEMLANATTLAYLKRVLLGP ; _struct_ref.pdbx_align_begin 34 _struct_ref.pdbx_align_end ? # 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 4X93 A 2 ? 380 ? Q8NCC3 34 ? 412 ? 1 379 2 1 4X93 B 2 ? 380 ? Q8NCC3 34 ? 412 ? 1 379 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 4X93 GLY A 1 ? UNP Q8NCC3 ? ? 'cloning artifact' 0 1 2 4X93 GLY B 1 ? UNP Q8NCC3 ? ? 'cloning artifact' 0 2 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 EPE non-polymer . '4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID' HEPES 'C8 H18 N2 O4 S' 238.305 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PE8 non-polymer . 3,6,9,12,15,18,21-HEPTAOXATRICOSANE-1,23-DIOL ? 'C16 H34 O9' 370.436 PEG non-polymer . 'DI(HYDROXYETHYL)ETHER' ? 'C4 H10 O3' 106.120 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.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 4X93 _exptl.crystals_number 1 _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 4.01 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 69.36 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? # _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 277 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details '100 mM HEPES pH 7.5, 30% PEG MME 550, 50 mM MgCl2' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? # _diffrn_detector.details ? _diffrn_detector.detector CCD _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'MARMOSAIC 300 mm CCD' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2013-06-14 # _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.97933 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.current ? _diffrn_source.details ? _diffrn_source.diffrn_id 1 _diffrn_source.power ? _diffrn_source.size ? _diffrn_source.source SYNCHROTRON _diffrn_source.target ? _diffrn_source.type 'APS BEAMLINE 23-ID-D' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 0.97933 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline 23-ID-D _diffrn_source.pdbx_synchrotron_site APS # _reflns.d_resolution_high 2.600 _reflns.d_resolution_low 30.000 _reflns.pdbx_number_measured_all 654390 _reflns.number_obs 44707 _reflns.pdbx_Rmerge_I_obs 0.159 _reflns.pdbx_netI_over_av_sigmaI 23.545 _reflns.pdbx_netI_over_sigmaI 4.400 _reflns.pdbx_chi_squared 1.508 _reflns.pdbx_redundancy 14.600 _reflns.percent_possible_obs 100.000 _reflns.pdbx_Rrim_I_all 0.165 _reflns.pdbx_Rpim_I_all 0.049 _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 4X93 _reflns.observed_criterion_sigma_I ? _reflns.observed_criterion_sigma_F ? _reflns.number_all ? _reflns.pdbx_Rsym_value ? _reflns.B_iso_Wilson_estimate ? # loop_ _reflns_shell.pdbx_diffrn_id _reflns_shell.pdbx_ordinal _reflns_shell.d_res_high _reflns_shell.d_res_low _reflns_shell.number_measured_obs _reflns_shell.number_measured_all _reflns_shell.number_unique_obs _reflns_shell.pdbx_rejects _reflns_shell.Rmerge_I_obs _reflns_shell.meanI_over_sigI_obs _reflns_shell.pdbx_Rsym_value _reflns_shell.pdbx_chi_squared _reflns_shell.pdbx_redundancy _reflns_shell.percent_possible_obs _reflns_shell.pdbx_netI_over_sigmaI_obs _reflns_shell.number_possible _reflns_shell.number_unique_all _reflns_shell.Rmerge_F_all _reflns_shell.Rmerge_F_obs _reflns_shell.Rmerge_I_all _reflns_shell.meanI_over_sigI_all _reflns_shell.percent_possible_all _reflns_shell.pdbx_Rrim_I_all _reflns_shell.pdbx_Rpim_I_all _reflns_shell.pdbx_CC_half 1 1 2.600 2.640 ? ? ? 0 ? ? ? 0.886 14.700 ? ? ? 2205 ? ? ? ? 100.000 ? 0.428 0.761 1 2 2.640 2.690 ? ? ? 0 ? ? ? 0.914 14.600 ? ? ? 2159 ? ? ? ? 100.000 ? 0.380 0.815 1 3 2.690 2.740 ? ? ? 0 ? ? ? 0.907 14.700 ? ? ? 2200 ? ? ? ? 100.000 ? 0.302 0.859 1 4 2.740 2.800 ? ? ? 0 ? ? ? 0.936 14.800 ? ? ? 2190 ? ? ? ? 100.000 ? 0.272 0.880 1 5 2.800 2.860 ? ? ? 0 0.855 ? ? 0.977 14.900 ? ? ? 2176 ? ? ? ? 100.000 0.885 0.227 0.910 1 6 2.860 2.930 ? ? ? 0 0.719 ? ? 0.988 14.800 ? ? ? 2183 ? ? ? ? 100.000 0.744 0.191 0.933 1 7 2.930 3.000 ? ? ? 0 0.603 ? ? 1.063 14.900 ? ? ? 2233 ? ? ? ? 100.000 0.624 0.160 0.958 1 8 3.000 3.080 ? ? ? 0 0.522 ? ? 1.136 15.000 ? ? ? 2175 ? ? ? ? 100.000 0.540 0.139 0.972 1 9 3.080 3.170 ? ? ? 0 0.402 ? ? 1.267 14.900 ? ? ? 2191 ? ? ? ? 100.000 0.416 0.107 0.975 1 10 3.170 3.280 ? ? ? 0 0.337 ? ? 1.398 14.900 ? ? ? 2195 ? ? ? ? 100.000 0.349 0.090 0.981 1 11 3.280 3.390 ? ? ? 0 0.274 ? ? 1.519 14.900 ? ? ? 2216 ? ? ? ? 100.000 0.284 0.073 0.982 1 12 3.390 3.530 ? ? ? 0 0.239 ? ? 1.646 14.600 ? ? ? 2231 ? ? ? ? 100.000 0.248 0.065 0.987 1 13 3.530 3.690 ? ? ? 0 0.195 ? ? 1.719 14.500 ? ? ? 2216 ? ? ? ? 100.000 0.202 0.053 0.989 1 14 3.690 3.880 ? ? ? 0 0.168 ? ? 1.804 14.400 ? ? ? 2231 ? ? ? ? 100.000 0.175 0.046 0.993 1 15 3.880 4.120 ? ? ? 0 0.154 ? ? 2.016 13.900 ? ? ? 2252 ? ? ? ? 100.000 0.160 0.043 0.991 1 16 4.120 4.440 ? ? ? 0 0.147 ? ? 2.550 13.800 ? ? ? 2238 ? ? ? ? 100.000 0.153 0.041 0.993 1 17 4.440 4.890 ? ? ? 0 0.124 ? ? 2.610 13.900 ? ? ? 2279 ? ? ? ? 99.900 0.129 0.035 0.994 1 18 4.890 5.590 ? ? ? 0 0.110 ? ? 2.114 14.800 ? ? ? 2289 ? ? ? ? 100.000 0.114 0.030 0.996 1 19 5.590 7.030 ? ? ? 0 0.096 ? ? 1.734 15.400 ? ? ? 2334 ? ? ? ? 100.000 0.100 0.025 0.997 1 20 7.030 30.000 ? ? ? 0 0.073 ? ? 1.981 14.400 ? ? ? 2514 ? ? ? ? 99.600 0.076 0.020 0.997 # _refine.entry_id 4X93 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_d_res_high 2.6000 _refine.ls_d_res_low 30.0000 _refine.pdbx_ls_sigma_F 0.000 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_percent_reflns_obs 99.7900 _refine.ls_number_reflns_obs 42161 _refine.ls_number_reflns_all ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.ls_matrix_type ? _refine.pdbx_R_Free_selection_details RANDOM _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS U VALUES : WITH TLS ADDED' _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1995 _refine.ls_R_factor_R_work 0.1986 _refine.ls_wR_factor_R_work ? _refine.ls_R_factor_R_free 0.2182 _refine.ls_wR_factor_R_free ? _refine.ls_percent_reflns_R_free 4.9000 _refine.ls_number_reflns_R_free 2158 _refine.ls_number_reflns_R_work ? _refine.ls_R_factor_R_free_error ? _refine.B_iso_mean 62.7070 _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.pdbx_isotropic_thermal_model ? _refine.aniso_B[1][1] 0.6700 _refine.aniso_B[2][2] 0.6700 _refine.aniso_B[3][3] -1.3400 _refine.aniso_B[1][2] 0.0000 _refine.aniso_B[1][3] 0.0000 _refine.aniso_B[2][3] 0.0000 _refine.correlation_coeff_Fo_to_Fc 0.9520 _refine.correlation_coeff_Fo_to_Fc_free 0.9450 _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.overall_SU_R_free ? _refine.pdbx_overall_ESU_R 0.3260 _refine.pdbx_overall_ESU_R_Free 0.2250 _refine.overall_SU_ML 0.1750 _refine.overall_SU_B 17.5170 _refine.solvent_model_details MASK _refine.pdbx_solvent_vdw_probe_radii 1.2000 _refine.pdbx_solvent_ion_probe_radii 0.8000 _refine.pdbx_solvent_shrinkage_radii 0.8000 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.pdbx_starting_model 4X90 _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.overall_FOM_work_R_set ? _refine.B_iso_max 152.930 _refine.B_iso_min 32.140 _refine.pdbx_overall_phase_error ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_R_factor_R_free_error_details ? # _refine_hist.cycle_id final _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.d_res_high 2.6000 _refine_hist.d_res_low 30.0000 _refine_hist.pdbx_number_atoms_ligand 174 _refine_hist.number_atoms_solvent 91 _refine_hist.number_atoms_total 6314 _refine_hist.pdbx_number_residues_total 753 _refine_hist.pdbx_B_iso_mean_ligand 87.44 _refine_hist.pdbx_B_iso_mean_solvent 47.33 _refine_hist.pdbx_number_atoms_protein 6049 _refine_hist.pdbx_number_atoms_nucleic_acid 0 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.type _refine_ls_restr.number _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' r_bond_refined_d 6488 0.008 0.019 ? ? 'X-RAY DIFFRACTION' r_bond_other_d 6054 0.003 0.020 ? ? 'X-RAY DIFFRACTION' r_angle_refined_deg 8822 1.240 1.985 ? ? 'X-RAY DIFFRACTION' r_angle_other_deg 13916 0.869 3.000 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_1_deg 765 5.914 5.000 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_2_deg 292 35.107 23.493 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_3_deg 1011 12.608 15.000 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_4_deg 42 11.200 15.000 ? ? 'X-RAY DIFFRACTION' r_chiral_restr 966 0.086 0.200 ? ? 'X-RAY DIFFRACTION' r_gen_planes_refined 7179 0.005 0.021 ? ? 'X-RAY DIFFRACTION' r_gen_planes_other 1507 0.003 0.020 ? ? 'X-RAY DIFFRACTION' r_mcbond_it 3051 1.484 3.877 ? ? 'X-RAY DIFFRACTION' r_mcbond_other 3050 1.484 3.875 ? ? 'X-RAY DIFFRACTION' r_mcangle_it 3813 2.542 5.812 ? ? # loop_ _refine_ls_restr_ncs.pdbx_ordinal _refine_ls_restr_ncs.pdbx_refine_id _refine_ls_restr_ncs.pdbx_ens_id _refine_ls_restr_ncs.dom_id _refine_ls_restr_ncs.pdbx_type _refine_ls_restr_ncs.pdbx_auth_asym_id _refine_ls_restr_ncs.pdbx_number _refine_ls_restr_ncs.rms_dev_position _refine_ls_restr_ncs.weight_position _refine_ls_restr_ncs.ncs_model_details _refine_ls_restr_ncs.rms_dev_B_iso _refine_ls_restr_ncs.weight_B_iso 1 'X-RAY DIFFRACTION' 1 1 'interatomic distance' A 23361 0.070 0.050 ? ? ? 2 'X-RAY DIFFRACTION' 1 2 'interatomic distance' B 23361 0.070 0.050 ? ? ? # _refine_ls_shell.d_res_high 2.6000 _refine_ls_shell.d_res_low 2.6670 _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.percent_reflns_obs 99.8400 _refine_ls_shell.number_reflns_R_work 3054 _refine_ls_shell.R_factor_all ? _refine_ls_shell.R_factor_R_work 0.3030 _refine_ls_shell.R_factor_R_free 0.3350 _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 160 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.number_reflns_all 3214 _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.R_factor_obs ? # loop_ _struct_ncs_dom.pdbx_ens_id _struct_ncs_dom.id _struct_ncs_dom.details 1 1 A 1 2 B # loop_ _struct_ncs_dom_lim.pdbx_ens_id _struct_ncs_dom_lim.dom_id _struct_ncs_dom_lim.pdbx_component_id _struct_ncs_dom_lim.pdbx_refine_code _struct_ncs_dom_lim.beg_auth_asym_id _struct_ncs_dom_lim.beg_auth_seq_id _struct_ncs_dom_lim.end_auth_asym_id _struct_ncs_dom_lim.end_auth_seq_id _struct_ncs_dom_lim.selection_details _struct_ncs_dom_lim.beg_label_asym_id _struct_ncs_dom_lim.beg_label_comp_id _struct_ncs_dom_lim.beg_label_seq_id _struct_ncs_dom_lim.beg_label_alt_id _struct_ncs_dom_lim.end_label_asym_id _struct_ncs_dom_lim.end_label_comp_id _struct_ncs_dom_lim.end_label_seq_id _struct_ncs_dom_lim.end_label_alt_id 1 1 0 0 A 4 A 378 ? ? ? ? ? ? ? ? ? 1 2 0 0 B 4 B 378 ? ? ? ? ? ? ? ? ? # _struct_ncs_ens.id 1 _struct_ncs_ens.details ? # _struct.entry_id 4X93 _struct.title ;Crystal structure of Lysosomal Phospholipase A2 crystallized in the presence of methyl arachidonyl fluorophosphonate (tetragonal form) ; _struct.pdbx_descriptor 'Group XV phospholipase A2 (E.C.2.3.1.-)' _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag ? # _struct_keywords.entry_id 4X93 _struct_keywords.text 'hydrolase, phospholipase, esterase, acyltransferase, TRANSFERASE' _struct_keywords.pdbx_keywords TRANSFERASE # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 2 ? D N N 2 ? E N N 2 ? F N N 2 ? G N N 3 ? H N N 2 ? I N N 2 ? J N N 2 ? K N N 2 ? L N N 3 ? M N N 4 ? N N N 5 ? O N N 6 ? P N N 6 ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 AA1 ASN A 46 ? LEU A 50 ? ASN A 45 LEU A 49 5 ? 5 HELX_P HELX_P2 AA2 LEU A 51 ? ARG A 63 ? LEU A 50 ARG A 62 1 ? 13 HELX_P HELX_P3 AA3 THR A 89 ? PHE A 94 ? THR A 88 PHE A 93 1 ? 6 HELX_P HELX_P4 AA4 SER A 100 ? SER A 104 ? SER A 99 SER A 103 5 ? 5 HELX_P HELX_P5 AA5 PHE A 106 ? TRP A 116 ? PHE A 105 TRP A 115 1 ? 11 HELX_P HELX_P6 AA6 ALA A 134 ? GLU A 137 ? ALA A 133 GLU A 136 5 ? 4 HELX_P HELX_P7 AA7 ASN A 138 ? GLY A 157 ? ASN A 137 GLY A 156 1 ? 20 HELX_P HELX_P8 AA8 MET A 167 ? ARG A 178 ? MET A 166 ARG A 177 1 ? 12 HELX_P HELX_P9 AA9 PRO A 180 ? TYR A 187 ? PRO A 179 TYR A 186 1 ? 8 HELX_P HELX_P10 AB1 LYS A 203 ? GLY A 211 ? LYS A 202 GLY A 210 1 ? 9 HELX_P HELX_P11 AB2 GLY A 220 ? ALA A 231 ? GLY A 219 ALA A 230 1 ? 12 HELX_P HELX_P12 AB3 ALA A 231 ? LEU A 237 ? ALA A 230 LEU A 236 1 ? 7 HELX_P HELX_P13 AB4 ASP A 262 ? ILE A 270 ? ASP A 261 ILE A 269 1 ? 9 HELX_P HELX_P14 AB5 GLU A 273 ? GLU A 283 ? GLU A 272 GLU A 282 1 ? 11 HELX_P HELX_P15 AB6 ASN A 332 ? SER A 335 ? ASN A 331 SER A 334 5 ? 4 HELX_P HELX_P16 AB7 ALA A 336 ? GLN A 343 ? ALA A 335 GLN A 342 1 ? 8 HELX_P HELX_P17 AB8 ILE A 361 ? ALA A 365 ? ILE A 360 ALA A 364 5 ? 5 HELX_P HELX_P18 AB9 ASN A 366 ? GLY A 379 ? ASN A 365 GLY A 378 1 ? 14 HELX_P HELX_P19 AC1 ASN B 46 ? LEU B 51 ? ASN B 45 LEU B 50 5 ? 6 HELX_P HELX_P20 AC2 VAL B 53 ? ARG B 63 ? VAL B 52 ARG B 62 1 ? 11 HELX_P HELX_P21 AC3 THR B 89 ? PHE B 94 ? THR B 88 PHE B 93 1 ? 6 HELX_P HELX_P22 AC4 SER B 100 ? SER B 104 ? SER B 99 SER B 103 5 ? 5 HELX_P HELX_P23 AC5 PHE B 106 ? TRP B 116 ? PHE B 105 TRP B 115 1 ? 11 HELX_P HELX_P24 AC6 ALA B 134 ? GLU B 137 ? ALA B 133 GLU B 136 5 ? 4 HELX_P HELX_P25 AC7 ASN B 138 ? GLY B 157 ? ASN B 137 GLY B 156 1 ? 20 HELX_P HELX_P26 AC8 MET B 167 ? ARG B 178 ? MET B 166 ARG B 177 1 ? 12 HELX_P HELX_P27 AC9 PRO B 180 ? TYR B 187 ? PRO B 179 TYR B 186 1 ? 8 HELX_P HELX_P28 AD1 ALA B 202 ? GLY B 211 ? ALA B 201 GLY B 210 1 ? 10 HELX_P HELX_P29 AD2 GLY B 220 ? ALA B 231 ? GLY B 219 ALA B 230 1 ? 12 HELX_P HELX_P30 AD3 ALA B 231 ? LEU B 237 ? ALA B 230 LEU B 236 1 ? 7 HELX_P HELX_P31 AD4 ASP B 262 ? ILE B 270 ? ASP B 261 ILE B 269 1 ? 9 HELX_P HELX_P32 AD5 GLU B 273 ? GLU B 283 ? GLU B 272 GLU B 282 1 ? 11 HELX_P HELX_P33 AD6 ASN B 332 ? SER B 335 ? ASN B 331 SER B 334 5 ? 4 HELX_P HELX_P34 AD7 ALA B 336 ? GLN B 343 ? ALA B 335 GLN B 342 1 ? 8 HELX_P HELX_P35 AD8 ILE B 361 ? ALA B 365 ? ILE B 360 ALA B 364 5 ? 5 HELX_P HELX_P36 AD9 ASN B 366 ? GLY B 379 ? ASN B 365 GLY B 378 1 ? 14 # _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 33 SG ? ? ? 1_555 A CYS 57 SG ? ? A CYS 32 A CYS 56 1_555 ? ? ? ? ? ? ? 2.045 ? disulf2 disulf ? ? B CYS 33 SG ? ? ? 1_555 B CYS 57 SG ? ? B CYS 32 B CYS 56 1_555 ? ? ? ? ? ? ? 2.074 ? covale1 covale one ? A ASN 67 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 66 A NAG 401 1_555 ? ? ? ? ? ? ? 1.434 ? covale2 covale one ? A ASN 241 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 240 A NAG 402 1_555 ? ? ? ? ? ? ? 1.433 ? covale3 covale one ? A ASN 257 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 256 A NAG 403 1_555 ? ? ? ? ? ? ? 1.435 ? covale4 covale one ? A ASN 366 ND2 ? ? ? 1_555 F NAG . C1 ? ? A ASN 365 A NAG 404 1_555 ? ? ? ? ? ? ? 1.433 ? covale5 covale one ? B ASN 67 ND2 ? ? ? 1_555 H NAG . C1 ? ? B ASN 66 B NAG 401 1_555 ? ? ? ? ? ? ? 1.433 ? covale6 covale one ? B ASN 241 ND2 ? ? ? 1_555 I NAG . C1 ? ? B ASN 240 B NAG 402 1_555 ? ? ? ? ? ? ? 1.430 ? covale7 covale one ? B ASN 257 ND2 ? ? ? 1_555 J NAG . C1 ? ? B ASN 256 B NAG 403 1_555 ? ? ? ? ? ? ? 1.438 ? covale8 covale one ? B ASN 366 ND2 ? ? ? 1_555 K NAG . C1 ? ? B ASN 365 B NAG 404 1_555 ? ? ? ? ? ? ? 1.435 ? # 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 TRP 44 A . ? TRP 43 A LEU 45 A ? LEU 44 A 1 -1.74 2 PHE 315 A . ? PHE 314 A PRO 316 A ? PRO 315 A 1 5.94 3 TRP 44 B . ? TRP 43 B LEU 45 B ? LEU 44 B 1 -2.07 4 PHE 315 B . ? PHE 314 B PRO 316 B ? PRO 315 B 1 2.00 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 6 ? AA2 ? 3 ? AA3 ? 2 ? AA4 ? 4 ? AA5 ? 6 ? AA6 ? 3 ? AA7 ? 2 ? AA8 ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense AA1 1 2 ? parallel AA1 2 3 ? parallel AA1 3 4 ? parallel AA1 4 5 ? parallel AA1 5 6 ? parallel AA2 1 2 ? anti-parallel AA2 2 3 ? anti-parallel AA3 1 2 ? anti-parallel AA4 1 2 ? anti-parallel AA4 2 3 ? parallel AA4 3 4 ? anti-parallel AA5 1 2 ? parallel AA5 2 3 ? parallel AA5 3 4 ? parallel AA5 4 5 ? parallel AA5 5 6 ? parallel AA6 1 2 ? anti-parallel AA6 2 3 ? anti-parallel AA7 1 2 ? anti-parallel AA8 1 2 ? anti-parallel AA8 2 3 ? parallel AA8 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id AA1 1 VAL A 124 ? GLY A 126 ? VAL A 123 GLY A 125 AA1 2 VAL A 8 ? VAL A 11 ? VAL A 7 VAL A 10 AA1 3 VAL A 160 ? HIS A 165 ? VAL A 159 HIS A 164 AA1 4 ILE A 188 ? LEU A 194 ? ILE A 187 LEU A 193 AA1 5 LEU A 296 ? THR A 302 ? LEU A 295 THR A 301 AA1 6 VAL A 350 ? PRO A 356 ? VAL A 349 PRO A 355 AA2 1 PHE A 41 ? TRP A 44 ? PHE A 40 TRP A 43 AA2 2 LEU A 19 ? LEU A 23 ? LEU A 18 LEU A 22 AA2 3 VAL A 79 ? ARG A 82 ? VAL A 78 ARG A 81 AA3 1 VAL A 65 ? ASN A 67 ? VAL A 64 ASN A 66 AA3 2 ALA A 72 ? GLN A 74 ? ALA A 71 GLN A 73 AA4 1 ASN A 257 ? TYR A 258 ? ASN A 256 TYR A 257 AA4 2 VAL A 251 ? GLN A 252 ? VAL A 250 GLN A 251 AA4 3 THR A 306 ? TYR A 311 ? THR A 305 TYR A 310 AA4 4 LYS A 321 ? GLY A 325 ? LYS A 320 GLY A 324 AA5 1 VAL B 124 ? GLY B 126 ? VAL B 123 GLY B 125 AA5 2 VAL B 8 ? VAL B 11 ? VAL B 7 VAL B 10 AA5 3 VAL B 160 ? HIS B 165 ? VAL B 159 HIS B 164 AA5 4 ILE B 188 ? LEU B 194 ? ILE B 187 LEU B 193 AA5 5 LEU B 296 ? THR B 302 ? LEU B 295 THR B 301 AA5 6 VAL B 350 ? PRO B 356 ? VAL B 349 PRO B 355 AA6 1 PHE B 41 ? TRP B 44 ? PHE B 40 TRP B 43 AA6 2 LEU B 19 ? LEU B 23 ? LEU B 18 LEU B 22 AA6 3 VAL B 79 ? ARG B 82 ? VAL B 78 ARG B 81 AA7 1 VAL B 65 ? ASN B 67 ? VAL B 64 ASN B 66 AA7 2 ALA B 72 ? GLN B 74 ? ALA B 71 GLN B 73 AA8 1 ASN B 257 ? TYR B 258 ? ASN B 256 TYR B 257 AA8 2 VAL B 251 ? GLN B 252 ? VAL B 250 GLN B 251 AA8 3 THR B 306 ? TYR B 311 ? THR B 305 TYR B 310 AA8 4 LYS B 321 ? GLY B 325 ? LYS B 320 GLY B 324 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id AA1 1 2 O ARG A 125 ? O ARG A 124 N LEU A 10 ? N LEU A 9 AA1 2 3 N VAL A 9 ? N VAL A 8 O VAL A 163 ? O VAL A 162 AA1 3 4 N LEU A 162 ? N LEU A 161 O VAL A 192 ? O VAL A 191 AA1 4 5 N SER A 193 ? N SER A 192 O HIS A 297 ? O HIS A 296 AA1 5 6 N LEU A 296 ? N LEU A 295 O LEU A 351 ? O LEU A 350 AA2 1 2 O PHE A 41 ? O PHE A 40 N ALA A 21 ? N ALA A 20 AA2 2 3 N GLU A 20 ? N GLU A 19 O ARG A 82 ? O ARG A 81 AA3 1 2 N VAL A 65 ? N VAL A 64 O GLN A 74 ? O GLN A 73 AA4 1 2 O TYR A 258 ? O TYR A 257 N VAL A 251 ? N VAL A 250 AA4 2 3 N GLN A 252 ? N GLN A 251 O PHE A 310 ? O PHE A 309 AA4 3 4 N ASP A 308 ? N ASP A 307 O CYS A 323 ? O CYS A 322 AA5 1 2 O ARG B 125 ? O ARG B 124 N LEU B 10 ? N LEU B 9 AA5 2 3 N VAL B 9 ? N VAL B 8 O VAL B 163 ? O VAL B 162 AA5 3 4 N LEU B 162 ? N LEU B 161 O VAL B 192 ? O VAL B 191 AA5 4 5 N SER B 193 ? N SER B 192 O HIS B 297 ? O HIS B 296 AA5 5 6 N LEU B 296 ? N LEU B 295 O LEU B 351 ? O LEU B 350 AA6 1 2 O PHE B 41 ? O PHE B 40 N ALA B 21 ? N ALA B 20 AA6 2 3 N GLU B 20 ? N GLU B 19 O ARG B 82 ? O ARG B 81 AA7 1 2 N VAL B 65 ? N VAL B 64 O GLN B 74 ? O GLN B 73 AA8 1 2 O TYR B 258 ? O TYR B 257 N VAL B 251 ? N VAL B 250 AA8 2 3 N GLN B 252 ? N GLN B 251 O PHE B 310 ? O PHE B 309 AA8 3 4 N ASP B 308 ? N ASP B 307 O CYS B 323 ? O CYS B 322 # 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 A EPE 405 ? 9 'binding site for residue EPE A 405' AC2 Software B EPE 405 ? 6 'binding site for residue EPE B 405' AC3 Software B PEG 406 ? 3 'binding site for residue PEG B 406' AC4 Software B PE8 407 ? 3 'binding site for residue PE8 B 407' AC5 Software A NAG 401 ? 3 'binding site for Mono-Saccharide NAG A 401 bound to ASN A 66' AC6 Software A NAG 402 ? 2 'binding site for Mono-Saccharide NAG A 402 bound to ASN A 240' AC7 Software A NAG 403 ? 4 'binding site for Mono-Saccharide NAG A 403 bound to ASN A 256' AC8 Software A NAG 404 ? 4 'binding site for Mono-Saccharide NAG A 404 bound to ASN A 365' AC9 Software B NAG 401 ? 2 'binding site for Mono-Saccharide NAG B 401 bound to ASN B 66' AD1 Software B NAG 402 ? 2 'binding site for Mono-Saccharide NAG B 402 bound to ASN B 240' AD2 Software B NAG 403 ? 5 'binding site for Mono-Saccharide NAG B 403 bound to ASN B 256' AD3 Software B NAG 404 ? 4 'binding site for Mono-Saccharide NAG B 404 bound to ASN B 365' # 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 9 CYS A 33 ? CYS A 32 . ? 1_555 ? 2 AC1 9 SER A 34 ? SER A 33 . ? 1_555 ? 3 AC1 9 PHE A 41 ? PHE A 40 . ? 1_555 ? 4 AC1 9 ASN A 61 ? ASN A 60 . ? 1_555 ? 5 AC1 9 HOH O . ? HOH A 527 . ? 1_555 ? 6 AC1 9 HOH O . ? HOH A 537 . ? 1_555 ? 7 AC1 9 HOH O . ? HOH A 538 . ? 1_555 ? 8 AC1 9 TYR B 31 ? TYR B 30 . ? 6_475 ? 9 AC1 9 HOH P . ? HOH B 502 . ? 6_475 ? 10 AC2 6 SER B 34 ? SER B 33 . ? 1_555 ? 11 AC2 6 LEU B 49 ? LEU B 48 . ? 1_555 ? 12 AC2 6 CYS B 57 ? CYS B 56 . ? 1_555 ? 13 AC2 6 ASN B 61 ? ASN B 60 . ? 1_555 ? 14 AC2 6 HOH P . ? HOH B 541 . ? 1_555 ? 15 AC2 6 HOH P . ? HOH B 546 . ? 1_555 ? 16 AC3 3 SER B 166 ? SER B 165 . ? 1_555 ? 17 AC3 3 VAL B 201 ? VAL B 200 . ? 1_555 ? 18 AC3 3 HOH P . ? HOH B 538 . ? 1_555 ? 19 AC4 3 GLY B 303 ? GLY B 302 . ? 1_555 ? 20 AC4 3 PRO B 305 ? PRO B 304 . ? 1_555 ? 21 AC4 3 GLY B 325 ? GLY B 324 . ? 1_555 ? 22 AC5 3 ASN A 67 ? ASN A 66 . ? 1_555 ? 23 AC5 3 SER A 70 ? SER A 69 . ? 1_555 ? 24 AC5 3 GLN A 74 ? GLN A 73 . ? 1_555 ? 25 AC6 2 ASN A 241 ? ASN A 240 . ? 1_555 ? 26 AC6 2 GLU A 283 ? GLU A 282 . ? 1_555 ? 27 AC7 4 VAL A 249 ? VAL A 248 . ? 1_555 ? 28 AC7 4 GLN A 252 ? GLN A 251 . ? 1_555 ? 29 AC7 4 ASN A 257 ? ASN A 256 . ? 1_555 ? 30 AC7 4 GLN B 252 ? GLN B 251 . ? 4_465 ? 31 AC8 4 PRO A 356 ? PRO A 355 . ? 1_555 ? 32 AC8 4 GLU A 362 ? GLU A 361 . ? 1_555 ? 33 AC8 4 ASN A 366 ? ASN A 365 . ? 1_555 ? 34 AC8 4 THR A 368 ? THR A 367 . ? 1_555 ? 35 AC9 2 ASN B 67 ? ASN B 66 . ? 1_555 ? 36 AC9 2 GLN B 74 ? GLN B 73 . ? 1_555 ? 37 AD1 2 ASN B 241 ? ASN B 240 . ? 1_555 ? 38 AD1 2 GLU B 283 ? GLU B 282 . ? 1_555 ? 39 AD2 5 THR A 255 ? THR A 254 . ? 6_565 ? 40 AD2 5 ILE A 256 ? ILE A 255 . ? 6_565 ? 41 AD2 5 ASN A 257 ? ASN A 256 . ? 6_565 ? 42 AD2 5 GLN B 252 ? GLN B 251 . ? 1_555 ? 43 AD2 5 ASN B 257 ? ASN B 256 . ? 1_555 ? 44 AD3 4 PRO B 356 ? PRO B 355 . ? 1_555 ? 45 AD3 4 GLU B 362 ? GLU B 361 . ? 1_555 ? 46 AD3 4 ASN B 366 ? ASN B 365 . ? 1_555 ? 47 AD3 4 THR B 368 ? THR B 367 . ? 1_555 ? # _atom_sites.entry_id 4X93 _atom_sites.fract_transf_matrix[1][1] 0.011518 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.011518 _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] 0.002733 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # 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 . HIS A 1 5 ? 60.814 88.570 52.726 1.00 78.61 ? 4 HIS A N 1 ATOM 2 C CA . HIS A 1 5 ? 59.749 88.192 53.692 1.00 75.76 ? 4 HIS A CA 1 ATOM 3 C C . HIS A 1 5 ? 58.416 87.923 52.986 1.00 70.05 ? 4 HIS A C 1 ATOM 4 O O . HIS A 1 5 ? 58.086 88.567 51.999 1.00 66.61 ? 4 HIS A O 1 ATOM 5 C CB . HIS A 1 5 ? 59.596 89.256 54.796 1.00 78.88 ? 4 HIS A CB 1 ATOM 6 C CG . HIS A 1 5 ? 59.613 90.672 54.299 1.00 81.18 ? 4 HIS A CG 1 ATOM 7 N ND1 . HIS A 1 5 ? 58.623 91.205 53.498 1.00 81.30 ? 4 HIS A ND1 1 ATOM 8 C CD2 . HIS A 1 5 ? 60.506 91.670 54.505 1.00 83.08 ? 4 HIS A CD2 1 ATOM 9 C CE1 . HIS A 1 5 ? 58.909 92.467 53.226 1.00 81.70 ? 4 HIS A CE1 1 ATOM 10 N NE2 . HIS A 1 5 ? 60.045 92.774 53.828 1.00 84.47 ? 4 HIS A NE2 1 ATOM 11 N N . PRO A 1 6 ? 57.670 86.939 53.481 1.00 66.53 ? 5 PRO A N 1 ATOM 12 C CA . PRO A 1 6 ? 56.494 86.548 52.738 1.00 64.21 ? 5 PRO A CA 1 ATOM 13 C C . PRO A 1 6 ? 55.322 87.493 52.973 1.00 62.08 ? 5 PRO A C 1 ATOM 14 O O . PRO A 1 6 ? 55.248 88.120 54.020 1.00 61.70 ? 5 PRO A O 1 ATOM 15 C CB . PRO A 1 6 ? 56.178 85.161 53.305 1.00 64.80 ? 5 PRO A CB 1 ATOM 16 C CG . PRO A 1 6 ? 56.685 85.198 54.704 1.00 65.38 ? 5 PRO A CG 1 ATOM 17 C CD . PRO A 1 6 ? 57.826 86.176 54.734 1.00 66.34 ? 5 PRO A CD 1 ATOM 18 N N . PRO A 1 7 ? 54.412 87.599 52.000 1.00 59.71 ? 6 PRO A N 1 ATOM 19 C CA . PRO A 1 7 ? 53.218 88.417 52.213 1.00 57.07 ? 6 PRO A CA 1 ATOM 20 C C . PRO A 1 7 ? 52.336 87.910 53.354 1.00 54.65 ? 6 PRO A C 1 ATOM 21 O O . PRO A 1 7 ? 52.282 86.701 53.628 1.00 52.02 ? 6 PRO A O 1 ATOM 22 C CB . PRO A 1 7 ? 52.479 88.327 50.874 1.00 57.44 ? 6 PRO A CB 1 ATOM 23 C CG . PRO A 1 7 ? 53.015 87.107 50.212 1.00 58.85 ? 6 PRO A CG 1 ATOM 24 C CD . PRO A 1 7 ? 54.422 86.952 50.682 1.00 59.99 ? 6 PRO A CD 1 ATOM 25 N N . VAL A 1 8 ? 51.635 88.851 53.985 1.00 53.70 ? 7 VAL A N 1 ATOM 26 C CA . VAL A 1 8 ? 50.875 88.573 55.180 1.00 51.64 ? 7 VAL A CA 1 ATOM 27 C C . VAL A 1 8 ? 49.449 89.057 55.030 1.00 50.29 ? 7 VAL A C 1 ATOM 28 O O . VAL A 1 8 ? 49.220 90.184 54.592 1.00 51.60 ? 7 VAL A O 1 ATOM 29 C CB . VAL A 1 8 ? 51.524 89.253 56.394 1.00 52.25 ? 7 VAL A CB 1 ATOM 30 C CG1 . VAL A 1 8 ? 50.611 89.190 57.615 1.00 51.42 ? 7 VAL A CG1 1 ATOM 31 C CG2 . VAL A 1 8 ? 52.867 88.604 56.691 1.00 53.76 ? 7 VAL A CG2 1 ATOM 32 N N . VAL A 1 9 ? 48.503 88.199 55.410 1.00 49.25 ? 8 VAL A N 1 ATOM 33 C CA . VAL A 1 9 ? 47.084 88.550 55.469 1.00 48.05 ? 8 VAL A CA 1 ATOM 34 C C . VAL A 1 9 ? 46.601 88.439 56.913 1.00 46.62 ? 8 VAL A C 1 ATOM 35 O O . VAL A 1 9 ? 46.833 87.431 57.568 1.00 46.89 ? 8 VAL A O 1 ATOM 36 C CB . VAL A 1 9 ? 46.247 87.635 54.560 1.00 48.29 ? 8 VAL A CB 1 ATOM 37 C CG1 . VAL A 1 9 ? 44.758 87.872 54.763 1.00 48.30 ? 8 VAL A CG1 1 ATOM 38 C CG2 . VAL A 1 9 ? 46.623 87.864 53.105 1.00 49.37 ? 8 VAL A CG2 1 ATOM 39 N N . LEU A 1 10 ? 45.941 89.495 57.381 1.00 45.89 ? 9 LEU A N 1 ATOM 40 C CA . LEU A 1 10 ? 45.447 89.594 58.741 1.00 45.73 ? 9 LEU A CA 1 ATOM 41 C C . LEU A 1 10 ? 43.934 89.359 58.770 1.00 45.49 ? 9 LEU A C 1 ATOM 42 O O . LEU A 1 10 ? 43.179 89.994 58.015 1.00 44.08 ? 9 LEU A O 1 ATOM 43 C CB . LEU A 1 10 ? 45.760 90.979 59.309 1.00 46.22 ? 9 LEU A CB 1 ATOM 44 C CG . LEU A 1 10 ? 47.225 91.416 59.233 1.00 47.06 ? 9 LEU A CG 1 ATOM 45 C CD1 . LEU A 1 10 ? 47.399 92.851 59.690 1.00 47.84 ? 9 LEU A CD1 1 ATOM 46 C CD2 . LEU A 1 10 ? 48.092 90.488 60.060 1.00 48.30 ? 9 LEU A CD2 1 ATOM 47 N N . VAL A 1 11 ? 43.499 88.448 59.648 1.00 45.26 ? 10 VAL A N 1 ATOM 48 C CA . VAL A 1 11 ? 42.091 88.091 59.782 1.00 45.62 ? 10 VAL A CA 1 ATOM 49 C C . VAL A 1 11 ? 41.646 88.400 61.206 1.00 45.87 ? 10 VAL A C 1 ATOM 50 O O . VAL A 1 11 ? 42.156 87.803 62.154 1.00 46.60 ? 10 VAL A O 1 ATOM 51 C CB . VAL A 1 11 ? 41.846 86.597 59.488 1.00 47.21 ? 10 VAL A CB 1 ATOM 52 C CG1 . VAL A 1 11 ? 40.351 86.300 59.490 1.00 46.81 ? 10 VAL A CG1 1 ATOM 53 C CG2 . VAL A 1 11 ? 42.469 86.195 58.152 1.00 48.61 ? 10 VAL A CG2 1 ATOM 54 N N . PRO A 1 12 ? 40.706 89.341 61.359 1.00 45.32 ? 11 PRO A N 1 ATOM 55 C CA . PRO A 1 12 ? 40.309 89.772 62.684 1.00 45.03 ? 11 PRO A CA 1 ATOM 56 C C . PRO A 1 12 ? 39.249 88.891 63.326 1.00 43.35 ? 11 PRO A C 1 ATOM 57 O O . PRO A 1 12 ? 38.682 88.017 62.689 1.00 43.16 ? 11 PRO A O 1 ATOM 58 C CB . PRO A 1 12 ? 39.742 91.171 62.420 1.00 45.43 ? 11 PRO A CB 1 ATOM 59 C CG . PRO A 1 12 ? 39.109 91.047 61.080 1.00 45.78 ? 11 PRO A CG 1 ATOM 60 C CD . PRO A 1 12 ? 39.962 90.066 60.311 1.00 46.13 ? 11 PRO A CD 1 ATOM 61 N N . GLY A 1 13 ? 38.982 89.147 64.598 1.00 42.93 ? 12 GLY A N 1 ATOM 62 C CA . GLY A 1 13 ? 37.930 88.449 65.315 1.00 43.34 ? 12 GLY A CA 1 ATOM 63 C C . GLY A 1 13 ? 36.644 89.247 65.371 1.00 43.52 ? 12 GLY A C 1 ATOM 64 O O . GLY A 1 13 ? 36.454 90.226 64.637 1.00 44.79 ? 12 GLY A O 1 ATOM 65 N N . ASP A 1 14 ? 35.762 88.817 66.265 1.00 45.67 ? 13 ASP A N 1 ATOM 66 C CA . ASP A 1 14 ? 34.490 89.484 66.515 1.00 47.77 ? 13 ASP A CA 1 ATOM 67 C C . ASP A 1 14 ? 34.719 90.924 66.974 1.00 46.80 ? 13 ASP A C 1 ATOM 68 O O . ASP A 1 14 ? 35.623 91.203 67.748 1.00 44.25 ? 13 ASP A O 1 ATOM 69 C CB . ASP A 1 14 ? 33.700 88.730 67.582 1.00 51.57 ? 13 ASP A CB 1 ATOM 70 C CG . ASP A 1 14 ? 32.215 89.083 67.579 1.00 57.55 ? 13 ASP A CG 1 ATOM 71 O OD1 . ASP A 1 14 ? 31.766 89.899 66.732 1.00 61.80 ? 13 ASP A OD1 1 ATOM 72 O OD2 . ASP A 1 14 ? 31.488 88.497 68.414 1.00 61.22 ? 13 ASP A OD2 1 ATOM 73 N N . LEU A 1 15 ? 33.906 91.837 66.458 1.00 46.53 ? 14 LEU A N 1 ATOM 74 C CA . LEU A 1 15 ? 34.082 93.283 66.675 1.00 47.18 ? 14 LEU A CA 1 ATOM 75 C C . LEU A 1 15 ? 35.370 93.849 66.099 1.00 45.99 ? 14 LEU A C 1 ATOM 76 O O . LEU A 1 15 ? 35.707 94.995 66.382 1.00 44.85 ? 14 LEU A O 1 ATOM 77 C CB . LEU A 1 15 ? 34.009 93.654 68.167 1.00 48.12 ? 14 LEU A CB 1 ATOM 78 C CG . LEU A 1 15 ? 32.835 93.116 68.990 1.00 48.70 ? 14 LEU A CG 1 ATOM 79 C CD1 . LEU A 1 15 ? 32.957 93.640 70.411 1.00 50.11 ? 14 LEU A CD1 1 ATOM 80 C CD2 . LEU A 1 15 ? 31.495 93.505 68.382 1.00 48.37 ? 14 LEU A CD2 1 ATOM 81 N N . GLY A 1 16 ? 36.050 93.067 65.260 1.00 45.39 ? 15 GLY A N 1 ATOM 82 C CA . GLY A 1 16 ? 37.443 93.325 64.924 1.00 44.11 ? 15 GLY A CA 1 ATOM 83 C C . GLY A 1 16 ? 37.715 94.133 63.684 1.00 43.71 ? 15 GLY A C 1 ATOM 84 O O . GLY A 1 16 ? 38.862 94.258 63.284 1.00 44.01 ? 15 GLY A O 1 ATOM 85 N N . ASN A 1 17 ? 36.676 94.692 63.077 1.00 42.10 ? 16 ASN A N 1 ATOM 86 C CA . ASN A 1 17 ? 36.867 95.635 61.990 1.00 42.54 ? 16 ASN A CA 1 ATOM 87 C C . ASN A 1 17 ? 35.708 96.594 61.885 1.00 43.45 ? 16 ASN A C 1 ATOM 88 O O . ASN A 1 17 ? 34.609 96.326 62.371 1.00 42.19 ? 16 ASN A O 1 ATOM 89 C CB . ASN A 1 17 ? 37.196 94.934 60.646 1.00 41.85 ? 16 ASN A CB 1 ATOM 90 C CG . ASN A 1 17 ? 36.163 93.891 60.226 1.00 41.30 ? 16 ASN A CG 1 ATOM 91 O OD1 . ASN A 1 17 ? 36.455 92.698 60.210 1.00 40.44 ? 16 ASN A OD1 1 ATOM 92 N ND2 . ASN A 1 17 ? 34.965 94.337 59.866 1.00 41.07 ? 16 ASN A ND2 1 ATOM 93 N N . GLN A 1 18 ? 35.975 97.726 61.253 1.00 45.06 ? 17 GLN A N 1 ATOM 94 C CA . GLN A 1 18 ? 34.946 98.724 61.063 1.00 46.46 ? 17 GLN A CA 1 ATOM 95 C C . GLN A 1 18 ? 33.783 98.169 60.237 1.00 46.67 ? 17 GLN A C 1 ATOM 96 O O . GLN A 1 18 ? 33.959 97.265 59.409 1.00 46.38 ? 17 GLN A O 1 ATOM 97 C CB . GLN A 1 18 ? 35.513 99.951 60.369 1.00 47.62 ? 17 GLN A CB 1 ATOM 98 C CG . GLN A 1 18 ? 36.500 100.707 61.226 1.00 48.44 ? 17 GLN A CG 1 ATOM 99 C CD . GLN A 1 18 ? 37.060 101.924 60.535 1.00 50.80 ? 17 GLN A CD 1 ATOM 100 O OE1 . GLN A 1 18 ? 36.472 102.460 59.580 1.00 51.84 ? 17 GLN A OE1 1 ATOM 101 N NE2 . GLN A 1 18 ? 38.198 102.391 61.031 1.00 52.24 ? 17 GLN A NE2 1 ATOM 102 N N . LEU A 1 19 ? 32.597 98.715 60.490 1.00 46.95 ? 18 LEU A N 1 ATOM 103 C CA . LEU A 1 19 ? 31.414 98.507 59.667 1.00 46.85 ? 18 LEU A CA 1 ATOM 104 C C . LEU A 1 19 ? 30.791 99.861 59.360 1.00 48.48 ? 18 LEU A C 1 ATOM 105 O O . LEU A 1 19 ? 30.824 100.768 60.200 1.00 48.20 ? 18 LEU A O 1 ATOM 106 C CB . LEU A 1 19 ? 30.386 97.648 60.397 1.00 45.91 ? 18 LEU A CB 1 ATOM 107 C CG . LEU A 1 19 ? 30.759 96.190 60.635 1.00 46.00 ? 18 LEU A CG 1 ATOM 108 C CD1 . LEU A 1 19 ? 29.672 95.521 61.456 1.00 46.37 ? 18 LEU A CD1 1 ATOM 109 C CD2 . LEU A 1 19 ? 30.967 95.449 59.320 1.00 45.93 ? 18 LEU A CD2 1 ATOM 110 N N . GLU A 1 20 ? 30.209 99.981 58.167 1.00 49.85 ? 19 GLU A N 1 ATOM 111 C CA . GLU A 1 20 ? 29.540 101.203 57.734 1.00 52.06 ? 19 GLU A CA 1 ATOM 112 C C . GLU A 1 20 ? 28.091 100.915 57.372 1.00 51.35 ? 19 GLU A C 1 ATOM 113 O O . GLU A 1 20 ? 27.767 99.816 56.924 1.00 52.15 ? 19 GLU A O 1 ATOM 114 C CB . GLU A 1 20 ? 30.272 101.812 56.535 1.00 54.43 ? 19 GLU A CB 1 ATOM 115 C CG . GLU A 1 20 ? 31.680 102.296 56.866 1.00 56.44 ? 19 GLU A CG 1 ATOM 116 C CD . GLU A 1 20 ? 32.429 102.862 55.668 1.00 59.22 ? 19 GLU A CD 1 ATOM 117 O OE1 . GLU A 1 20 ? 31.969 102.675 54.513 1.00 62.18 ? 19 GLU A OE1 1 ATOM 118 O OE2 . GLU A 1 20 ? 33.490 103.496 55.886 1.00 58.87 ? 19 GLU A OE2 1 ATOM 119 N N . ALA A 1 21 ? 27.222 101.894 57.566 1.00 51.72 ? 20 ALA A N 1 ATOM 120 C CA . ALA A 1 21 ? 25.809 101.715 57.252 1.00 52.52 ? 20 ALA A CA 1 ATOM 121 C C . ALA A 1 21 ? 25.227 102.907 56.523 1.00 54.61 ? 20 ALA A C 1 ATOM 122 O O . ALA A 1 21 ? 25.714 104.025 56.650 1.00 53.85 ? 20 ALA A O 1 ATOM 123 C CB . ALA A 1 21 ? 25.009 101.419 58.511 1.00 52.40 ? 20 ALA A CB 1 ATOM 124 N N . LYS A 1 22 ? 24.167 102.645 55.768 1.00 57.11 ? 21 LYS A N 1 ATOM 125 C CA . LYS A 1 22 ? 23.380 103.689 55.107 1.00 60.51 ? 21 LYS A CA 1 ATOM 126 C C . LYS A 1 22 ? 21.914 103.398 55.355 1.00 61.17 ? 21 LYS A C 1 ATOM 127 O O . LYS A 1 22 ? 21.500 102.241 55.321 1.00 61.02 ? 21 LYS A O 1 ATOM 128 C CB . LYS A 1 22 ? 23.660 103.690 53.616 1.00 63.39 ? 21 LYS A CB 1 ATOM 129 C CG . LYS A 1 22 ? 22.889 104.756 52.858 1.00 68.03 ? 21 LYS A CG 1 ATOM 130 C CD . LYS A 1 22 ? 23.506 105.014 51.502 1.00 70.92 ? 21 LYS A CD 1 ATOM 131 C CE . LYS A 1 22 ? 22.723 106.048 50.718 1.00 74.93 ? 21 LYS A CE 1 ATOM 132 N NZ . LYS A 1 22 ? 23.297 106.171 49.350 1.00 76.82 ? 21 LYS A NZ 1 ATOM 133 N N . LEU A 1 23 ? 21.124 104.442 55.580 1.00 63.23 ? 22 LEU A N 1 ATOM 134 C CA . LEU A 1 23 ? 19.751 104.270 56.045 1.00 64.97 ? 22 LEU A CA 1 ATOM 135 C C . LEU A 1 23 ? 18.724 104.896 55.105 1.00 67.58 ? 22 LEU A C 1 ATOM 136 O O . LEU A 1 23 ? 18.944 105.999 54.597 1.00 68.31 ? 22 LEU A O 1 ATOM 137 C CB . LEU A 1 23 ? 19.570 104.920 57.421 1.00 65.21 ? 22 LEU A CB 1 ATOM 138 C CG . LEU A 1 23 ? 20.594 104.639 58.519 1.00 64.13 ? 22 LEU A CG 1 ATOM 139 C CD1 . LEU A 1 23 ? 20.240 105.427 59.775 1.00 64.51 ? 22 LEU A CD1 1 ATOM 140 C CD2 . LEU A 1 23 ? 20.690 103.150 58.824 1.00 62.67 ? 22 LEU A CD2 1 ATOM 141 N N . ASP A 1 24 ? 17.610 104.185 54.912 1.00 68.67 ? 23 ASP A N 1 ATOM 142 C CA . ASP A 1 24 ? 16.385 104.744 54.329 1.00 72.98 ? 23 ASP A CA 1 ATOM 143 C C . ASP A 1 24 ? 15.201 103.944 54.900 1.00 72.77 ? 23 ASP A C 1 ATOM 144 O O . ASP A 1 24 ? 14.570 103.149 54.205 1.00 72.37 ? 23 ASP A O 1 ATOM 145 C CB . ASP A 1 24 ? 16.431 104.671 52.796 1.00 75.39 ? 23 ASP A CB 1 ATOM 146 C CG . ASP A 1 24 ? 15.360 105.535 52.130 1.00 79.33 ? 23 ASP A CG 1 ATOM 147 O OD1 . ASP A 1 24 ? 14.437 106.025 52.821 1.00 80.49 ? 23 ASP A OD1 1 ATOM 148 O OD2 . ASP A 1 24 ? 15.446 105.735 50.901 1.00 83.24 ? 23 ASP A OD2 1 ATOM 149 N N . LYS A 1 25 ? 14.934 104.149 56.186 1.00 72.24 ? 24 LYS A N 1 ATOM 150 C CA . LYS A 1 25 ? 14.033 103.293 56.946 1.00 72.64 ? 24 LYS A CA 1 ATOM 151 C C . LYS A 1 25 ? 12.597 103.802 56.824 1.00 75.48 ? 24 LYS A C 1 ATOM 152 O O . LYS A 1 25 ? 12.372 105.008 56.827 1.00 77.07 ? 24 LYS A O 1 ATOM 153 C CB . LYS A 1 25 ? 14.447 103.297 58.425 1.00 70.65 ? 24 LYS A CB 1 ATOM 154 C CG . LYS A 1 25 ? 15.852 102.763 58.683 1.00 68.28 ? 24 LYS A CG 1 ATOM 155 C CD . LYS A 1 25 ? 16.446 103.255 59.999 1.00 67.90 ? 24 LYS A CD 1 ATOM 156 C CE . LYS A 1 25 ? 15.796 102.622 61.222 1.00 67.09 ? 24 LYS A CE 1 ATOM 157 N NZ . LYS A 1 25 ? 16.272 101.240 61.484 1.00 64.62 ? 24 LYS A NZ 1 ATOM 158 N N . PRO A 1 26 ? 11.615 102.891 56.736 1.00 76.54 ? 25 PRO A N 1 ATOM 159 C CA . PRO A 1 26 ? 10.220 103.345 56.755 1.00 78.51 ? 25 PRO A CA 1 ATOM 160 C C . PRO A 1 26 ? 9.775 103.870 58.127 1.00 77.84 ? 25 PRO A C 1 ATOM 161 O O . PRO A 1 26 ? 8.964 104.801 58.200 1.00 78.96 ? 25 PRO A O 1 ATOM 162 C CB . PRO A 1 26 ? 9.435 102.084 56.381 1.00 79.13 ? 25 PRO A CB 1 ATOM 163 C CG . PRO A 1 26 ? 10.310 100.949 56.797 1.00 76.78 ? 25 PRO A CG 1 ATOM 164 C CD . PRO A 1 26 ? 11.723 101.426 56.618 1.00 75.45 ? 25 PRO A CD 1 ATOM 165 N N . THR A 1 27 ? 10.293 103.275 59.199 1.00 74.82 ? 26 THR A N 1 ATOM 166 C CA . THR A 1 27 ? 9.934 103.666 60.561 1.00 74.27 ? 26 THR A CA 1 ATOM 167 C C . THR A 1 27 ? 11.145 103.560 61.486 1.00 72.89 ? 26 THR A C 1 ATOM 168 O O . THR A 1 27 ? 12.133 102.884 61.176 1.00 70.10 ? 26 THR A O 1 ATOM 169 C CB . THR A 1 27 ? 8.811 102.777 61.143 1.00 73.82 ? 26 THR A CB 1 ATOM 170 O OG1 . THR A 1 27 ? 9.261 101.418 61.230 1.00 70.35 ? 26 THR A OG1 1 ATOM 171 C CG2 . THR A 1 27 ? 7.546 102.850 60.285 1.00 76.49 ? 26 THR A CG2 1 ATOM 172 N N . VAL A 1 28 ? 11.049 104.226 62.634 1.00 72.28 ? 27 VAL A N 1 ATOM 173 C CA . VAL A 1 28 ? 12.095 104.178 63.649 1.00 68.87 ? 27 VAL A CA 1 ATOM 174 C C . VAL A 1 28 ? 11.499 103.858 65.016 1.00 67.79 ? 27 VAL A C 1 ATOM 175 O O . VAL A 1 28 ? 10.307 104.041 65.237 1.00 68.95 ? 27 VAL A O 1 ATOM 176 C CB . VAL A 1 28 ? 12.875 105.508 63.748 1.00 69.37 ? 27 VAL A CB 1 ATOM 177 C CG1 . VAL A 1 28 ? 13.904 105.608 62.631 1.00 68.81 ? 27 VAL A CG1 1 ATOM 178 C CG2 . VAL A 1 28 ? 11.931 106.705 63.740 1.00 71.30 ? 27 VAL A CG2 1 ATOM 179 N N . VAL A 1 29 ? 12.344 103.391 65.929 1.00 64.84 ? 28 VAL A N 1 ATOM 180 C CA . VAL A 1 29 ? 11.891 103.018 67.269 1.00 64.47 ? 28 VAL A CA 1 ATOM 181 C C . VAL A 1 29 ? 11.676 104.210 68.221 1.00 66.64 ? 28 VAL A C 1 ATOM 182 O O . VAL A 1 29 ? 10.883 104.074 69.159 1.00 67.59 ? 28 VAL A O 1 ATOM 183 C CB . VAL A 1 29 ? 12.831 101.995 67.943 1.00 61.29 ? 28 VAL A CB 1 ATOM 184 C CG1 . VAL A 1 29 ? 12.953 100.740 67.087 1.00 60.31 ? 28 VAL A CG1 1 ATOM 185 C CG2 . VAL A 1 29 ? 14.195 102.602 68.237 1.00 59.86 ? 28 VAL A CG2 1 ATOM 186 N N . HIS A 1 30 ? 12.374 105.321 68.008 1.00 67.12 ? 29 HIS A N 1 ATOM 187 C CA . HIS A 1 30 ? 12.010 106.575 68.686 1.00 69.64 ? 29 HIS A CA 1 ATOM 188 C C . HIS A 1 30 ? 12.410 107.751 67.861 1.00 70.34 ? 29 HIS A C 1 ATOM 189 O O . HIS A 1 30 ? 13.126 107.646 66.855 1.00 71.46 ? 29 HIS A O 1 ATOM 190 C CB . HIS A 1 30 ? 12.383 106.613 70.202 1.00 70.48 ? 29 HIS A CB 1 ATOM 191 C CG . HIS A 1 30 ? 13.845 106.610 70.509 1.00 70.35 ? 29 HIS A CG 1 ATOM 192 N ND1 . HIS A 1 30 ? 14.599 107.761 70.555 1.00 71.83 ? 29 HIS A ND1 1 ATOM 193 C CD2 . HIS A 1 30 ? 14.671 105.605 70.890 1.00 69.61 ? 29 HIS A CD2 1 ATOM 194 C CE1 . HIS A 1 30 ? 15.841 107.457 70.891 1.00 70.77 ? 29 HIS A CE1 1 ATOM 195 N NE2 . HIS A 1 30 ? 15.910 106.156 71.105 1.00 68.82 ? 29 HIS A NE2 1 ATOM 196 N N . TYR A 1 31 ? 11.843 108.891 68.214 1.00 71.49 ? 30 TYR A N 1 ATOM 197 C CA . TYR A 1 31 ? 11.980 110.096 67.385 1.00 73.28 ? 30 TYR A CA 1 ATOM 198 C C . TYR A 1 31 ? 13.398 110.579 67.188 1.00 73.08 ? 30 TYR A C 1 ATOM 199 O O . TYR A 1 31 ? 13.676 111.247 66.222 1.00 75.85 ? 30 TYR A O 1 ATOM 200 C CB . TYR A 1 31 ? 11.095 111.218 67.918 1.00 75.43 ? 30 TYR A CB 1 ATOM 201 C CG . TYR A 1 31 ? 11.581 111.888 69.186 1.00 76.08 ? 30 TYR A CG 1 ATOM 202 C CD1 . TYR A 1 31 ? 11.424 111.292 70.435 1.00 75.49 ? 30 TYR A CD1 1 ATOM 203 C CD2 . TYR A 1 31 ? 12.171 113.141 69.135 1.00 78.09 ? 30 TYR A CD2 1 ATOM 204 C CE1 . TYR A 1 31 ? 11.859 111.923 71.592 1.00 75.37 ? 30 TYR A CE1 1 ATOM 205 C CE2 . TYR A 1 31 ? 12.607 113.778 70.282 1.00 78.24 ? 30 TYR A CE2 1 ATOM 206 C CZ . TYR A 1 31 ? 12.454 113.165 71.508 1.00 76.84 ? 30 TYR A CZ 1 ATOM 207 O OH . TYR A 1 31 ? 12.882 113.801 72.652 1.00 76.99 ? 30 TYR A OH 1 ATOM 208 N N . LEU A 1 32 ? 14.267 110.308 68.152 1.00 71.09 ? 31 LEU A N 1 ATOM 209 C CA . LEU A 1 32 ? 15.660 110.747 68.025 1.00 69.73 ? 31 LEU A CA 1 ATOM 210 C C . LEU A 1 32 ? 16.471 109.874 67.063 1.00 66.76 ? 31 LEU A C 1 ATOM 211 O O . LEU A 1 32 ? 17.611 110.192 66.787 1.00 65.49 ? 31 LEU A O 1 ATOM 212 C CB . LEU A 1 32 ? 16.365 110.784 69.385 1.00 69.63 ? 31 LEU A CB 1 ATOM 213 C CG . LEU A 1 32 ? 15.845 111.805 70.403 1.00 72.68 ? 31 LEU A CG 1 ATOM 214 C CD1 . LEU A 1 32 ? 16.451 111.536 71.775 1.00 71.89 ? 31 LEU A CD1 1 ATOM 215 C CD2 . LEU A 1 32 ? 16.130 113.232 69.954 1.00 74.79 ? 31 LEU A CD2 1 ATOM 216 N N . CYS A 1 33 ? 15.867 108.806 66.540 1.00 65.99 ? 32 CYS A N 1 ATOM 217 C CA . CYS A 1 33 ? 16.560 107.957 65.549 1.00 64.94 ? 32 CYS A CA 1 ATOM 218 C C . CYS A 1 33 ? 16.437 108.550 64.152 1.00 67.22 ? 32 CYS A C 1 ATOM 219 O O . CYS A 1 33 ? 15.358 108.936 63.740 1.00 68.76 ? 32 CYS A O 1 ATOM 220 C CB . CYS A 1 33 ? 15.982 106.552 65.533 1.00 64.29 ? 32 CYS A CB 1 ATOM 221 S SG . CYS A 1 33 ? 16.076 105.672 67.114 1.00 65.33 ? 32 CYS A SG 1 ATOM 222 N N . SER A 1 34 ? 17.545 108.627 63.423 1.00 67.58 ? 33 SER A N 1 ATOM 223 C CA . SER A 1 34 ? 17.523 109.052 62.026 1.00 69.29 ? 33 SER A CA 1 ATOM 224 C C . SER A 1 34 ? 16.845 108.012 61.136 1.00 70.06 ? 33 SER A C 1 ATOM 225 O O . SER A 1 34 ? 17.137 106.822 61.230 1.00 67.98 ? 33 SER A O 1 ATOM 226 C CB . SER A 1 34 ? 18.952 109.278 61.569 1.00 68.12 ? 33 SER A CB 1 ATOM 227 O OG . SER A 1 34 ? 18.990 109.767 60.257 1.00 71.13 ? 33 SER A OG 1 ATOM 228 N N . LYS A 1 35 ? 15.963 108.471 60.251 1.00 76.17 ? 34 LYS A N 1 ATOM 229 C CA . LYS A 1 35 ? 15.310 107.597 59.253 1.00 78.58 ? 34 LYS A CA 1 ATOM 230 C C . LYS A 1 35 ? 16.174 107.403 58.013 1.00 78.22 ? 34 LYS A C 1 ATOM 231 O O . LYS A 1 35 ? 16.166 106.323 57.406 1.00 78.33 ? 34 LYS A O 1 ATOM 232 C CB . LYS A 1 35 ? 13.954 108.163 58.837 1.00 82.96 ? 34 LYS A CB 1 ATOM 233 C CG . LYS A 1 35 ? 13.056 108.490 60.015 1.00 86.83 ? 34 LYS A CG 1 ATOM 234 C CD . LYS A 1 35 ? 11.648 108.852 59.577 1.00 91.91 ? 34 LYS A CD 1 ATOM 235 C CE . LYS A 1 35 ? 10.889 107.630 59.085 1.00 93.25 ? 34 LYS A CE 1 ATOM 236 N NZ . LYS A 1 35 ? 9.419 107.840 59.206 1.00 96.50 ? 34 LYS A NZ 1 ATOM 237 N N . LYS A 1 36 ? 16.923 108.435 57.640 1.00 79.67 ? 35 LYS A N 1 ATOM 238 C CA . LYS A 1 36 ? 17.590 108.443 56.365 1.00 81.00 ? 35 LYS A CA 1 ATOM 239 C C . LYS A 1 36 ? 18.936 109.118 56.449 1.00 78.90 ? 35 LYS A C 1 ATOM 240 O O . LYS A 1 36 ? 19.085 110.109 57.139 1.00 78.87 ? 35 LYS A O 1 ATOM 241 C CB . LYS A 1 36 ? 16.713 109.156 55.339 1.00 86.55 ? 35 LYS A CB 1 ATOM 242 C CG . LYS A 1 36 ? 17.180 108.979 53.907 1.00 90.92 ? 35 LYS A CG 1 ATOM 243 C CD . LYS A 1 36 ? 16.268 109.716 52.945 1.00 96.98 ? 35 LYS A CD 1 ATOM 244 C CE . LYS A 1 36 ? 16.572 109.349 51.501 1.00 99.32 ? 35 LYS A CE 1 ATOM 245 N NZ . LYS A 1 36 ? 15.572 109.940 50.570 1.00 104.67 ? 35 LYS A NZ 1 ATOM 246 N N . THR A 1 37 ? 19.918 108.571 55.748 1.00 77.44 ? 36 THR A N 1 ATOM 247 C CA . THR A 1 37 ? 21.206 109.246 55.567 1.00 77.40 ? 36 THR A CA 1 ATOM 248 C C . THR A 1 37 ? 21.524 109.331 54.086 1.00 80.15 ? 36 THR A C 1 ATOM 249 O O . THR A 1 37 ? 21.144 108.458 53.303 1.00 80.61 ? 36 THR A O 1 ATOM 250 C CB . THR A 1 37 ? 22.364 108.530 56.281 1.00 74.26 ? 36 THR A CB 1 ATOM 251 O OG1 . THR A 1 37 ? 22.585 107.243 55.690 1.00 72.58 ? 36 THR A OG1 1 ATOM 252 C CG2 . THR A 1 37 ? 22.060 108.377 57.757 1.00 73.71 ? 36 THR A CG2 1 ATOM 253 N N . GLU A 1 38 ? 22.207 110.399 53.690 1.00 83.33 ? 37 GLU A N 1 ATOM 254 C CA . GLU A 1 38 ? 22.600 110.588 52.294 1.00 86.69 ? 37 GLU A CA 1 ATOM 255 C C . GLU A 1 38 ? 23.790 109.718 51.891 1.00 82.00 ? 37 GLU A C 1 ATOM 256 O O . GLU A 1 38 ? 23.970 109.402 50.712 1.00 81.36 ? 37 GLU A O 1 ATOM 257 C CB . GLU A 1 38 ? 22.959 112.056 52.041 1.00 93.74 ? 37 GLU A CB 1 ATOM 258 C CG . GLU A 1 38 ? 21.803 113.040 52.194 1.00 100.47 ? 37 GLU A CG 1 ATOM 259 C CD . GLU A 1 38 ? 20.833 113.007 51.019 1.00 106.07 ? 37 GLU A CD 1 ATOM 260 O OE1 . GLU A 1 38 ? 20.797 113.996 50.248 1.00 106.94 ? 37 GLU A OE1 1 ATOM 261 O OE2 . GLU A 1 38 ? 20.110 111.990 50.864 1.00 108.87 ? 37 GLU A OE2 1 ATOM 262 N N . SER A 1 39 ? 24.607 109.344 52.868 1.00 77.71 ? 38 SER A N 1 ATOM 263 C CA . SER A 1 39 ? 25.761 108.505 52.603 1.00 74.70 ? 38 SER A CA 1 ATOM 264 C C . SER A 1 39 ? 25.941 107.473 53.694 1.00 69.23 ? 38 SER A C 1 ATOM 265 O O . SER A 1 39 ? 25.191 107.430 54.671 1.00 65.94 ? 38 SER A O 1 ATOM 266 C CB . SER A 1 39 ? 27.027 109.352 52.484 1.00 75.80 ? 38 SER A CB 1 ATOM 267 O OG . SER A 1 39 ? 27.009 110.441 53.385 1.00 75.80 ? 38 SER A OG 1 ATOM 268 N N . TYR A 1 40 ? 26.956 106.635 53.514 1.00 65.11 ? 39 TYR A N 1 ATOM 269 C CA . TYR A 1 40 ? 27.345 105.678 54.540 1.00 60.66 ? 39 TYR A CA 1 ATOM 270 C C . TYR A 1 40 ? 28.034 106.412 55.683 1.00 59.00 ? 39 TYR A C 1 ATOM 271 O O . TYR A 1 40 ? 28.687 107.437 55.466 1.00 59.58 ? 39 TYR A O 1 ATOM 272 C CB . TYR A 1 40 ? 28.253 104.574 53.969 1.00 58.22 ? 39 TYR A CB 1 ATOM 273 C CG . TYR A 1 40 ? 27.504 103.589 53.097 1.00 58.58 ? 39 TYR A CG 1 ATOM 274 C CD1 . TYR A 1 40 ? 27.180 103.900 51.774 1.00 59.77 ? 39 TYR A CD1 1 ATOM 275 C CD2 . TYR A 1 40 ? 27.110 102.351 53.592 1.00 57.04 ? 39 TYR A CD2 1 ATOM 276 C CE1 . TYR A 1 40 ? 26.483 103.011 50.976 1.00 59.39 ? 39 TYR A CE1 1 ATOM 277 C CE2 . TYR A 1 40 ? 26.416 101.453 52.798 1.00 57.75 ? 39 TYR A CE2 1 ATOM 278 C CZ . TYR A 1 40 ? 26.105 101.790 51.492 1.00 59.36 ? 39 TYR A CZ 1 ATOM 279 O OH . TYR A 1 40 ? 25.420 100.896 50.701 1.00 60.57 ? 39 TYR A OH 1 ATOM 280 N N . PHE A 1 41 ? 27.849 105.904 56.897 1.00 56.13 ? 40 PHE A N 1 ATOM 281 C CA . PHE A 1 41 ? 28.537 106.426 58.059 1.00 54.89 ? 40 PHE A CA 1 ATOM 282 C C . PHE A 1 41 ? 29.089 105.227 58.829 1.00 53.69 ? 40 PHE A C 1 ATOM 283 O O . PHE A 1 41 ? 28.646 104.090 58.638 1.00 51.81 ? 40 PHE A O 1 ATOM 284 C CB . PHE A 1 41 ? 27.579 107.233 58.930 1.00 55.08 ? 40 PHE A CB 1 ATOM 285 C CG . PHE A 1 41 ? 26.461 106.418 59.518 1.00 54.41 ? 40 PHE A CG 1 ATOM 286 C CD1 . PHE A 1 41 ? 25.310 106.168 58.795 1.00 55.14 ? 40 PHE A CD1 1 ATOM 287 C CD2 . PHE A 1 41 ? 26.568 105.892 60.790 1.00 53.23 ? 40 PHE A CD2 1 ATOM 288 C CE1 . PHE A 1 41 ? 24.285 105.412 59.332 1.00 54.91 ? 40 PHE A CE1 1 ATOM 289 C CE2 . PHE A 1 41 ? 25.546 105.144 61.337 1.00 53.06 ? 40 PHE A CE2 1 ATOM 290 C CZ . PHE A 1 41 ? 24.401 104.901 60.608 1.00 54.10 ? 40 PHE A CZ 1 ATOM 291 N N . THR A 1 42 ? 30.053 105.480 59.706 1.00 52.60 ? 41 THR A N 1 ATOM 292 C CA . THR A 1 42 ? 30.626 104.416 60.510 1.00 50.38 ? 41 THR A CA 1 ATOM 293 C C . THR A 1 42 ? 29.675 104.001 61.627 1.00 50.79 ? 41 THR A C 1 ATOM 294 O O . THR A 1 42 ? 29.325 104.804 62.486 1.00 54.61 ? 41 THR A O 1 ATOM 295 C CB . THR A 1 42 ? 31.971 104.833 61.116 1.00 50.08 ? 41 THR A CB 1 ATOM 296 O OG1 . THR A 1 42 ? 32.903 105.061 60.063 1.00 49.20 ? 41 THR A OG1 1 ATOM 297 C CG2 . THR A 1 42 ? 32.520 103.733 62.037 1.00 49.09 ? 41 THR A CG2 1 ATOM 298 N N . ILE A 1 43 ? 29.257 102.744 61.598 1.00 49.63 ? 42 ILE A N 1 ATOM 299 C CA . ILE A 1 43 ? 28.359 102.198 62.613 1.00 49.34 ? 42 ILE A CA 1 ATOM 300 C C . ILE A 1 43 ? 29.105 101.380 63.683 1.00 48.49 ? 42 ILE A C 1 ATOM 301 O O . ILE A 1 43 ? 28.584 101.154 64.768 1.00 47.49 ? 42 ILE A O 1 ATOM 302 C CB . ILE A 1 43 ? 27.200 101.407 61.956 1.00 49.27 ? 42 ILE A CB 1 ATOM 303 C CG1 . ILE A 1 43 ? 26.004 101.314 62.907 1.00 50.03 ? 42 ILE A CG1 1 ATOM 304 C CG2 . ILE A 1 43 ? 27.647 100.029 61.495 1.00 48.06 ? 42 ILE A CG2 1 ATOM 305 C CD1 . ILE A 1 43 ? 24.792 100.656 62.289 1.00 51.10 ? 42 ILE A CD1 1 ATOM 306 N N . TRP A 1 44 ? 30.317 100.940 63.368 1.00 49.44 ? 43 TRP A N 1 ATOM 307 C CA . TRP A 1 44 ? 31.237 100.383 64.358 1.00 50.68 ? 43 TRP A CA 1 ATOM 308 C C . TRP A 1 44 ? 32.661 100.758 63.948 1.00 52.00 ? 43 TRP A C 1 ATOM 309 O O . TRP A 1 44 ? 33.035 100.497 62.801 1.00 52.76 ? 43 TRP A O 1 ATOM 310 C CB . TRP A 1 44 ? 31.102 98.866 64.426 1.00 51.23 ? 43 TRP A CB 1 ATOM 311 C CG . TRP A 1 44 ? 31.989 98.256 65.459 1.00 52.34 ? 43 TRP A CG 1 ATOM 312 C CD1 . TRP A 1 44 ? 33.207 97.681 65.256 1.00 52.31 ? 43 TRP A CD1 1 ATOM 313 C CD2 . TRP A 1 44 ? 31.741 98.186 66.861 1.00 53.43 ? 43 TRP A CD2 1 ATOM 314 N NE1 . TRP A 1 44 ? 33.728 97.245 66.441 1.00 51.87 ? 43 TRP A NE1 1 ATOM 315 C CE2 . TRP A 1 44 ? 32.849 97.542 67.446 1.00 53.31 ? 43 TRP A CE2 1 ATOM 316 C CE3 . TRP A 1 44 ? 30.684 98.599 67.685 1.00 55.50 ? 43 TRP A CE3 1 ATOM 317 C CZ2 . TRP A 1 44 ? 32.932 97.293 68.817 1.00 53.99 ? 43 TRP A CZ2 1 ATOM 318 C CZ3 . TRP A 1 44 ? 30.765 98.349 69.052 1.00 55.10 ? 43 TRP A CZ3 1 ATOM 319 C CH2 . TRP A 1 44 ? 31.885 97.701 69.600 1.00 54.33 ? 43 TRP A CH2 1 ATOM 320 N N . LEU A 1 45 ? 33.475 101.369 64.823 1.00 53.28 ? 44 LEU A N 1 ATOM 321 C CA . LEU A 1 45 ? 33.135 101.773 66.189 1.00 54.32 ? 44 LEU A CA 1 ATOM 322 C C . LEU A 1 45 ? 32.968 103.288 66.237 1.00 55.54 ? 44 LEU A C 1 ATOM 323 O O . LEU A 1 45 ? 33.885 104.020 65.858 1.00 55.59 ? 44 LEU A O 1 ATOM 324 C CB . LEU A 1 45 ? 34.247 101.351 67.152 1.00 55.02 ? 44 LEU A CB 1 ATOM 325 C CG . LEU A 1 45 ? 34.183 101.874 68.595 1.00 56.84 ? 44 LEU A CG 1 ATOM 326 C CD1 . LEU A 1 45 ? 32.928 101.384 69.302 1.00 57.32 ? 44 LEU A CD1 1 ATOM 327 C CD2 . LEU A 1 45 ? 35.419 101.449 69.371 1.00 56.98 ? 44 LEU A CD2 1 ATOM 328 N N . ASN A 1 46 ? 31.807 103.748 66.695 1.00 56.93 ? 45 ASN A N 1 ATOM 329 C CA . ASN A 1 46 ? 31.572 105.179 66.879 1.00 58.40 ? 45 ASN A CA 1 ATOM 330 C C . ASN A 1 46 ? 30.889 105.384 68.218 1.00 58.36 ? 45 ASN A C 1 ATOM 331 O O . ASN A 1 46 ? 29.722 105.002 68.395 1.00 56.95 ? 45 ASN A O 1 ATOM 332 C CB . ASN A 1 46 ? 30.700 105.692 65.743 1.00 60.32 ? 45 ASN A CB 1 ATOM 333 C CG . ASN A 1 46 ? 30.490 107.192 65.778 1.00 63.17 ? 45 ASN A CG 1 ATOM 334 O OD1 . ASN A 1 46 ? 30.686 107.855 66.798 1.00 64.91 ? 45 ASN A OD1 1 ATOM 335 N ND2 . ASN A 1 46 ? 30.074 107.734 64.646 1.00 65.11 ? 45 ASN A ND2 1 ATOM 336 N N . LEU A 1 47 ? 31.637 105.950 69.165 1.00 60.43 ? 46 LEU A N 1 ATOM 337 C CA . LEU A 1 47 ? 31.206 106.004 70.560 1.00 62.43 ? 46 LEU A CA 1 ATOM 338 C C . LEU A 1 47 ? 29.960 106.859 70.753 1.00 63.27 ? 46 LEU A C 1 ATOM 339 O O . LEU A 1 47 ? 29.171 106.607 71.649 1.00 61.45 ? 46 LEU A O 1 ATOM 340 C CB . LEU A 1 47 ? 32.333 106.536 71.457 1.00 62.97 ? 46 LEU A CB 1 ATOM 341 C CG . LEU A 1 47 ? 33.523 105.590 71.657 1.00 63.20 ? 46 LEU A CG 1 ATOM 342 C CD1 . LEU A 1 47 ? 34.695 106.324 72.300 1.00 64.07 ? 46 LEU A CD1 1 ATOM 343 C CD2 . LEU A 1 47 ? 33.120 104.365 72.477 1.00 61.46 ? 46 LEU A CD2 1 ATOM 344 N N . GLU A 1 48 ? 29.765 107.842 69.887 1.00 65.79 ? 47 GLU A N 1 ATOM 345 C CA . GLU A 1 48 ? 28.627 108.727 70.007 1.00 71.87 ? 47 GLU A CA 1 ATOM 346 C C . GLU A 1 48 ? 27.280 108.035 69.770 1.00 70.91 ? 47 GLU A C 1 ATOM 347 O O . GLU A 1 48 ? 26.235 108.524 70.239 1.00 76.73 ? 47 GLU A O 1 ATOM 348 C CB . GLU A 1 48 ? 28.759 109.873 69.003 1.00 75.47 ? 47 GLU A CB 1 ATOM 349 C CG . GLU A 1 48 ? 29.930 110.821 69.247 1.00 80.37 ? 47 GLU A CG 1 ATOM 350 C CD . GLU A 1 48 ? 30.091 111.849 68.130 1.00 86.69 ? 47 GLU A CD 1 ATOM 351 O OE1 . GLU A 1 48 ? 30.051 111.463 66.939 1.00 86.72 ? 47 GLU A OE1 1 ATOM 352 O OE2 . GLU A 1 48 ? 30.260 113.051 68.439 1.00 91.86 ? 47 GLU A OE2 1 ATOM 353 N N . LEU A 1 49 ? 27.300 106.887 69.086 1.00 65.92 ? 48 LEU A N 1 ATOM 354 C CA . LEU A 1 49 ? 26.075 106.164 68.782 1.00 62.60 ? 48 LEU A CA 1 ATOM 355 C C . LEU A 1 49 ? 25.605 105.288 69.949 1.00 61.03 ? 48 LEU A C 1 ATOM 356 O O . LEU A 1 49 ? 24.444 104.772 69.961 1.00 61.22 ? 48 LEU A O 1 ATOM 357 C CB . LEU A 1 49 ? 26.273 105.306 67.538 1.00 60.72 ? 48 LEU A CB 1 ATOM 358 C CG . LEU A 1 49 ? 26.889 105.987 66.309 1.00 60.88 ? 48 LEU A CG 1 ATOM 359 C CD1 . LEU A 1 49 ? 27.109 104.969 65.207 1.00 59.61 ? 48 LEU A CD1 1 ATOM 360 C CD2 . LEU A 1 49 ? 26.014 107.129 65.825 1.00 62.34 ? 48 LEU A CD2 1 ATOM 361 N N . LEU A 1 50 ? 26.497 105.113 70.930 1.00 60.61 ? 49 LEU A N 1 ATOM 362 C CA . LEU A 1 50 ? 26.266 104.158 72.013 1.00 59.77 ? 49 LEU A CA 1 ATOM 363 C C . LEU A 1 50 ? 25.845 104.814 73.336 1.00 60.24 ? 49 LEU A C 1 ATOM 364 O O . LEU A 1 50 ? 25.697 104.120 74.354 1.00 59.78 ? 49 LEU A O 1 ATOM 365 C CB . LEU A 1 50 ? 27.517 103.303 72.231 1.00 58.48 ? 49 LEU A CB 1 ATOM 366 C CG . LEU A 1 50 ? 28.162 102.809 70.932 1.00 57.44 ? 49 LEU A CG 1 ATOM 367 C CD1 . LEU A 1 50 ? 29.497 102.146 71.225 1.00 56.33 ? 49 LEU A CD1 1 ATOM 368 C CD2 . LEU A 1 50 ? 27.221 101.852 70.204 1.00 57.68 ? 49 LEU A CD2 1 ATOM 369 N N . LEU A 1 51 ? 25.612 106.137 73.329 1.00 61.15 ? 50 LEU A N 1 ATOM 370 C CA . LEU A 1 51 ? 25.076 106.825 74.503 1.00 63.77 ? 50 LEU A CA 1 ATOM 371 C C . LEU A 1 51 ? 23.648 106.354 74.846 1.00 63.34 ? 50 LEU A C 1 ATOM 372 O O . LEU A 1 51 ? 22.944 105.833 73.973 1.00 64.30 ? 50 LEU A O 1 ATOM 373 C CB . LEU A 1 51 ? 25.049 108.334 74.268 1.00 67.52 ? 50 LEU A CB 1 ATOM 374 C CG . LEU A 1 51 ? 26.357 109.009 73.837 1.00 68.99 ? 50 LEU A CG 1 ATOM 375 C CD1 . LEU A 1 51 ? 26.131 110.486 73.564 1.00 69.72 ? 50 LEU A CD1 1 ATOM 376 C CD2 . LEU A 1 51 ? 27.441 108.801 74.888 1.00 69.41 ? 50 LEU A CD2 1 ATOM 377 N N . PRO A 1 52 ? 23.227 106.514 76.120 1.00 63.35 ? 51 PRO A N 1 ATOM 378 C CA . PRO A 1 52 ? 21.973 105.896 76.543 1.00 63.51 ? 51 PRO A CA 1 ATOM 379 C C . PRO A 1 52 ? 20.824 106.385 75.671 1.00 62.43 ? 51 PRO A C 1 ATOM 380 O O . PRO A 1 52 ? 20.168 105.566 75.061 1.00 61.38 ? 51 PRO A O 1 ATOM 381 C CB . PRO A 1 52 ? 21.820 106.334 77.998 1.00 64.36 ? 51 PRO A CB 1 ATOM 382 C CG . PRO A 1 52 ? 23.228 106.486 78.449 1.00 64.45 ? 51 PRO A CG 1 ATOM 383 C CD . PRO A 1 52 ? 23.995 107.010 77.266 1.00 64.08 ? 51 PRO A CD 1 ATOM 384 N N . VAL A 1 53 ? 20.679 107.711 75.496 1.00 63.64 ? 52 VAL A N 1 ATOM 385 C CA . VAL A 1 53 ? 19.642 108.346 74.634 1.00 65.76 ? 52 VAL A CA 1 ATOM 386 C C . VAL A 1 53 ? 19.461 107.814 73.172 1.00 64.07 ? 52 VAL A C 1 ATOM 387 O O . VAL A 1 53 ? 18.414 108.015 72.610 1.00 65.30 ? 52 VAL A O 1 ATOM 388 C CB . VAL A 1 53 ? 19.818 109.906 74.683 1.00 69.22 ? 52 VAL A CB 1 ATOM 389 C CG1 . VAL A 1 53 ? 20.999 110.387 73.841 1.00 68.53 ? 52 VAL A CG1 1 ATOM 390 C CG2 . VAL A 1 53 ? 18.530 110.628 74.304 1.00 71.92 ? 52 VAL A CG2 1 ATOM 391 N N . ILE A 1 54 ? 20.409 107.051 72.618 1.00 61.80 ? 53 ILE A N 1 ATOM 392 C CA . ILE A 1 54 ? 20.373 106.705 71.214 1.00 61.64 ? 53 ILE A CA 1 ATOM 393 C C . ILE A 1 54 ? 20.901 105.300 70.926 1.00 58.35 ? 53 ILE A C 1 ATOM 394 O O . ILE A 1 54 ? 20.834 104.861 69.816 1.00 58.10 ? 53 ILE A O 1 ATOM 395 C CB . ILE A 1 54 ? 21.081 107.763 70.333 1.00 64.32 ? 53 ILE A CB 1 ATOM 396 C CG1 . ILE A 1 54 ? 22.531 107.982 70.762 1.00 64.86 ? 53 ILE A CG1 1 ATOM 397 C CG2 . ILE A 1 54 ? 20.293 109.075 70.363 1.00 67.73 ? 53 ILE A CG2 1 ATOM 398 C CD1 . ILE A 1 54 ? 23.293 108.866 69.792 1.00 64.97 ? 53 ILE A CD1 1 ATOM 399 N N . ILE A 1 55 ? 21.401 104.576 71.923 1.00 55.12 ? 54 ILE A N 1 ATOM 400 C CA . ILE A 1 55 ? 21.780 103.173 71.775 1.00 53.12 ? 54 ILE A CA 1 ATOM 401 C C . ILE A 1 55 ? 20.661 102.308 71.170 1.00 52.22 ? 54 ILE A C 1 ATOM 402 O O . ILE A 1 55 ? 20.929 101.331 70.481 1.00 52.69 ? 54 ILE A O 1 ATOM 403 C CB . ILE A 1 55 ? 22.169 102.570 73.170 1.00 52.16 ? 54 ILE A CB 1 ATOM 404 C CG1 . ILE A 1 55 ? 22.775 101.175 73.055 1.00 50.80 ? 54 ILE A CG1 1 ATOM 405 C CG2 . ILE A 1 55 ? 20.973 102.496 74.115 1.00 52.10 ? 54 ILE A CG2 1 ATOM 406 C CD1 . ILE A 1 55 ? 24.189 101.192 72.544 1.00 52.62 ? 54 ILE A CD1 1 ATOM 407 N N . ASP A 1 56 ? 19.408 102.644 71.447 1.00 53.78 ? 55 ASP A N 1 ATOM 408 C CA . ASP A 1 56 ? 18.285 101.897 70.856 1.00 54.24 ? 55 ASP A CA 1 ATOM 409 C C . ASP A 1 56 ? 18.236 102.059 69.332 1.00 54.42 ? 55 ASP A C 1 ATOM 410 O O . ASP A 1 56 ? 17.891 101.116 68.617 1.00 53.75 ? 55 ASP A O 1 ATOM 411 C CB . ASP A 1 56 ? 16.939 102.325 71.453 1.00 56.83 ? 55 ASP A CB 1 ATOM 412 C CG . ASP A 1 56 ? 16.745 101.849 72.888 1.00 57.89 ? 55 ASP A CG 1 ATOM 413 O OD1 . ASP A 1 56 ? 17.253 100.769 73.248 1.00 58.56 ? 55 ASP A OD1 1 ATOM 414 O OD2 . ASP A 1 56 ? 16.056 102.548 73.659 1.00 60.88 ? 55 ASP A OD2 1 ATOM 415 N N . CYS A 1 57 ? 18.588 103.247 68.843 1.00 55.00 ? 56 CYS A N 1 ATOM 416 C CA . CYS A 1 57 ? 18.721 103.500 67.404 1.00 56.10 ? 56 CYS A CA 1 ATOM 417 C C . CYS A 1 57 ? 19.819 102.609 66.815 1.00 53.35 ? 56 CYS A C 1 ATOM 418 O O . CYS A 1 57 ? 19.649 101.999 65.756 1.00 53.40 ? 56 CYS A O 1 ATOM 419 C CB . CYS A 1 57 ? 19.033 104.983 67.128 1.00 58.54 ? 56 CYS A CB 1 ATOM 420 S SG . CYS A 1 57 ? 17.896 106.165 67.906 1.00 61.64 ? 56 CYS A SG 1 ATOM 421 N N . TRP A 1 58 ? 20.963 102.559 67.489 1.00 51.47 ? 57 TRP A N 1 ATOM 422 C CA . TRP A 1 58 ? 22.093 101.755 67.043 1.00 49.65 ? 57 TRP A CA 1 ATOM 423 C C . TRP A 1 58 ? 21.737 100.274 66.982 1.00 48.62 ? 57 TRP A C 1 ATOM 424 O O . TRP A 1 58 ? 21.980 99.610 65.975 1.00 47.32 ? 57 TRP A O 1 ATOM 425 C CB . TRP A 1 58 ? 23.288 101.967 67.969 1.00 48.15 ? 57 TRP A CB 1 ATOM 426 C CG . TRP A 1 58 ? 24.503 101.180 67.607 1.00 46.84 ? 57 TRP A CG 1 ATOM 427 C CD1 . TRP A 1 58 ? 25.402 101.472 66.622 1.00 48.08 ? 57 TRP A CD1 1 ATOM 428 C CD2 . TRP A 1 58 ? 24.973 99.979 68.236 1.00 45.40 ? 57 TRP A CD2 1 ATOM 429 N NE1 . TRP A 1 58 ? 26.402 100.524 66.598 1.00 46.21 ? 57 TRP A NE1 1 ATOM 430 C CE2 . TRP A 1 58 ? 26.161 99.599 67.579 1.00 44.71 ? 57 TRP A CE2 1 ATOM 431 C CE3 . TRP A 1 58 ? 24.506 99.189 69.294 1.00 44.76 ? 57 TRP A CE3 1 ATOM 432 C CZ2 . TRP A 1 58 ? 26.887 98.464 67.944 1.00 44.17 ? 57 TRP A CZ2 1 ATOM 433 C CZ3 . TRP A 1 58 ? 25.233 98.053 69.658 1.00 43.12 ? 57 TRP A CZ3 1 ATOM 434 C CH2 . TRP A 1 58 ? 26.407 97.704 68.986 1.00 42.96 ? 57 TRP A CH2 1 ATOM 435 N N . ILE A 1 59 ? 21.133 99.770 68.054 1.00 48.27 ? 58 ILE A N 1 ATOM 436 C CA . ILE A 1 59 ? 20.656 98.386 68.102 1.00 48.74 ? 58 ILE A CA 1 ATOM 437 C C . ILE A 1 59 ? 19.717 98.099 66.925 1.00 49.38 ? 58 ILE A C 1 ATOM 438 O O . ILE A 1 59 ? 19.826 97.069 66.257 1.00 48.62 ? 58 ILE A O 1 ATOM 439 C CB . ILE A 1 59 ? 19.826 98.110 69.380 1.00 49.11 ? 58 ILE A CB 1 ATOM 440 C CG1 . ILE A 1 59 ? 20.664 98.252 70.655 1.00 49.48 ? 58 ILE A CG1 1 ATOM 441 C CG2 . ILE A 1 59 ? 19.167 96.729 69.321 1.00 48.07 ? 58 ILE A CG2 1 ATOM 442 C CD1 . ILE A 1 59 ? 21.728 97.199 70.839 1.00 50.49 ? 58 ILE A CD1 1 ATOM 443 N N . ASP A 1 60 ? 18.786 99.015 66.675 1.00 51.48 ? 59 ASP A N 1 ATOM 444 C CA . ASP A 1 60 ? 17.815 98.807 65.604 1.00 53.34 ? 59 ASP A CA 1 ATOM 445 C C . ASP A 1 60 ? 18.467 98.711 64.218 1.00 53.72 ? 59 ASP A C 1 ATOM 446 O O . ASP A 1 60 ? 17.909 98.072 63.328 1.00 56.14 ? 59 ASP A O 1 ATOM 447 C CB . ASP A 1 60 ? 16.721 99.871 65.573 1.00 55.10 ? 59 ASP A CB 1 ATOM 448 C CG . ASP A 1 60 ? 15.526 99.435 64.736 1.00 56.59 ? 59 ASP A CG 1 ATOM 449 O OD1 . ASP A 1 60 ? 15.037 98.311 64.970 1.00 55.18 ? 59 ASP A OD1 1 ATOM 450 O OD2 . ASP A 1 60 ? 15.088 100.194 63.840 1.00 59.56 ? 59 ASP A OD2 1 ATOM 451 N N . ASN A 1 61 ? 19.623 99.353 64.045 1.00 51.95 ? 60 ASN A N 1 ATOM 452 C CA . ASN A 1 61 ? 20.333 99.349 62.767 1.00 52.20 ? 60 ASN A CA 1 ATOM 453 C C . ASN A 1 61 ? 21.360 98.237 62.623 1.00 51.21 ? 60 ASN A C 1 ATOM 454 O O . ASN A 1 61 ? 21.563 97.725 61.511 1.00 49.86 ? 60 ASN A O 1 ATOM 455 C CB . ASN A 1 61 ? 21.030 100.693 62.527 1.00 52.06 ? 60 ASN A CB 1 ATOM 456 C CG . ASN A 1 61 ? 20.061 101.805 62.214 1.00 53.30 ? 60 ASN A CG 1 ATOM 457 O OD1 . ASN A 1 61 ? 18.995 101.581 61.638 1.00 54.55 ? 60 ASN A OD1 1 ATOM 458 N ND2 . ASN A 1 61 ? 20.434 103.019 62.577 1.00 53.73 ? 60 ASN A ND2 1 ATOM 459 N N . ILE A 1 62 ? 22.017 97.875 63.720 1.00 50.27 ? 61 ILE A N 1 ATOM 460 C CA . ILE A 1 62 ? 23.093 96.885 63.652 1.00 50.40 ? 61 ILE A CA 1 ATOM 461 C C . ILE A 1 62 ? 22.638 95.445 63.942 1.00 48.82 ? 61 ILE A C 1 ATOM 462 O O . ILE A 1 62 ? 23.379 94.496 63.686 1.00 47.16 ? 61 ILE A O 1 ATOM 463 C CB . ILE A 1 62 ? 24.271 97.260 64.575 1.00 51.23 ? 61 ILE A CB 1 ATOM 464 C CG1 . ILE A 1 62 ? 25.553 96.607 64.054 1.00 51.68 ? 61 ILE A CG1 1 ATOM 465 C CG2 . ILE A 1 62 ? 23.985 96.890 66.031 1.00 49.45 ? 61 ILE A CG2 1 ATOM 466 C CD1 . ILE A 1 62 ? 26.782 97.024 64.817 1.00 53.42 ? 61 ILE A CD1 1 ATOM 467 N N . ARG A 1 63 ? 21.426 95.279 64.467 1.00 49.20 ? 62 ARG A N 1 ATOM 468 C CA . ARG A 1 63 ? 20.866 93.947 64.634 1.00 50.77 ? 62 ARG A CA 1 ATOM 469 C C . ARG A 1 63 ? 20.677 93.268 63.276 1.00 51.75 ? 62 ARG A C 1 ATOM 470 O O . ARG A 1 63 ? 20.489 93.936 62.260 1.00 52.87 ? 62 ARG A O 1 ATOM 471 C CB . ARG A 1 63 ? 19.533 93.976 65.389 1.00 52.24 ? 62 ARG A CB 1 ATOM 472 C CG . ARG A 1 63 ? 18.380 94.535 64.583 1.00 56.02 ? 62 ARG A CG 1 ATOM 473 C CD . ARG A 1 63 ? 17.133 94.734 65.424 1.00 57.64 ? 62 ARG A CD 1 ATOM 474 N NE . ARG A 1 63 ? 16.173 95.538 64.670 1.00 62.09 ? 62 ARG A NE 1 ATOM 475 C CZ . ARG A 1 63 ? 15.158 95.065 63.942 1.00 64.96 ? 62 ARG A CZ 1 ATOM 476 N NH1 . ARG A 1 63 ? 14.904 93.764 63.856 1.00 65.88 ? 62 ARG A NH1 1 ATOM 477 N NH2 . ARG A 1 63 ? 14.379 95.919 63.291 1.00 67.18 ? 62 ARG A NH2 1 ATOM 478 N N . LEU A 1 64 ? 20.784 91.942 63.264 1.00 51.00 ? 63 LEU A N 1 ATOM 479 C CA . LEU A 1 64 ? 20.335 91.125 62.134 1.00 51.03 ? 63 LEU A CA 1 ATOM 480 C C . LEU A 1 64 ? 18.922 90.594 62.392 1.00 51.31 ? 63 LEU A C 1 ATOM 481 O O . LEU A 1 64 ? 18.558 90.304 63.532 1.00 51.39 ? 63 LEU A O 1 ATOM 482 C CB . LEU A 1 64 ? 21.277 89.946 61.910 1.00 50.51 ? 63 LEU A CB 1 ATOM 483 C CG . LEU A 1 64 ? 22.739 90.252 61.571 1.00 50.53 ? 63 LEU A CG 1 ATOM 484 C CD1 . LEU A 1 64 ? 23.510 88.945 61.498 1.00 50.93 ? 63 LEU A CD1 1 ATOM 485 C CD2 . LEU A 1 64 ? 22.886 91.033 60.272 1.00 51.80 ? 63 LEU A CD2 1 ATOM 486 N N . VAL A 1 65 ? 18.134 90.485 61.329 1.00 51.32 ? 64 VAL A N 1 ATOM 487 C CA . VAL A 1 65 ? 16.813 89.887 61.398 1.00 52.82 ? 64 VAL A CA 1 ATOM 488 C C . VAL A 1 65 ? 16.918 88.430 60.928 1.00 53.29 ? 64 VAL A C 1 ATOM 489 O O . VAL A 1 65 ? 17.467 88.152 59.857 1.00 56.09 ? 64 VAL A O 1 ATOM 490 C CB . VAL A 1 65 ? 15.817 90.665 60.508 1.00 55.07 ? 64 VAL A CB 1 ATOM 491 C CG1 . VAL A 1 65 ? 14.467 89.962 60.429 1.00 56.50 ? 64 VAL A CG1 1 ATOM 492 C CG2 . VAL A 1 65 ? 15.642 92.072 61.042 1.00 55.66 ? 64 VAL A CG2 1 ATOM 493 N N . TYR A 1 66 ? 16.425 87.502 61.735 1.00 53.10 ? 65 TYR A N 1 ATOM 494 C CA . TYR A 1 66 ? 16.460 86.096 61.356 1.00 53.71 ? 65 TYR A CA 1 ATOM 495 C C . TYR A 1 66 ? 15.154 85.721 60.659 1.00 56.51 ? 65 TYR A C 1 ATOM 496 O O . TYR A 1 66 ? 14.076 85.891 61.216 1.00 58.10 ? 65 TYR A O 1 ATOM 497 C CB . TYR A 1 66 ? 16.740 85.172 62.559 1.00 51.82 ? 65 TYR A CB 1 ATOM 498 C CG . TYR A 1 66 ? 17.077 83.774 62.097 1.00 51.69 ? 65 TYR A CG 1 ATOM 499 C CD1 . TYR A 1 66 ? 18.368 83.441 61.709 1.00 50.42 ? 65 TYR A CD1 1 ATOM 500 C CD2 . TYR A 1 66 ? 16.094 82.804 61.991 1.00 53.32 ? 65 TYR A CD2 1 ATOM 501 C CE1 . TYR A 1 66 ? 18.677 82.172 61.253 1.00 51.26 ? 65 TYR A CE1 1 ATOM 502 C CE2 . TYR A 1 66 ? 16.395 81.529 61.535 1.00 54.57 ? 65 TYR A CE2 1 ATOM 503 C CZ . TYR A 1 66 ? 17.687 81.221 61.166 1.00 52.68 ? 65 TYR A CZ 1 ATOM 504 O OH . TYR A 1 66 ? 17.979 79.955 60.717 1.00 52.81 ? 65 TYR A OH 1 ATOM 505 N N . ASN A 1 67 ? 15.258 85.195 59.443 1.00 58.92 ? 66 ASN A N 1 ATOM 506 C CA . ASN A 1 67 ? 14.098 84.726 58.705 1.00 61.54 ? 66 ASN A CA 1 ATOM 507 C C . ASN A 1 67 ? 14.014 83.209 58.828 1.00 62.51 ? 66 ASN A C 1 ATOM 508 O O . ASN A 1 67 ? 14.854 82.492 58.280 1.00 61.07 ? 66 ASN A O 1 ATOM 509 C CB . ASN A 1 67 ? 14.211 85.148 57.238 1.00 63.73 ? 66 ASN A CB 1 ATOM 510 C CG . ASN A 1 67 ? 12.987 84.783 56.428 1.00 66.86 ? 66 ASN A CG 1 ATOM 511 O OD1 . ASN A 1 67 ? 12.338 83.774 56.686 1.00 68.26 ? 66 ASN A OD1 1 ATOM 512 N ND2 . ASN A 1 67 ? 12.678 85.596 55.415 1.00 72.17 ? 66 ASN A ND2 1 ATOM 513 N N . LYS A 1 68 ? 13.000 82.730 59.546 1.00 64.57 ? 67 LYS A N 1 ATOM 514 C CA . LYS A 1 68 ? 12.844 81.300 59.836 1.00 66.45 ? 67 LYS A CA 1 ATOM 515 C C . LYS A 1 68 ? 12.545 80.462 58.588 1.00 67.00 ? 67 LYS A C 1 ATOM 516 O O . LYS A 1 68 ? 12.877 79.278 58.533 1.00 66.44 ? 67 LYS A O 1 ATOM 517 C CB . LYS A 1 68 ? 11.681 81.067 60.807 1.00 69.35 ? 67 LYS A CB 1 ATOM 518 C CG . LYS A 1 68 ? 11.790 81.679 62.197 1.00 71.14 ? 67 LYS A CG 1 ATOM 519 C CD . LYS A 1 68 ? 10.477 81.459 62.945 1.00 74.51 ? 67 LYS A CD 1 ATOM 520 C CE . LYS A 1 68 ? 10.541 81.896 64.399 1.00 75.31 ? 67 LYS A CE 1 ATOM 521 N NZ . LYS A 1 68 ? 10.892 83.338 64.532 1.00 77.29 ? 67 LYS A NZ 1 ATOM 522 N N . THR A 1 69 ? 11.908 81.085 57.598 1.00 69.17 ? 68 THR A N 1 ATOM 523 C CA . THR A 1 69 ? 11.546 80.402 56.347 1.00 71.69 ? 68 THR A CA 1 ATOM 524 C C . THR A 1 69 ? 12.779 80.148 55.491 1.00 70.90 ? 68 THR A C 1 ATOM 525 O O . THR A 1 69 ? 13.007 79.024 55.046 1.00 75.09 ? 68 THR A O 1 ATOM 526 C CB . THR A 1 69 ? 10.477 81.178 55.551 1.00 73.89 ? 68 THR A CB 1 ATOM 527 O OG1 . THR A 1 69 ? 9.343 81.416 56.393 1.00 75.01 ? 68 THR A OG1 1 ATOM 528 C CG2 . THR A 1 69 ? 10.030 80.391 54.320 1.00 76.57 ? 68 THR A CG2 1 ATOM 529 N N . SER A 1 70 ? 13.576 81.184 55.257 1.00 68.04 ? 69 SER A N 1 ATOM 530 C CA . SER A 1 70 ? 14.785 81.022 54.471 1.00 67.20 ? 69 SER A CA 1 ATOM 531 C C . SER A 1 70 ? 15.965 80.483 55.282 1.00 65.83 ? 69 SER A C 1 ATOM 532 O O . SER A 1 70 ? 16.972 80.113 54.698 1.00 65.43 ? 69 SER A O 1 ATOM 533 C CB . SER A 1 70 ? 15.180 82.351 53.824 1.00 67.41 ? 69 SER A CB 1 ATOM 534 O OG . SER A 1 70 ? 15.397 83.354 54.799 1.00 67.72 ? 69 SER A OG 1 ATOM 535 N N . ARG A 1 71 ? 15.840 80.428 56.612 1.00 64.71 ? 70 ARG A N 1 ATOM 536 C CA . ARG A 1 71 ? 16.951 80.072 57.495 1.00 62.47 ? 70 ARG A CA 1 ATOM 537 C C . ARG A 1 71 ? 18.183 80.918 57.205 1.00 60.13 ? 70 ARG A C 1 ATOM 538 O O . ARG A 1 71 ? 19.288 80.407 57.048 1.00 59.34 ? 70 ARG A O 1 ATOM 539 C CB . ARG A 1 71 ? 17.285 78.573 57.390 1.00 61.86 ? 70 ARG A CB 1 ATOM 540 C CG . ARG A 1 71 ? 16.120 77.643 57.707 1.00 62.70 ? 70 ARG A CG 1 ATOM 541 C CD . ARG A 1 71 ? 15.667 77.758 59.161 1.00 62.51 ? 70 ARG A CD 1 ATOM 542 N NE . ARG A 1 71 ? 16.702 77.302 60.097 1.00 61.02 ? 70 ARG A NE 1 ATOM 543 C CZ . ARG A 1 71 ? 16.744 76.106 60.680 1.00 61.12 ? 70 ARG A CZ 1 ATOM 544 N NH1 . ARG A 1 71 ? 15.804 75.195 60.457 1.00 63.60 ? 70 ARG A NH1 1 ATOM 545 N NH2 . ARG A 1 71 ? 17.741 75.813 61.503 1.00 60.58 ? 70 ARG A NH2 1 ATOM 546 N N . ALA A 1 72 ? 17.966 82.223 57.125 1.00 59.72 ? 71 ALA A N 1 ATOM 547 C CA . ALA A 1 72 ? 19.007 83.157 56.745 1.00 58.99 ? 71 ALA A CA 1 ATOM 548 C C . ALA A 1 72 ? 18.762 84.479 57.459 1.00 57.55 ? 71 ALA A C 1 ATOM 549 O O . ALA A 1 72 ? 17.634 84.783 57.836 1.00 57.58 ? 71 ALA A O 1 ATOM 550 C CB . ALA A 1 72 ? 19.014 83.354 55.236 1.00 58.82 ? 71 ALA A CB 1 ATOM 551 N N . THR A 1 73 ? 19.820 85.266 57.655 1.00 56.88 ? 72 THR A N 1 ATOM 552 C CA . THR A 1 73 ? 19.680 86.580 58.265 1.00 55.70 ? 72 THR A CA 1 ATOM 553 C C . THR A 1 73 ? 19.540 87.618 57.172 1.00 56.24 ? 72 THR A C 1 ATOM 554 O O . THR A 1 73 ? 19.989 87.424 56.048 1.00 55.69 ? 72 THR A O 1 ATOM 555 C CB . THR A 1 73 ? 20.879 86.955 59.153 1.00 53.97 ? 72 THR A CB 1 ATOM 556 O OG1 . THR A 1 73 ? 22.101 86.791 58.424 1.00 54.28 ? 72 THR A OG1 1 ATOM 557 C CG2 . THR A 1 73 ? 20.908 86.090 60.398 1.00 53.33 ? 72 THR A CG2 1 ATOM 558 N N . GLN A 1 74 ? 18.895 88.721 57.516 1.00 57.05 ? 73 GLN A N 1 ATOM 559 C CA . GLN A 1 74 ? 18.791 89.856 56.618 1.00 58.00 ? 73 GLN A CA 1 ATOM 560 C C . GLN A 1 74 ? 18.939 91.130 57.438 1.00 55.88 ? 73 GLN A C 1 ATOM 561 O O . GLN A 1 74 ? 18.825 91.113 58.664 1.00 54.95 ? 73 GLN A O 1 ATOM 562 C CB . GLN A 1 74 ? 17.473 89.818 55.833 1.00 61.91 ? 73 GLN A CB 1 ATOM 563 C CG . GLN A 1 74 ? 16.253 89.473 56.674 1.00 65.81 ? 73 GLN A CG 1 ATOM 564 C CD . GLN A 1 74 ? 15.061 89.018 55.844 1.00 68.83 ? 73 GLN A CD 1 ATOM 565 O OE1 . GLN A 1 74 ? 15.123 88.012 55.128 1.00 69.09 ? 73 GLN A OE1 1 ATOM 566 N NE2 . GLN A 1 74 ? 13.947 89.729 55.982 1.00 71.13 ? 73 GLN A NE2 1 ATOM 567 N N . PHE A 1 75 ? 19.248 92.230 56.768 1.00 55.25 ? 74 PHE A N 1 ATOM 568 C CA . PHE A 1 75 ? 19.338 93.509 57.452 1.00 54.88 ? 74 PHE A CA 1 ATOM 569 C C . PHE A 1 75 ? 17.923 94.043 57.693 1.00 55.99 ? 74 PHE A C 1 ATOM 570 O O . PHE A 1 75 ? 16.991 93.668 56.984 1.00 57.41 ? 74 PHE A O 1 ATOM 571 C CB . PHE A 1 75 ? 20.165 94.509 56.642 1.00 54.80 ? 74 PHE A CB 1 ATOM 572 C CG . PHE A 1 75 ? 21.515 93.995 56.209 1.00 53.93 ? 74 PHE A CG 1 ATOM 573 C CD1 . PHE A 1 75 ? 22.254 93.134 57.014 1.00 53.69 ? 74 PHE A CD1 1 ATOM 574 C CD2 . PHE A 1 75 ? 22.071 94.411 55.005 1.00 54.29 ? 74 PHE A CD2 1 ATOM 575 C CE1 . PHE A 1 75 ? 23.503 92.682 56.608 1.00 53.27 ? 74 PHE A CE1 1 ATOM 576 C CE2 . PHE A 1 75 ? 23.318 93.969 54.600 1.00 53.14 ? 74 PHE A CE2 1 ATOM 577 C CZ . PHE A 1 75 ? 24.039 93.105 55.405 1.00 52.11 ? 74 PHE A CZ 1 ATOM 578 N N . PRO A 1 76 ? 17.744 94.916 58.701 1.00 55.93 ? 75 PRO A N 1 ATOM 579 C CA . PRO A 1 76 ? 16.425 95.527 58.869 1.00 57.67 ? 75 PRO A CA 1 ATOM 580 C C . PRO A 1 76 ? 15.998 96.304 57.630 1.00 60.80 ? 75 PRO A C 1 ATOM 581 O O . PRO A 1 76 ? 16.851 96.711 56.842 1.00 59.54 ? 75 PRO A O 1 ATOM 582 C CB . PRO A 1 76 ? 16.622 96.483 60.052 1.00 57.06 ? 75 PRO A CB 1 ATOM 583 C CG . PRO A 1 76 ? 17.796 95.956 60.795 1.00 54.36 ? 75 PRO A CG 1 ATOM 584 C CD . PRO A 1 76 ? 18.675 95.288 59.781 1.00 54.04 ? 75 PRO A CD 1 ATOM 585 N N . ASP A 1 77 ? 14.691 96.490 57.457 1.00 64.96 ? 76 ASP A N 1 ATOM 586 C CA . ASP A 1 77 ? 14.175 97.190 56.289 1.00 68.79 ? 76 ASP A CA 1 ATOM 587 C C . ASP A 1 77 ? 14.840 98.556 56.178 1.00 67.77 ? 76 ASP A C 1 ATOM 588 O O . ASP A 1 77 ? 14.899 99.297 57.164 1.00 67.47 ? 76 ASP A O 1 ATOM 589 C CB . ASP A 1 77 ? 12.657 97.374 56.395 1.00 74.00 ? 76 ASP A CB 1 ATOM 590 C CG . ASP A 1 77 ? 11.885 96.057 56.303 1.00 77.00 ? 76 ASP A CG 1 ATOM 591 O OD1 . ASP A 1 77 ? 12.361 95.098 55.646 1.00 77.90 ? 76 ASP A OD1 1 ATOM 592 O OD2 . ASP A 1 77 ? 10.779 95.994 56.887 1.00 80.88 ? 76 ASP A OD2 1 ATOM 593 N N . GLY A 1 78 ? 15.342 98.867 54.983 1.00 66.01 ? 77 GLY A N 1 ATOM 594 C CA . GLY A 1 78 ? 15.960 100.157 54.704 1.00 65.70 ? 77 GLY A CA 1 ATOM 595 C C . GLY A 1 78 ? 17.341 100.378 55.300 1.00 62.86 ? 77 GLY A C 1 ATOM 596 O O . GLY A 1 78 ? 17.815 101.514 55.379 1.00 64.27 ? 77 GLY A O 1 ATOM 597 N N . VAL A 1 79 ? 18.000 99.312 55.732 1.00 60.15 ? 78 VAL A N 1 ATOM 598 C CA . VAL A 1 79 ? 19.353 99.426 56.253 1.00 57.53 ? 78 VAL A CA 1 ATOM 599 C C . VAL A 1 79 ? 20.298 98.645 55.354 1.00 56.20 ? 78 VAL A C 1 ATOM 600 O O . VAL A 1 79 ? 20.004 97.508 54.985 1.00 54.65 ? 78 VAL A O 1 ATOM 601 C CB . VAL A 1 79 ? 19.457 98.935 57.707 1.00 56.11 ? 78 VAL A CB 1 ATOM 602 C CG1 . VAL A 1 79 ? 20.904 98.967 58.182 1.00 54.78 ? 78 VAL A CG1 1 ATOM 603 C CG2 . VAL A 1 79 ? 18.587 99.790 58.615 1.00 57.34 ? 78 VAL A CG2 1 ATOM 604 N N . ASP A 1 80 ? 21.408 99.270 54.976 1.00 56.22 ? 79 ASP A N 1 ATOM 605 C CA . ASP A 1 80 ? 22.507 98.528 54.369 1.00 56.19 ? 79 ASP A CA 1 ATOM 606 C C . ASP A 1 80 ? 23.758 98.646 55.223 1.00 54.54 ? 79 ASP A C 1 ATOM 607 O O . ASP A 1 80 ? 24.062 99.715 55.741 1.00 54.81 ? 79 ASP A O 1 ATOM 608 C CB . ASP A 1 80 ? 22.803 98.997 52.946 1.00 57.43 ? 79 ASP A CB 1 ATOM 609 C CG . ASP A 1 80 ? 23.807 98.097 52.241 1.00 58.55 ? 79 ASP A CG 1 ATOM 610 O OD1 . ASP A 1 80 ? 23.657 96.854 52.316 1.00 59.64 ? 79 ASP A OD1 1 ATOM 611 O OD2 . ASP A 1 80 ? 24.760 98.621 51.624 1.00 59.96 ? 79 ASP A OD2 1 ATOM 612 N N . VAL A 1 81 ? 24.480 97.542 55.353 1.00 52.65 ? 80 VAL A N 1 ATOM 613 C CA . VAL A 1 81 ? 25.715 97.505 56.123 1.00 52.07 ? 80 VAL A CA 1 ATOM 614 C C . VAL A 1 81 ? 26.813 96.917 55.260 1.00 52.20 ? 80 VAL A C 1 ATOM 615 O O . VAL A 1 81 ? 26.638 95.852 54.689 1.00 54.80 ? 80 VAL A O 1 ATOM 616 C CB . VAL A 1 81 ? 25.564 96.648 57.395 1.00 51.29 ? 80 VAL A CB 1 ATOM 617 C CG1 . VAL A 1 81 ? 26.881 96.560 58.144 1.00 50.73 ? 80 VAL A CG1 1 ATOM 618 C CG2 . VAL A 1 81 ? 24.488 97.225 58.304 1.00 51.94 ? 80 VAL A CG2 1 ATOM 619 N N . ARG A 1 82 ? 27.938 97.613 55.150 1.00 52.76 ? 81 ARG A N 1 ATOM 620 C CA . ARG A 1 82 ? 29.056 97.130 54.347 1.00 52.97 ? 81 ARG A CA 1 ATOM 621 C C . ARG A 1 82 ? 30.352 97.136 55.144 1.00 51.19 ? 81 ARG A C 1 ATOM 622 O O . ARG A 1 82 ? 30.462 97.801 56.171 1.00 49.96 ? 81 ARG A O 1 ATOM 623 C CB . ARG A 1 82 ? 29.214 97.957 53.071 1.00 55.68 ? 81 ARG A CB 1 ATOM 624 C CG . ARG A 1 82 ? 29.897 99.296 53.284 1.00 58.98 ? 81 ARG A CG 1 ATOM 625 C CD . ARG A 1 82 ? 29.851 100.166 52.041 1.00 62.38 ? 81 ARG A CD 1 ATOM 626 N NE . ARG A 1 82 ? 30.502 101.457 52.274 1.00 65.33 ? 81 ARG A NE 1 ATOM 627 C CZ . ARG A 1 82 ? 30.502 102.475 51.414 1.00 67.55 ? 81 ARG A CZ 1 ATOM 628 N NH1 . ARG A 1 82 ? 29.877 102.372 50.245 1.00 68.63 ? 81 ARG A NH1 1 ATOM 629 N NH2 . ARG A 1 82 ? 31.131 103.604 51.725 1.00 68.00 ? 81 ARG A NH2 1 ATOM 630 N N . VAL A 1 83 ? 31.327 96.384 54.644 1.00 49.66 ? 82 VAL A N 1 ATOM 631 C CA . VAL A 1 83 ? 32.631 96.243 55.280 1.00 47.83 ? 82 VAL A CA 1 ATOM 632 C C . VAL A 1 83 ? 33.637 97.062 54.483 1.00 48.00 ? 82 VAL A C 1 ATOM 633 O O . VAL A 1 83 ? 33.930 96.726 53.348 1.00 47.89 ? 82 VAL A O 1 ATOM 634 C CB . VAL A 1 83 ? 33.072 94.770 55.291 1.00 46.14 ? 82 VAL A CB 1 ATOM 635 C CG1 . VAL A 1 83 ? 34.450 94.625 55.916 1.00 46.01 ? 82 VAL A CG1 1 ATOM 636 C CG2 . VAL A 1 83 ? 32.046 93.917 56.013 1.00 44.43 ? 82 VAL A CG2 1 ATOM 637 N N . PRO A 1 84 ? 34.153 98.154 55.059 1.00 48.78 ? 83 PRO A N 1 ATOM 638 C CA . PRO A 1 84 ? 35.190 98.921 54.362 1.00 49.14 ? 83 PRO A CA 1 ATOM 639 C C . PRO A 1 84 ? 36.570 98.266 54.500 1.00 48.85 ? 83 PRO A C 1 ATOM 640 O O . PRO A 1 84 ? 36.783 97.420 55.375 1.00 46.83 ? 83 PRO A O 1 ATOM 641 C CB . PRO A 1 84 ? 35.168 100.265 55.101 1.00 49.60 ? 83 PRO A CB 1 ATOM 642 C CG . PRO A 1 84 ? 34.808 99.895 56.504 1.00 48.11 ? 83 PRO A CG 1 ATOM 643 C CD . PRO A 1 84 ? 33.865 98.720 56.392 1.00 47.96 ? 83 PRO A CD 1 ATOM 644 N N . GLY A 1 85 ? 37.494 98.652 53.631 1.00 50.02 ? 84 GLY A N 1 ATOM 645 C CA . GLY A 1 85 ? 38.918 98.393 53.851 1.00 49.93 ? 84 GLY A CA 1 ATOM 646 C C . GLY A 1 85 ? 39.442 97.013 53.516 1.00 48.97 ? 84 GLY A C 1 ATOM 647 O O . GLY A 1 85 ? 40.518 96.627 54.001 1.00 49.75 ? 84 GLY A O 1 ATOM 648 N N . PHE A 1 86 ? 38.705 96.262 52.701 1.00 49.18 ? 85 PHE A N 1 ATOM 649 C CA . PHE A 1 86 ? 39.188 94.944 52.290 1.00 48.82 ? 85 PHE A CA 1 ATOM 650 C C . PHE A 1 86 ? 40.455 95.121 51.455 1.00 48.84 ? 85 PHE A C 1 ATOM 651 O O . PHE A 1 86 ? 40.468 95.882 50.496 1.00 50.45 ? 85 PHE A O 1 ATOM 652 C CB . PHE A 1 86 ? 38.141 94.151 51.507 1.00 48.27 ? 85 PHE A CB 1 ATOM 653 C CG . PHE A 1 86 ? 38.549 92.733 51.262 1.00 48.42 ? 85 PHE A CG 1 ATOM 654 C CD1 . PHE A 1 86 ? 38.286 91.749 52.206 1.00 48.00 ? 85 PHE A CD1 1 ATOM 655 C CD2 . PHE A 1 86 ? 39.253 92.384 50.115 1.00 48.85 ? 85 PHE A CD2 1 ATOM 656 C CE1 . PHE A 1 86 ? 38.680 90.434 51.986 1.00 47.35 ? 85 PHE A CE1 1 ATOM 657 C CE2 . PHE A 1 86 ? 39.657 91.079 49.898 1.00 48.26 ? 85 PHE A CE2 1 ATOM 658 C CZ . PHE A 1 86 ? 39.369 90.102 50.832 1.00 47.73 ? 85 PHE A CZ 1 ATOM 659 N N . GLY A 1 87 ? 41.511 94.412 51.822 1.00 48.94 ? 86 GLY A N 1 ATOM 660 C CA . GLY A 1 87 ? 42.776 94.536 51.122 1.00 49.90 ? 86 GLY A CA 1 ATOM 661 C C . GLY A 1 87 ? 43.665 95.604 51.723 1.00 51.65 ? 86 GLY A C 1 ATOM 662 O O . GLY A 1 87 ? 44.830 95.691 51.368 1.00 53.31 ? 86 GLY A O 1 ATOM 663 N N . LYS A 1 88 ? 43.126 96.402 52.650 1.00 54.57 ? 87 LYS A N 1 ATOM 664 C CA . LYS A 1 88 ? 43.859 97.463 53.345 1.00 56.00 ? 87 LYS A CA 1 ATOM 665 C C . LYS A 1 88 ? 43.977 97.063 54.814 1.00 54.97 ? 87 LYS A C 1 ATOM 666 O O . LYS A 1 88 ? 43.558 95.966 55.195 1.00 56.47 ? 87 LYS A O 1 ATOM 667 C CB . LYS A 1 88 ? 43.125 98.795 53.215 1.00 57.87 ? 87 LYS A CB 1 ATOM 668 C CG . LYS A 1 88 ? 42.711 99.168 51.799 1.00 59.40 ? 87 LYS A CG 1 ATOM 669 C CD . LYS A 1 88 ? 43.904 99.388 50.891 1.00 61.10 ? 87 LYS A CD 1 ATOM 670 C CE . LYS A 1 88 ? 43.443 99.815 49.502 1.00 63.93 ? 87 LYS A CE 1 ATOM 671 N NZ . LYS A 1 88 ? 44.531 99.705 48.495 1.00 64.67 ? 87 LYS A NZ 1 ATOM 672 N N . THR A 1 89 ? 44.580 97.917 55.635 1.00 55.20 ? 88 THR A N 1 ATOM 673 C CA . THR A 1 89 ? 44.737 97.597 57.054 1.00 54.57 ? 88 THR A CA 1 ATOM 674 C C . THR A 1 89 ? 44.046 98.579 57.986 1.00 54.87 ? 88 THR A C 1 ATOM 675 O O . THR A 1 89 ? 43.861 98.268 59.146 1.00 53.87 ? 88 THR A O 1 ATOM 676 C CB . THR A 1 89 ? 46.220 97.489 57.451 1.00 55.03 ? 88 THR A CB 1 ATOM 677 O OG1 . THR A 1 89 ? 46.899 98.707 57.130 1.00 56.74 ? 88 THR A OG1 1 ATOM 678 C CG2 . THR A 1 89 ? 46.879 96.336 56.722 1.00 55.38 ? 88 THR A CG2 1 ATOM 679 N N . PHE A 1 90 ? 43.662 99.750 57.486 1.00 55.93 ? 89 PHE A N 1 ATOM 680 C CA . PHE A 1 90 ? 43.170 100.801 58.368 1.00 55.91 ? 89 PHE A CA 1 ATOM 681 C C . PHE A 1 90 ? 41.966 100.369 59.217 1.00 54.24 ? 89 PHE A C 1 ATOM 682 O O . PHE A 1 90 ? 41.855 100.744 60.395 1.00 54.20 ? 89 PHE A O 1 ATOM 683 C CB . PHE A 1 90 ? 42.867 102.102 57.598 1.00 56.90 ? 89 PHE A CB 1 ATOM 684 C CG . PHE A 1 90 ? 41.659 102.029 56.698 1.00 58.32 ? 89 PHE A CG 1 ATOM 685 C CD1 . PHE A 1 90 ? 40.397 102.353 57.180 1.00 59.34 ? 89 PHE A CD1 1 ATOM 686 C CD2 . PHE A 1 90 ? 41.786 101.666 55.358 1.00 59.00 ? 89 PHE A CD2 1 ATOM 687 C CE1 . PHE A 1 90 ? 39.284 102.299 56.352 1.00 59.93 ? 89 PHE A CE1 1 ATOM 688 C CE2 . PHE A 1 90 ? 40.678 101.610 54.526 1.00 58.77 ? 89 PHE A CE2 1 ATOM 689 C CZ . PHE A 1 90 ? 39.424 101.923 55.025 1.00 59.60 ? 89 PHE A CZ 1 ATOM 690 N N . SER A 1 91 ? 41.078 99.563 58.644 1.00 52.93 ? 90 SER A N 1 ATOM 691 C CA . SER A 1 91 ? 39.806 99.240 59.300 1.00 52.57 ? 90 SER A CA 1 ATOM 692 C C . SER A 1 91 ? 39.930 98.149 60.352 1.00 51.03 ? 90 SER A C 1 ATOM 693 O O . SER A 1 91 ? 38.994 97.961 61.136 1.00 51.78 ? 90 SER A O 1 ATOM 694 C CB . SER A 1 91 ? 38.755 98.812 58.272 1.00 53.16 ? 90 SER A CB 1 ATOM 695 O OG . SER A 1 91 ? 39.060 97.548 57.690 1.00 53.72 ? 90 SER A OG 1 ATOM 696 N N . LEU A 1 92 ? 41.054 97.435 60.372 1.00 50.47 ? 91 LEU A N 1 ATOM 697 C CA . LEU A 1 92 ? 41.367 96.578 61.505 1.00 50.90 ? 91 LEU A CA 1 ATOM 698 C C . LEU A 1 92 ? 42.451 97.110 62.436 1.00 51.67 ? 91 LEU A C 1 ATOM 699 O O . LEU A 1 92 ? 42.594 96.615 63.556 1.00 49.79 ? 91 LEU A O 1 ATOM 700 C CB . LEU A 1 92 ? 41.575 95.109 61.106 1.00 51.44 ? 91 LEU A CB 1 ATOM 701 C CG . LEU A 1 92 ? 42.352 94.718 59.865 1.00 52.44 ? 91 LEU A CG 1 ATOM 702 C CD1 . LEU A 1 92 ? 43.822 94.996 60.105 1.00 54.87 ? 91 LEU A CD1 1 ATOM 703 C CD2 . LEU A 1 92 ? 42.111 93.248 59.565 1.00 51.30 ? 91 LEU A CD2 1 ATOM 704 N N . GLU A 1 93 ? 43.209 98.121 62.021 1.00 53.80 ? 92 GLU A N 1 ATOM 705 C CA . GLU A 1 93 ? 44.213 98.730 62.919 1.00 56.36 ? 92 GLU A CA 1 ATOM 706 C C . GLU A 1 93 ? 43.508 99.517 64.017 1.00 58.67 ? 92 GLU A C 1 ATOM 707 O O . GLU A 1 93 ? 43.853 99.427 65.187 1.00 58.12 ? 92 GLU A O 1 ATOM 708 C CB . GLU A 1 93 ? 45.148 99.664 62.151 1.00 58.23 ? 92 GLU A CB 1 ATOM 709 C CG . GLU A 1 93 ? 46.229 98.951 61.360 1.00 58.96 ? 92 GLU A CG 1 ATOM 710 C CD . GLU A 1 93 ? 47.156 99.918 60.659 1.00 60.62 ? 92 GLU A CD 1 ATOM 711 O OE1 . GLU A 1 93 ? 48.015 100.511 61.347 1.00 63.34 ? 92 GLU A OE1 1 ATOM 712 O OE2 . GLU A 1 93 ? 47.033 100.083 59.426 1.00 58.74 ? 92 GLU A OE2 1 ATOM 713 N N . PHE A 1 94 ? 42.504 100.284 63.606 1.00 60.58 ? 93 PHE A N 1 ATOM 714 C CA . PHE A 1 94 ? 41.731 101.130 64.495 1.00 60.02 ? 93 PHE A CA 1 ATOM 715 C C . PHE A 1 94 ? 40.244 100.886 64.227 1.00 58.75 ? 93 PHE A C 1 ATOM 716 O O . PHE A 1 94 ? 39.768 100.997 63.079 1.00 59.10 ? 93 PHE A O 1 ATOM 717 C CB . PHE A 1 94 ? 42.105 102.591 64.268 1.00 62.74 ? 93 PHE A CB 1 ATOM 718 C CG . PHE A 1 94 ? 43.428 102.981 64.876 1.00 64.93 ? 93 PHE A CG 1 ATOM 719 C CD1 . PHE A 1 94 ? 43.554 103.132 66.262 1.00 66.09 ? 93 PHE A CD1 1 ATOM 720 C CD2 . PHE A 1 94 ? 44.543 103.214 64.073 1.00 65.25 ? 93 PHE A CD2 1 ATOM 721 C CE1 . PHE A 1 94 ? 44.768 103.496 66.834 1.00 66.59 ? 93 PHE A CE1 1 ATOM 722 C CE2 . PHE A 1 94 ? 45.759 103.576 64.642 1.00 67.08 ? 93 PHE A CE2 1 ATOM 723 C CZ . PHE A 1 94 ? 45.872 103.715 66.025 1.00 67.12 ? 93 PHE A CZ 1 ATOM 724 N N . LEU A 1 95 ? 39.517 100.514 65.273 1.00 59.28 ? 94 LEU A N 1 ATOM 725 C CA . LEU A 1 95 ? 38.090 100.236 65.124 1.00 59.12 ? 94 LEU A CA 1 ATOM 726 C C . LEU A 1 95 ? 37.291 101.531 65.010 1.00 63.55 ? 94 LEU A C 1 ATOM 727 O O . LEU A 1 95 ? 36.261 101.596 64.331 1.00 62.22 ? 94 LEU A O 1 ATOM 728 C CB . LEU A 1 95 ? 37.580 99.414 66.298 1.00 58.23 ? 94 LEU A CB 1 ATOM 729 C CG . LEU A 1 95 ? 38.250 98.047 66.469 1.00 57.67 ? 94 LEU A CG 1 ATOM 730 C CD1 . LEU A 1 95 ? 37.735 97.346 67.721 1.00 56.26 ? 94 LEU A CD1 1 ATOM 731 C CD2 . LEU A 1 95 ? 38.023 97.193 65.230 1.00 57.62 ? 94 LEU A CD2 1 ATOM 732 N N . ASP A 1 96 ? 37.780 102.560 65.698 1.00 70.43 ? 95 ASP A N 1 ATOM 733 C CA . ASP A 1 96 ? 37.193 103.895 65.674 1.00 75.87 ? 95 ASP A CA 1 ATOM 734 C C . ASP A 1 96 ? 38.028 104.752 64.734 1.00 78.58 ? 95 ASP A C 1 ATOM 735 O O . ASP A 1 96 ? 39.215 104.962 64.988 1.00 80.68 ? 95 ASP A O 1 ATOM 736 C CB . ASP A 1 96 ? 37.204 104.503 67.091 1.00 78.64 ? 95 ASP A CB 1 ATOM 737 C CG . ASP A 1 96 ? 36.402 105.821 67.200 1.00 82.90 ? 95 ASP A CG 1 ATOM 738 O OD1 . ASP A 1 96 ? 36.353 106.596 66.219 1.00 83.14 ? 95 ASP A OD1 1 ATOM 739 O OD2 . ASP A 1 96 ? 35.827 106.087 68.290 1.00 85.27 ? 95 ASP A OD2 1 ATOM 740 N N . PRO A 1 97 ? 37.413 105.287 63.665 1.00 80.95 ? 96 PRO A N 1 ATOM 741 C CA . PRO A 1 97 ? 38.184 106.098 62.720 1.00 83.74 ? 96 PRO A CA 1 ATOM 742 C C . PRO A 1 97 ? 38.744 107.404 63.302 1.00 87.08 ? 96 PRO A C 1 ATOM 743 O O . PRO A 1 97 ? 39.606 108.012 62.683 1.00 89.94 ? 96 PRO A O 1 ATOM 744 C CB . PRO A 1 97 ? 37.192 106.369 61.582 1.00 84.45 ? 96 PRO A CB 1 ATOM 745 C CG . PRO A 1 97 ? 35.848 106.225 62.195 1.00 84.24 ? 96 PRO A CG 1 ATOM 746 C CD . PRO A 1 97 ? 35.986 105.216 63.298 1.00 82.28 ? 96 PRO A CD 1 ATOM 747 N N . SER A 1 98 ? 38.290 107.817 64.485 1.00 90.42 ? 97 SER A N 1 ATOM 748 C CA . SER A 1 98 ? 38.975 108.891 65.230 1.00 93.82 ? 97 SER A CA 1 ATOM 749 C C . SER A 1 98 ? 40.384 108.468 65.682 1.00 96.36 ? 97 SER A C 1 ATOM 750 O O . SER A 1 98 ? 41.181 109.310 66.090 1.00 95.15 ? 97 SER A O 1 ATOM 751 C CB . SER A 1 98 ? 38.149 109.335 66.442 1.00 93.44 ? 97 SER A CB 1 ATOM 752 O OG . SER A 1 98 ? 38.281 108.426 67.521 1.00 92.76 ? 97 SER A OG 1 ATOM 753 N N . LYS A 1 99 ? 40.669 107.165 65.627 1.00 98.85 ? 98 LYS A N 1 ATOM 754 C CA . LYS A 1 99 ? 41.975 106.572 65.942 1.00 98.16 ? 98 LYS A CA 1 ATOM 755 C C . LYS A 1 99 ? 42.284 106.634 67.422 1.00 97.48 ? 98 LYS A C 1 ATOM 756 O O . LYS A 1 99 ? 43.443 106.610 67.836 1.00 94.18 ? 98 LYS A O 1 ATOM 757 C CB . LYS A 1 99 ? 43.110 107.181 65.097 1.00 99.81 ? 98 LYS A CB 1 ATOM 758 C CG . LYS A 1 99 ? 43.007 106.834 63.619 1.00 100.21 ? 98 LYS A CG 1 ATOM 759 C CD . LYS A 1 99 ? 44.243 107.253 62.844 1.00 101.57 ? 98 LYS A CD 1 ATOM 760 C CE . LYS A 1 99 ? 44.090 106.931 61.366 1.00 101.86 ? 98 LYS A CE 1 ATOM 761 N NZ . LYS A 1 99 ? 45.234 107.443 60.564 1.00 103.65 ? 98 LYS A NZ 1 ATOM 762 N N . SER A 1 100 ? 41.223 106.686 68.217 1.00 98.20 ? 99 SER A N 1 ATOM 763 C CA . SER A 1 100 ? 41.363 106.634 69.665 1.00 100.95 ? 99 SER A CA 1 ATOM 764 C C . SER A 1 100 ? 41.967 105.299 70.129 1.00 100.30 ? 99 SER A C 1 ATOM 765 O O . SER A 1 100 ? 41.742 104.236 69.521 1.00 100.13 ? 99 SER A O 1 ATOM 766 C CB . SER A 1 100 ? 40.010 106.880 70.356 1.00 103.31 ? 99 SER A CB 1 ATOM 767 O OG . SER A 1 100 ? 39.103 105.803 70.160 1.00 103.27 ? 99 SER A OG 1 ATOM 768 N N . SER A 1 101 ? 42.711 105.352 71.232 1.00 100.12 ? 100 SER A N 1 ATOM 769 C CA . SER A 1 101 ? 43.383 104.163 71.768 1.00 97.26 ? 100 SER A CA 1 ATOM 770 C C . SER A 1 101 ? 42.389 103.065 72.181 1.00 93.89 ? 100 SER A C 1 ATOM 771 O O . SER A 1 101 ? 42.724 101.884 72.140 1.00 88.21 ? 100 SER A O 1 ATOM 772 C CB . SER A 1 101 ? 44.290 104.540 72.945 1.00 98.05 ? 100 SER A CB 1 ATOM 773 O OG . SER A 1 101 ? 43.545 105.140 73.991 1.00 101.84 ? 100 SER A OG 1 ATOM 774 N N . VAL A 1 102 ? 41.167 103.472 72.540 1.00 94.92 ? 101 VAL A N 1 ATOM 775 C CA . VAL A 1 102 ? 40.088 102.536 72.883 1.00 94.43 ? 101 VAL A CA 1 ATOM 776 C C . VAL A 1 102 ? 39.843 101.531 71.740 1.00 90.01 ? 101 VAL A C 1 ATOM 777 O O . VAL A 1 102 ? 39.513 100.376 71.987 1.00 91.36 ? 101 VAL A O 1 ATOM 778 C CB . VAL A 1 102 ? 38.766 103.266 73.232 1.00 96.51 ? 101 VAL A CB 1 ATOM 779 C CG1 . VAL A 1 102 ? 37.700 102.263 73.686 1.00 95.63 ? 101 VAL A CG1 1 ATOM 780 C CG2 . VAL A 1 102 ? 39.006 104.333 74.298 1.00 98.22 ? 101 VAL A CG2 1 ATOM 781 N N . GLY A 1 103 ? 40.034 101.956 70.494 1.00 84.05 ? 102 GLY A N 1 ATOM 782 C CA . GLY A 1 103 ? 39.801 101.072 69.360 1.00 79.23 ? 102 GLY A CA 1 ATOM 783 C C . GLY A 1 103 ? 41.066 100.513 68.726 1.00 73.83 ? 102 GLY A C 1 ATOM 784 O O . GLY A 1 103 ? 40.995 99.931 67.641 1.00 71.36 ? 102 GLY A O 1 ATOM 785 N N . SER A 1 104 ? 42.222 100.674 69.364 1.00 70.45 ? 103 SER A N 1 ATOM 786 C CA . SER A 1 104 ? 43.450 100.177 68.767 1.00 67.22 ? 103 SER A CA 1 ATOM 787 C C . SER A 1 104 ? 43.478 98.658 68.857 1.00 62.75 ? 103 SER A C 1 ATOM 788 O O . SER A 1 104 ? 43.459 98.095 69.938 1.00 62.15 ? 103 SER A O 1 ATOM 789 C CB . SER A 1 104 ? 44.679 100.770 69.449 1.00 69.20 ? 103 SER A CB 1 ATOM 790 O OG . SER A 1 104 ? 45.865 100.376 68.782 1.00 69.64 ? 103 SER A OG 1 ATOM 791 N N . TYR A 1 105 ? 43.549 97.993 67.713 1.00 59.01 ? 104 TYR A N 1 ATOM 792 C CA . TYR A 1 105 ? 43.373 96.547 67.655 1.00 54.55 ? 104 TYR A CA 1 ATOM 793 C C . TYR A 1 105 ? 44.589 95.911 66.961 1.00 55.44 ? 104 TYR A C 1 ATOM 794 O O . TYR A 1 105 ? 45.482 95.429 67.643 1.00 56.46 ? 104 TYR A O 1 ATOM 795 C CB . TYR A 1 105 ? 42.028 96.230 66.989 1.00 52.14 ? 104 TYR A CB 1 ATOM 796 C CG . TYR A 1 105 ? 41.644 94.767 66.905 1.00 49.74 ? 104 TYR A CG 1 ATOM 797 C CD1 . TYR A 1 105 ? 41.694 93.930 68.018 1.00 48.40 ? 104 TYR A CD1 1 ATOM 798 C CD2 . TYR A 1 105 ? 41.182 94.230 65.706 1.00 49.30 ? 104 TYR A CD2 1 ATOM 799 C CE1 . TYR A 1 105 ? 41.323 92.592 67.929 1.00 48.22 ? 104 TYR A CE1 1 ATOM 800 C CE2 . TYR A 1 105 ? 40.820 92.896 65.605 1.00 48.16 ? 104 TYR A CE2 1 ATOM 801 C CZ . TYR A 1 105 ? 40.893 92.080 66.712 1.00 47.71 ? 104 TYR A CZ 1 ATOM 802 O OH . TYR A 1 105 ? 40.527 90.763 66.592 1.00 45.83 ? 104 TYR A OH 1 ATOM 803 N N . PHE A 1 106 ? 44.665 95.939 65.631 1.00 54.33 ? 105 PHE A N 1 ATOM 804 C CA . PHE A 1 106 ? 45.860 95.439 64.928 1.00 53.73 ? 105 PHE A CA 1 ATOM 805 C C . PHE A 1 106 ? 46.960 96.497 64.763 1.00 54.67 ? 105 PHE A C 1 ATOM 806 O O . PHE A 1 106 ? 48.020 96.204 64.180 1.00 55.27 ? 105 PHE A O 1 ATOM 807 C CB . PHE A 1 106 ? 45.494 94.866 63.545 1.00 53.63 ? 105 PHE A CB 1 ATOM 808 C CG . PHE A 1 106 ? 45.125 93.406 63.564 1.00 52.76 ? 105 PHE A CG 1 ATOM 809 C CD1 . PHE A 1 106 ? 46.104 92.428 63.484 1.00 53.75 ? 105 PHE A CD1 1 ATOM 810 C CD2 . PHE A 1 106 ? 43.807 93.010 63.651 1.00 53.06 ? 105 PHE A CD2 1 ATOM 811 C CE1 . PHE A 1 106 ? 45.777 91.083 63.500 1.00 53.39 ? 105 PHE A CE1 1 ATOM 812 C CE2 . PHE A 1 106 ? 43.468 91.664 63.671 1.00 53.60 ? 105 PHE A CE2 1 ATOM 813 C CZ . PHE A 1 106 ? 44.455 90.697 63.595 1.00 53.08 ? 105 PHE A CZ 1 ATOM 814 N N . HIS A 1 107 ? 46.737 97.719 65.250 1.00 54.22 ? 106 HIS A N 1 ATOM 815 C CA . HIS A 1 107 ? 47.691 98.800 64.992 1.00 56.37 ? 106 HIS A CA 1 ATOM 816 C C . HIS A 1 107 ? 49.128 98.523 65.421 1.00 57.81 ? 106 HIS A C 1 ATOM 817 O O . HIS A 1 107 ? 50.059 98.758 64.661 1.00 59.78 ? 106 HIS A O 1 ATOM 818 C CB . HIS A 1 107 ? 47.224 100.109 65.642 1.00 57.37 ? 106 HIS A CB 1 ATOM 819 C CG . HIS A 1 107 ? 48.155 101.259 65.411 1.00 59.95 ? 106 HIS A CG 1 ATOM 820 N ND1 . HIS A 1 107 ? 48.461 101.726 64.149 1.00 61.73 ? 106 HIS A ND1 1 ATOM 821 C CD2 . HIS A 1 107 ? 48.858 102.027 66.278 1.00 61.84 ? 106 HIS A CD2 1 ATOM 822 C CE1 . HIS A 1 107 ? 49.309 102.735 64.249 1.00 63.55 ? 106 HIS A CE1 1 ATOM 823 N NE2 . HIS A 1 107 ? 49.562 102.941 65.531 1.00 64.44 ? 106 HIS A NE2 1 ATOM 824 N N . THR A 1 108 ? 49.322 97.989 66.623 1.00 57.45 ? 107 THR A N 1 ATOM 825 C CA . THR A 1 108 ? 50.667 97.758 67.121 1.00 58.47 ? 107 THR A CA 1 ATOM 826 C C . THR A 1 108 ? 51.379 96.725 66.243 1.00 58.05 ? 107 THR A C 1 ATOM 827 O O . THR A 1 108 ? 52.544 96.879 65.938 1.00 58.42 ? 107 THR A O 1 ATOM 828 C CB . THR A 1 108 ? 50.651 97.277 68.588 1.00 59.21 ? 107 THR A CB 1 ATOM 829 O OG1 . THR A 1 108 ? 49.794 98.120 69.362 1.00 59.34 ? 107 THR A OG1 1 ATOM 830 C CG2 . THR A 1 108 ? 52.042 97.305 69.193 1.00 60.41 ? 107 THR A CG2 1 ATOM 831 N N . MET A 1 109 ? 50.654 95.672 65.867 1.00 56.15 ? 108 MET A N 1 ATOM 832 C CA . MET A 1 109 ? 51.228 94.633 65.011 1.00 57.48 ? 108 MET A CA 1 ATOM 833 C C . MET A 1 109 ? 51.614 95.157 63.613 1.00 57.91 ? 108 MET A C 1 ATOM 834 O O . MET A 1 109 ? 52.706 94.864 63.111 1.00 57.74 ? 108 MET A O 1 ATOM 835 C CB . MET A 1 109 ? 50.258 93.457 64.864 1.00 56.68 ? 108 MET A CB 1 ATOM 836 C CG . MET A 1 109 ? 50.840 92.299 64.068 1.00 57.58 ? 108 MET A CG 1 ATOM 837 S SD . MET A 1 109 ? 49.728 90.894 63.898 1.00 58.01 ? 108 MET A SD 1 ATOM 838 C CE . MET A 1 109 ? 49.806 90.196 65.545 1.00 58.63 ? 108 MET A CE 1 ATOM 839 N N . VAL A 1 110 ? 50.734 95.965 63.018 1.00 57.19 ? 109 VAL A N 1 ATOM 840 C CA . VAL A 1 110 ? 51.024 96.531 61.713 1.00 57.73 ? 109 VAL A CA 1 ATOM 841 C C . VAL A 1 110 ? 52.211 97.508 61.784 1.00 60.40 ? 109 VAL A C 1 ATOM 842 O O . VAL A 1 110 ? 53.057 97.517 60.880 1.00 61.61 ? 109 VAL A O 1 ATOM 843 C CB . VAL A 1 110 ? 49.789 97.214 61.094 1.00 56.58 ? 109 VAL A CB 1 ATOM 844 C CG1 . VAL A 1 110 ? 50.155 97.925 59.794 1.00 57.24 ? 109 VAL A CG1 1 ATOM 845 C CG2 . VAL A 1 110 ? 48.701 96.187 60.830 1.00 55.27 ? 109 VAL A CG2 1 ATOM 846 N N . GLU A 1 111 ? 52.277 98.332 62.826 1.00 61.54 ? 110 GLU A N 1 ATOM 847 C CA . GLU A 1 111 ? 53.438 99.192 63.021 1.00 64.59 ? 110 GLU A CA 1 ATOM 848 C C . GLU A 1 111 ? 54.731 98.384 63.021 1.00 64.97 ? 110 GLU A C 1 ATOM 849 O O . GLU A 1 111 ? 55.718 98.805 62.414 1.00 65.21 ? 110 GLU A O 1 ATOM 850 C CB . GLU A 1 111 ? 53.319 99.998 64.325 1.00 66.82 ? 110 GLU A CB 1 ATOM 851 C CG . GLU A 1 111 ? 52.348 101.165 64.235 1.00 68.23 ? 110 GLU A CG 1 ATOM 852 C CD . GLU A 1 111 ? 52.872 102.295 63.364 1.00 72.46 ? 110 GLU A CD 1 ATOM 853 O OE1 . GLU A 1 111 ? 53.881 102.925 63.746 1.00 77.16 ? 110 GLU A OE1 1 ATOM 854 O OE2 . GLU A 1 111 ? 52.276 102.565 62.299 1.00 73.36 ? 110 GLU A OE2 1 ATOM 855 N N . SER A 1 112 ? 54.729 97.266 63.730 1.00 64.98 ? 111 SER A N 1 ATOM 856 C CA . SER A 1 112 ? 55.916 96.388 63.745 1.00 66.20 ? 111 SER A CA 1 ATOM 857 C C . SER A 1 112 ? 56.251 95.837 62.368 1.00 65.31 ? 111 SER A C 1 ATOM 858 O O . SER A 1 112 ? 57.437 95.859 61.950 1.00 65.12 ? 111 SER A O 1 ATOM 859 C CB . SER A 1 112 ? 55.737 95.252 64.751 1.00 66.56 ? 111 SER A CB 1 ATOM 860 O OG . SER A 1 112 ? 55.673 95.772 66.069 1.00 69.10 ? 111 SER A OG 1 ATOM 861 N N . LEU A 1 113 ? 55.230 95.332 61.674 1.00 63.88 ? 112 LEU A N 1 ATOM 862 C CA . LEU A 1 113 ? 55.421 94.800 60.317 1.00 64.62 ? 112 LEU A CA 1 ATOM 863 C C . LEU A 1 113 ? 56.038 95.849 59.377 1.00 64.31 ? 112 LEU A C 1 ATOM 864 O O . LEU A 1 113 ? 56.992 95.557 58.648 1.00 64.06 ? 112 LEU A O 1 ATOM 865 C CB . LEU A 1 113 ? 54.102 94.279 59.739 1.00 64.10 ? 112 LEU A CB 1 ATOM 866 C CG . LEU A 1 113 ? 53.521 93.023 60.408 1.00 64.01 ? 112 LEU A CG 1 ATOM 867 C CD1 . LEU A 1 113 ? 52.139 92.710 59.863 1.00 62.25 ? 112 LEU A CD1 1 ATOM 868 C CD2 . LEU A 1 113 ? 54.440 91.828 60.231 1.00 65.58 ? 112 LEU A CD2 1 ATOM 869 N N . VAL A 1 114 ? 55.508 97.070 59.440 1.00 62.49 ? 113 VAL A N 1 ATOM 870 C CA . VAL A 1 114 ? 56.020 98.156 58.612 1.00 63.15 ? 113 VAL A CA 1 ATOM 871 C C . VAL A 1 114 ? 57.479 98.471 58.974 1.00 65.43 ? 113 VAL A C 1 ATOM 872 O O . VAL A 1 114 ? 58.307 98.701 58.101 1.00 67.72 ? 113 VAL A O 1 ATOM 873 C CB . VAL A 1 114 ? 55.124 99.414 58.659 1.00 62.64 ? 113 VAL A CB 1 ATOM 874 C CG1 . VAL A 1 114 ? 55.803 100.601 57.982 1.00 62.30 ? 113 VAL A CG1 1 ATOM 875 C CG2 . VAL A 1 114 ? 53.781 99.124 57.999 1.00 60.99 ? 113 VAL A CG2 1 ATOM 876 N N . GLY A 1 115 ? 57.797 98.485 60.263 1.00 66.79 ? 114 GLY A N 1 ATOM 877 C CA . GLY A 1 115 ? 59.169 98.646 60.717 1.00 68.65 ? 114 GLY A CA 1 ATOM 878 C C . GLY A 1 115 ? 60.104 97.572 60.184 1.00 69.83 ? 114 GLY A C 1 ATOM 879 O O . GLY A 1 115 ? 61.291 97.832 59.998 1.00 73.08 ? 114 GLY A O 1 ATOM 880 N N . TRP A 1 116 ? 59.572 96.368 59.938 1.00 68.63 ? 115 TRP A N 1 ATOM 881 C CA . TRP A 1 116 ? 60.348 95.271 59.364 1.00 69.01 ? 115 TRP A CA 1 ATOM 882 C C . TRP A 1 116 ? 60.405 95.298 57.833 1.00 68.98 ? 115 TRP A C 1 ATOM 883 O O . TRP A 1 116 ? 61.031 94.429 57.223 1.00 68.54 ? 115 TRP A O 1 ATOM 884 C CB . TRP A 1 116 ? 59.829 93.908 59.835 1.00 68.46 ? 115 TRP A CB 1 ATOM 885 C CG . TRP A 1 116 ? 59.743 93.768 61.312 1.00 69.08 ? 115 TRP A CG 1 ATOM 886 C CD1 . TRP A 1 116 ? 60.493 94.421 62.250 1.00 70.98 ? 115 TRP A CD1 1 ATOM 887 C CD2 . TRP A 1 116 ? 58.860 92.906 62.033 1.00 68.83 ? 115 TRP A CD2 1 ATOM 888 N NE1 . TRP A 1 116 ? 60.116 94.028 63.514 1.00 71.43 ? 115 TRP A NE1 1 ATOM 889 C CE2 . TRP A 1 116 ? 59.117 93.094 63.407 1.00 69.67 ? 115 TRP A CE2 1 ATOM 890 C CE3 . TRP A 1 116 ? 57.868 91.996 61.651 1.00 68.04 ? 115 TRP A CE3 1 ATOM 891 C CZ2 . TRP A 1 116 ? 58.419 92.403 64.399 1.00 69.10 ? 115 TRP A CZ2 1 ATOM 892 C CZ3 . TRP A 1 116 ? 57.173 91.312 62.637 1.00 67.21 ? 115 TRP A CZ3 1 ATOM 893 C CH2 . TRP A 1 116 ? 57.450 91.521 63.994 1.00 67.66 ? 115 TRP A CH2 1 ATOM 894 N N . GLY A 1 117 ? 59.741 96.271 57.211 1.00 68.19 ? 116 GLY A N 1 ATOM 895 C CA . GLY A 1 117 ? 59.816 96.452 55.766 1.00 66.93 ? 116 GLY A CA 1 ATOM 896 C C . GLY A 1 117 ? 58.552 96.164 54.975 1.00 65.18 ? 116 GLY A C 1 ATOM 897 O O . GLY A 1 117 ? 58.585 96.209 53.735 1.00 66.86 ? 116 GLY A O 1 ATOM 898 N N . TYR A 1 118 ? 57.435 95.889 55.656 1.00 62.09 ? 117 TYR A N 1 ATOM 899 C CA . TYR A 1 118 ? 56.148 95.685 54.982 1.00 59.04 ? 117 TYR A CA 1 ATOM 900 C C . TYR A 1 118 ? 55.533 97.028 54.607 1.00 58.07 ? 117 TYR A C 1 ATOM 901 O O . TYR A 1 118 ? 55.920 98.071 55.140 1.00 58.70 ? 117 TYR A O 1 ATOM 902 C CB . TYR A 1 118 ? 55.193 94.854 55.839 1.00 57.92 ? 117 TYR A CB 1 ATOM 903 C CG . TYR A 1 118 ? 55.528 93.379 55.878 1.00 57.31 ? 117 TYR A CG 1 ATOM 904 C CD1 . TYR A 1 118 ? 56.483 92.880 56.752 1.00 58.76 ? 117 TYR A CD1 1 ATOM 905 C CD2 . TYR A 1 118 ? 54.876 92.484 55.049 1.00 57.54 ? 117 TYR A CD2 1 ATOM 906 C CE1 . TYR A 1 118 ? 56.784 91.529 56.800 1.00 59.60 ? 117 TYR A CE1 1 ATOM 907 C CE2 . TYR A 1 118 ? 55.172 91.130 55.080 1.00 58.45 ? 117 TYR A CE2 1 ATOM 908 C CZ . TYR A 1 118 ? 56.126 90.653 55.959 1.00 59.35 ? 117 TYR A CZ 1 ATOM 909 O OH . TYR A 1 118 ? 56.421 89.306 56.003 1.00 58.00 ? 117 TYR A OH 1 ATOM 910 N N . THR A 1 119 ? 54.592 96.976 53.672 1.00 57.29 ? 118 THR A N 1 ATOM 911 C CA . THR A 1 119 ? 53.881 98.152 53.156 1.00 57.17 ? 118 THR A CA 1 ATOM 912 C C . THR A 1 119 ? 52.375 97.916 53.198 1.00 56.64 ? 118 THR A C 1 ATOM 913 O O . THR A 1 119 ? 51.886 96.942 52.608 1.00 56.63 ? 118 THR A O 1 ATOM 914 C CB . THR A 1 119 ? 54.310 98.455 51.708 1.00 57.78 ? 118 THR A CB 1 ATOM 915 O OG1 . THR A 1 119 ? 55.734 98.601 51.658 1.00 58.73 ? 118 THR A OG1 1 ATOM 916 C CG2 . THR A 1 119 ? 53.643 99.724 51.190 1.00 57.49 ? 118 THR A CG2 1 ATOM 917 N N . ARG A 1 120 ? 51.660 98.782 53.910 1.00 57.51 ? 119 ARG A N 1 ATOM 918 C CA . ARG A 1 120 ? 50.200 98.690 54.043 1.00 57.14 ? 119 ARG A CA 1 ATOM 919 C C . ARG A 1 120 ? 49.528 98.583 52.688 1.00 58.58 ? 119 ARG A C 1 ATOM 920 O O . ARG A 1 120 ? 49.783 99.422 51.822 1.00 60.34 ? 119 ARG A O 1 ATOM 921 C CB . ARG A 1 120 ? 49.645 99.916 54.771 1.00 58.24 ? 119 ARG A CB 1 ATOM 922 C CG . ARG A 1 120 ? 49.980 99.997 56.250 1.00 58.57 ? 119 ARG A CG 1 ATOM 923 C CD . ARG A 1 120 ? 49.453 101.294 56.856 1.00 59.53 ? 119 ARG A CD 1 ATOM 924 N NE . ARG A 1 120 ? 49.465 101.258 58.316 1.00 60.16 ? 119 ARG A NE 1 ATOM 925 C CZ . ARG A 1 120 ? 50.525 101.517 59.079 1.00 61.98 ? 119 ARG A CZ 1 ATOM 926 N NH1 . ARG A 1 120 ? 51.688 101.862 58.541 1.00 63.91 ? 119 ARG A NH1 1 ATOM 927 N NH2 . ARG A 1 120 ? 50.421 101.434 60.400 1.00 62.09 ? 119 ARG A NH2 1 ATOM 928 N N . GLY A 1 121 ? 48.652 97.587 52.507 1.00 57.42 ? 120 GLY A N 1 ATOM 929 C CA . GLY A 1 121 ? 47.876 97.514 51.291 1.00 56.03 ? 120 GLY A CA 1 ATOM 930 C C . GLY A 1 121 ? 48.586 96.833 50.143 1.00 56.47 ? 120 GLY A C 1 ATOM 931 O O . GLY A 1 121 ? 48.020 96.635 49.074 1.00 55.66 ? 120 GLY A O 1 ATOM 932 N N . GLU A 1 122 ? 49.860 96.490 50.352 1.00 56.22 ? 121 GLU A N 1 ATOM 933 C CA . GLU A 1 122 ? 50.664 95.772 49.378 1.00 56.07 ? 121 GLU A CA 1 ATOM 934 C C . GLU A 1 122 ? 50.970 94.386 49.942 1.00 56.09 ? 121 GLU A C 1 ATOM 935 O O . GLU A 1 122 ? 50.168 93.473 49.758 1.00 55.44 ? 121 GLU A O 1 ATOM 936 C CB . GLU A 1 122 ? 51.927 96.554 49.016 1.00 56.88 ? 121 GLU A CB 1 ATOM 937 C CG . GLU A 1 122 ? 51.623 97.867 48.312 1.00 57.77 ? 121 GLU A CG 1 ATOM 938 C CD . GLU A 1 122 ? 52.864 98.590 47.835 1.00 60.22 ? 121 GLU A CD 1 ATOM 939 O OE1 . GLU A 1 122 ? 53.965 97.986 47.851 1.00 62.87 ? 121 GLU A OE1 1 ATOM 940 O OE2 . GLU A 1 122 ? 52.740 99.767 47.427 1.00 60.65 ? 121 GLU A OE2 1 ATOM 941 N N . ASP A 1 123 ? 52.096 94.220 50.626 1.00 56.05 ? 122 ASP A N 1 ATOM 942 C CA . ASP A 1 123 ? 52.477 92.882 51.096 1.00 55.72 ? 122 ASP A CA 1 ATOM 943 C C . ASP A 1 123 ? 51.974 92.561 52.518 1.00 54.51 ? 122 ASP A C 1 ATOM 944 O O . ASP A 1 123 ? 52.222 91.462 53.034 1.00 53.65 ? 122 ASP A O 1 ATOM 945 C CB . ASP A 1 123 ? 53.990 92.617 50.940 1.00 57.91 ? 122 ASP A CB 1 ATOM 946 C CG . ASP A 1 123 ? 54.865 93.644 51.630 1.00 58.84 ? 122 ASP A CG 1 ATOM 947 O OD1 . ASP A 1 123 ? 54.337 94.646 52.155 1.00 58.80 ? 122 ASP A OD1 1 ATOM 948 O OD2 . ASP A 1 123 ? 56.100 93.441 51.631 1.00 60.23 ? 122 ASP A OD2 1 ATOM 949 N N . VAL A 1 124 ? 51.299 93.523 53.145 1.00 53.48 ? 123 VAL A N 1 ATOM 950 C CA . VAL A 1 124 ? 50.468 93.232 54.307 1.00 51.62 ? 123 VAL A CA 1 ATOM 951 C C . VAL A 1 124 ? 49.077 93.774 54.022 1.00 50.29 ? 123 VAL A C 1 ATOM 952 O O . VAL A 1 124 ? 48.915 94.950 53.702 1.00 50.73 ? 123 VAL A O 1 ATOM 953 C CB . VAL A 1 124 ? 51.049 93.782 55.635 1.00 51.32 ? 123 VAL A CB 1 ATOM 954 C CG1 . VAL A 1 124 ? 51.225 95.296 55.607 1.00 51.23 ? 123 VAL A CG1 1 ATOM 955 C CG2 . VAL A 1 124 ? 50.162 93.363 56.799 1.00 50.17 ? 123 VAL A CG2 1 ATOM 956 N N . ARG A 1 125 ? 48.085 92.894 54.085 1.00 49.24 ? 124 ARG A N 1 ATOM 957 C CA . ARG A 1 125 ? 46.706 93.283 53.823 1.00 49.28 ? 124 ARG A CA 1 ATOM 958 C C . ARG A 1 125 ? 45.755 92.704 54.849 1.00 48.76 ? 124 ARG A C 1 ATOM 959 O O . ARG A 1 125 ? 45.980 91.611 55.380 1.00 47.85 ? 124 ARG A O 1 ATOM 960 C CB . ARG A 1 125 ? 46.281 92.833 52.434 1.00 50.38 ? 124 ARG A CB 1 ATOM 961 C CG . ARG A 1 125 ? 47.159 93.386 51.325 1.00 53.01 ? 124 ARG A CG 1 ATOM 962 C CD . ARG A 1 125 ? 46.544 93.160 49.953 1.00 54.20 ? 124 ARG A CD 1 ATOM 963 N NE . ARG A 1 125 ? 47.530 93.339 48.890 1.00 56.14 ? 124 ARG A NE 1 ATOM 964 C CZ . ARG A 1 125 ? 47.256 93.307 47.591 1.00 56.33 ? 124 ARG A CZ 1 ATOM 965 N NH1 . ARG A 1 125 ? 46.012 93.119 47.162 1.00 55.96 ? 124 ARG A NH1 1 ATOM 966 N NH2 . ARG A 1 125 ? 48.237 93.464 46.718 1.00 58.16 ? 124 ARG A NH2 1 ATOM 967 N N . GLY A 1 126 ? 44.689 93.442 55.123 1.00 48.63 ? 125 GLY A N 1 ATOM 968 C CA . GLY A 1 126 ? 43.619 92.940 55.968 1.00 47.17 ? 125 GLY A CA 1 ATOM 969 C C . GLY A 1 126 ? 42.526 92.243 55.185 1.00 47.31 ? 125 GLY A C 1 ATOM 970 O O . GLY A 1 126 ? 42.247 92.575 54.013 1.00 48.01 ? 125 GLY A O 1 ATOM 971 N N . ALA A 1 127 ? 41.897 91.275 55.852 1.00 45.66 ? 126 ALA A N 1 ATOM 972 C CA . ALA A 1 127 ? 40.740 90.581 55.320 1.00 44.78 ? 126 ALA A CA 1 ATOM 973 C C . ALA A 1 127 ? 39.560 90.750 56.287 1.00 43.70 ? 126 ALA A C 1 ATOM 974 O O . ALA A 1 127 ? 39.098 89.783 56.892 1.00 44.18 ? 126 ALA A O 1 ATOM 975 C CB . ALA A 1 127 ? 41.056 89.111 55.106 1.00 45.09 ? 126 ALA A CB 1 ATOM 976 N N . PRO A 1 128 ? 39.070 91.992 56.438 1.00 43.97 ? 127 PRO A N 1 ATOM 977 C CA . PRO A 1 128 ? 37.886 92.236 57.270 1.00 43.47 ? 127 PRO A CA 1 ATOM 978 C C . PRO A 1 128 ? 36.611 91.619 56.683 1.00 43.79 ? 127 PRO A C 1 ATOM 979 O O . PRO A 1 128 ? 36.506 91.404 55.467 1.00 44.73 ? 127 PRO A O 1 ATOM 980 C CB . PRO A 1 128 ? 37.777 93.758 57.260 1.00 43.74 ? 127 PRO A CB 1 ATOM 981 C CG . PRO A 1 128 ? 38.321 94.135 55.923 1.00 44.36 ? 127 PRO A CG 1 ATOM 982 C CD . PRO A 1 128 ? 39.502 93.227 55.756 1.00 44.57 ? 127 PRO A CD 1 ATOM 983 N N . TYR A 1 129 ? 35.638 91.371 57.549 1.00 43.58 ? 128 TYR A N 1 ATOM 984 C CA . TYR A 1 129 ? 34.385 90.759 57.151 1.00 43.82 ? 128 TYR A CA 1 ATOM 985 C C . TYR A 1 129 ? 33.272 91.202 58.087 1.00 43.52 ? 128 TYR A C 1 ATOM 986 O O . TYR A 1 129 ? 33.511 91.828 59.127 1.00 43.10 ? 128 TYR A O 1 ATOM 987 C CB . TYR A 1 129 ? 34.516 89.239 57.172 1.00 43.50 ? 128 TYR A CB 1 ATOM 988 C CG . TYR A 1 129 ? 34.975 88.666 58.500 1.00 43.26 ? 128 TYR A CG 1 ATOM 989 C CD1 . TYR A 1 129 ? 36.323 88.638 58.839 1.00 43.86 ? 128 TYR A CD1 1 ATOM 990 C CD2 . TYR A 1 129 ? 34.060 88.130 59.408 1.00 42.70 ? 128 TYR A CD2 1 ATOM 991 C CE1 . TYR A 1 129 ? 36.746 88.100 60.048 1.00 43.75 ? 128 TYR A CE1 1 ATOM 992 C CE2 . TYR A 1 129 ? 34.471 87.591 60.616 1.00 42.33 ? 128 TYR A CE2 1 ATOM 993 C CZ . TYR A 1 129 ? 35.816 87.578 60.933 1.00 42.84 ? 128 TYR A CZ 1 ATOM 994 O OH . TYR A 1 129 ? 36.229 87.053 62.133 1.00 41.66 ? 128 TYR A OH 1 ATOM 995 N N . ASP A 1 130 ? 32.044 90.870 57.718 1.00 44.33 ? 129 ASP A N 1 ATOM 996 C CA . ASP A 1 130 ? 30.893 91.152 58.556 1.00 45.55 ? 129 ASP A CA 1 ATOM 997 C C . ASP A 1 130 ? 30.848 90.095 59.663 1.00 44.85 ? 129 ASP A C 1 ATOM 998 O O . ASP A 1 130 ? 30.306 89.007 59.482 1.00 46.09 ? 129 ASP A O 1 ATOM 999 C CB . ASP A 1 130 ? 29.605 91.155 57.730 1.00 46.19 ? 129 ASP A CB 1 ATOM 1000 C CG . ASP A 1 130 ? 28.395 91.627 58.528 1.00 46.96 ? 129 ASP A CG 1 ATOM 1001 O OD1 . ASP A 1 130 ? 28.471 91.694 59.774 1.00 47.10 ? 129 ASP A OD1 1 ATOM 1002 O OD2 . ASP A 1 130 ? 27.352 91.922 57.910 1.00 47.81 ? 129 ASP A OD2 1 ATOM 1003 N N . TRP A 1 131 ? 31.445 90.443 60.798 1.00 43.46 ? 130 TRP A N 1 ATOM 1004 C CA . TRP A 1 131 ? 31.656 89.510 61.912 1.00 43.12 ? 130 TRP A CA 1 ATOM 1005 C C . TRP A 1 131 ? 30.372 89.163 62.688 1.00 43.69 ? 130 TRP A C 1 ATOM 1006 O O . TRP A 1 131 ? 30.397 88.341 63.600 1.00 42.09 ? 130 TRP A O 1 ATOM 1007 C CB . TRP A 1 131 ? 32.731 90.053 62.884 1.00 42.57 ? 130 TRP A CB 1 ATOM 1008 C CG . TRP A 1 131 ? 32.733 91.542 63.025 1.00 42.72 ? 130 TRP A CG 1 ATOM 1009 C CD1 . TRP A 1 131 ? 33.593 92.424 62.430 1.00 42.75 ? 130 TRP A CD1 1 ATOM 1010 C CD2 . TRP A 1 131 ? 31.807 92.330 63.781 1.00 43.32 ? 130 TRP A CD2 1 ATOM 1011 N NE1 . TRP A 1 131 ? 33.266 93.711 62.783 1.00 43.36 ? 130 TRP A NE1 1 ATOM 1012 C CE2 . TRP A 1 131 ? 32.174 93.681 63.611 1.00 43.56 ? 130 TRP A CE2 1 ATOM 1013 C CE3 . TRP A 1 131 ? 30.707 92.024 64.596 1.00 43.30 ? 130 TRP A CE3 1 ATOM 1014 C CZ2 . TRP A 1 131 ? 31.480 94.723 64.222 1.00 44.07 ? 130 TRP A CZ2 1 ATOM 1015 C CZ3 . TRP A 1 131 ? 30.020 93.061 65.203 1.00 42.46 ? 130 TRP A CZ3 1 ATOM 1016 C CH2 . TRP A 1 131 ? 30.409 94.393 65.011 1.00 43.79 ? 130 TRP A CH2 1 ATOM 1017 N N . ARG A 1 132 ? 29.252 89.784 62.334 1.00 44.97 ? 131 ARG A N 1 ATOM 1018 C CA . ARG A 1 132 ? 27.957 89.415 62.896 1.00 45.26 ? 131 ARG A CA 1 ATOM 1019 C C . ARG A 1 132 ? 27.469 88.080 62.324 1.00 45.34 ? 131 ARG A C 1 ATOM 1020 O O . ARG A 1 132 ? 26.643 87.403 62.929 1.00 46.62 ? 131 ARG A O 1 ATOM 1021 C CB . ARG A 1 132 ? 26.936 90.504 62.581 1.00 46.30 ? 131 ARG A CB 1 ATOM 1022 C CG . ARG A 1 132 ? 27.306 91.883 63.120 1.00 45.95 ? 131 ARG A CG 1 ATOM 1023 C CD . ARG A 1 132 ? 26.338 92.947 62.634 1.00 46.38 ? 131 ARG A CD 1 ATOM 1024 N NE . ARG A 1 132 ? 26.287 92.990 61.183 1.00 47.14 ? 131 ARG A NE 1 ATOM 1025 C CZ . ARG A 1 132 ? 25.381 93.650 60.466 1.00 48.75 ? 131 ARG A CZ 1 ATOM 1026 N NH1 . ARG A 1 132 ? 24.431 94.362 61.055 1.00 48.79 ? 131 ARG A NH1 1 ATOM 1027 N NH2 . ARG A 1 132 ? 25.431 93.596 59.135 1.00 49.56 ? 131 ARG A NH2 1 ATOM 1028 N N . ARG A 1 133 ? 27.972 87.723 61.148 1.00 45.34 ? 132 ARG A N 1 ATOM 1029 C CA . ARG A 1 133 ? 27.592 86.494 60.482 1.00 46.19 ? 132 ARG A CA 1 ATOM 1030 C C . ARG A 1 133 ? 28.633 85.417 60.647 1.00 46.00 ? 132 ARG A C 1 ATOM 1031 O O . ARG A 1 133 ? 29.791 85.689 60.943 1.00 46.14 ? 132 ARG A O 1 ATOM 1032 C CB . ARG A 1 133 ? 27.299 86.754 59.016 1.00 47.57 ? 132 ARG A CB 1 ATOM 1033 C CG . ARG A 1 133 ? 25.936 87.382 58.855 1.00 48.98 ? 132 ARG A CG 1 ATOM 1034 C CD . ARG A 1 133 ? 25.799 88.096 57.543 1.00 51.21 ? 132 ARG A CD 1 ATOM 1035 N NE . ARG A 1 133 ? 24.397 88.230 57.177 1.00 53.44 ? 132 ARG A NE 1 ATOM 1036 C CZ . ARG A 1 133 ? 23.971 88.848 56.086 1.00 54.39 ? 132 ARG A CZ 1 ATOM 1037 N NH1 . ARG A 1 133 ? 24.839 89.413 55.248 1.00 55.43 ? 132 ARG A NH1 1 ATOM 1038 N NH2 . ARG A 1 133 ? 22.672 88.907 55.844 1.00 55.72 ? 132 ARG A NH2 1 ATOM 1039 N N . ALA A 1 134 ? 28.178 84.184 60.477 1.00 47.02 ? 133 ALA A N 1 ATOM 1040 C CA . ALA A 1 134 ? 29.038 83.021 60.451 1.00 47.43 ? 133 ALA A CA 1 ATOM 1041 C C . ALA A 1 134 ? 29.415 82.749 58.996 1.00 48.20 ? 133 ALA A C 1 ATOM 1042 O O . ALA A 1 134 ? 28.866 83.359 58.086 1.00 50.21 ? 133 ALA A O 1 ATOM 1043 C CB . ALA A 1 134 ? 28.307 81.838 61.054 1.00 47.59 ? 133 ALA A CB 1 ATOM 1044 N N . PRO A 1 135 ? 30.348 81.819 58.761 1.00 47.66 ? 134 PRO A N 1 ATOM 1045 C CA . PRO A 1 135 ? 30.837 81.619 57.398 1.00 48.58 ? 134 PRO A CA 1 ATOM 1046 C C . PRO A 1 135 ? 29.801 81.248 56.334 1.00 48.84 ? 134 PRO A C 1 ATOM 1047 O O . PRO A 1 135 ? 30.003 81.556 55.161 1.00 50.30 ? 134 PRO A O 1 ATOM 1048 C CB . PRO A 1 135 ? 31.853 80.493 57.570 1.00 49.66 ? 134 PRO A CB 1 ATOM 1049 C CG . PRO A 1 135 ? 32.387 80.711 58.939 1.00 48.39 ? 134 PRO A CG 1 ATOM 1050 C CD . PRO A 1 135 ? 31.185 81.106 59.743 1.00 47.74 ? 134 PRO A CD 1 ATOM 1051 N N . ASN A 1 136 ? 28.707 80.617 56.747 1.00 49.38 ? 135 ASN A N 1 ATOM 1052 C CA . ASN A 1 136 ? 27.652 80.226 55.820 1.00 50.39 ? 135 ASN A CA 1 ATOM 1053 C C . ASN A 1 136 ? 27.019 81.399 55.094 1.00 52.22 ? 135 ASN A C 1 ATOM 1054 O O . ASN A 1 136 ? 26.442 81.218 54.023 1.00 55.41 ? 135 ASN A O 1 ATOM 1055 C CB . ASN A 1 136 ? 26.557 79.415 56.524 1.00 50.21 ? 135 ASN A CB 1 ATOM 1056 C CG . ASN A 1 136 ? 25.918 80.162 57.679 1.00 49.57 ? 135 ASN A CG 1 ATOM 1057 O OD1 . ASN A 1 136 ? 26.596 80.856 58.431 1.00 51.06 ? 135 ASN A OD1 1 ATOM 1058 N ND2 . ASN A 1 136 ? 24.610 80.026 57.824 1.00 49.54 ? 135 ASN A ND2 1 ATOM 1059 N N . GLU A 1 137 ? 27.113 82.591 55.676 1.00 52.65 ? 136 GLU A N 1 ATOM 1060 C CA . GLU A 1 137 ? 26.557 83.788 55.034 1.00 53.71 ? 136 GLU A CA 1 ATOM 1061 C C . GLU A 1 137 ? 27.635 84.788 54.625 1.00 52.44 ? 136 GLU A C 1 ATOM 1062 O O . GLU A 1 137 ? 27.358 85.960 54.450 1.00 52.48 ? 136 GLU A O 1 ATOM 1063 C CB . GLU A 1 137 ? 25.499 84.429 55.931 1.00 55.32 ? 136 GLU A CB 1 ATOM 1064 C CG . GLU A 1 137 ? 24.375 83.466 56.279 1.00 58.04 ? 136 GLU A CG 1 ATOM 1065 C CD . GLU A 1 137 ? 23.203 84.141 56.971 1.00 60.78 ? 136 GLU A CD 1 ATOM 1066 O OE1 . GLU A 1 137 ? 22.244 84.495 56.259 1.00 68.36 ? 136 GLU A OE1 1 ATOM 1067 O OE2 . GLU A 1 137 ? 23.227 84.325 58.207 1.00 58.73 ? 136 GLU A OE2 1 ATOM 1068 N N . ASN A 1 138 ? 28.859 84.306 54.430 1.00 52.64 ? 137 ASN A N 1 ATOM 1069 C CA . ASN A 1 138 ? 29.954 85.157 53.969 1.00 52.06 ? 137 ASN A CA 1 ATOM 1070 C C . ASN A 1 138 ? 30.719 84.479 52.836 1.00 53.15 ? 137 ASN A C 1 ATOM 1071 O O . ASN A 1 138 ? 31.952 84.605 52.721 1.00 55.11 ? 137 ASN A O 1 ATOM 1072 C CB . ASN A 1 138 ? 30.886 85.521 55.135 1.00 51.32 ? 137 ASN A CB 1 ATOM 1073 C CG . ASN A 1 138 ? 30.485 86.814 55.822 1.00 50.81 ? 137 ASN A CG 1 ATOM 1074 O OD1 . ASN A 1 138 ? 30.090 87.781 55.168 1.00 50.42 ? 137 ASN A OD1 1 ATOM 1075 N ND2 . ASN A 1 138 ? 30.598 86.842 57.150 1.00 49.94 ? 137 ASN A ND2 1 ATOM 1076 N N . GLY A 1 139 ? 29.974 83.812 51.953 1.00 54.40 ? 138 GLY A N 1 ATOM 1077 C CA . GLY A 1 139 ? 30.553 83.181 50.755 1.00 53.19 ? 138 GLY A CA 1 ATOM 1078 C C . GLY A 1 139 ? 31.429 84.116 49.926 1.00 53.36 ? 138 GLY A C 1 ATOM 1079 O O . GLY A 1 139 ? 32.573 83.774 49.583 1.00 54.26 ? 138 GLY A O 1 ATOM 1080 N N . PRO A 1 140 ? 30.912 85.314 49.594 1.00 52.75 ? 139 PRO A N 1 ATOM 1081 C CA . PRO A 1 140 ? 31.709 86.252 48.786 1.00 52.96 ? 139 PRO A CA 1 ATOM 1082 C C . PRO A 1 140 ? 33.038 86.650 49.432 1.00 51.74 ? 139 PRO A C 1 ATOM 1083 O O . PRO A 1 140 ? 34.043 86.803 48.736 1.00 52.76 ? 139 PRO A O 1 ATOM 1084 C CB . PRO A 1 140 ? 30.786 87.470 48.648 1.00 52.28 ? 139 PRO A CB 1 ATOM 1085 C CG . PRO A 1 140 ? 29.415 86.902 48.756 1.00 53.07 ? 139 PRO A CG 1 ATOM 1086 C CD . PRO A 1 140 ? 29.531 85.797 49.776 1.00 52.65 ? 139 PRO A CD 1 ATOM 1087 N N . TYR A 1 141 ? 33.044 86.807 50.751 1.00 49.81 ? 140 TYR A N 1 ATOM 1088 C CA . TYR A 1 141 ? 34.293 87.045 51.492 1.00 48.83 ? 140 TYR A CA 1 ATOM 1089 C C . TYR A 1 141 ? 35.352 85.988 51.193 1.00 49.15 ? 140 TYR A C 1 ATOM 1090 O O . TYR A 1 141 ? 36.515 86.331 50.923 1.00 49.08 ? 140 TYR A O 1 ATOM 1091 C CB . TYR A 1 141 ? 34.032 87.121 53.006 1.00 46.25 ? 140 TYR A CB 1 ATOM 1092 C CG . TYR A 1 141 ? 35.279 87.124 53.864 1.00 43.87 ? 140 TYR A CG 1 ATOM 1093 C CD1 . TYR A 1 141 ? 36.035 88.272 54.014 1.00 42.61 ? 140 TYR A CD1 1 ATOM 1094 C CD2 . TYR A 1 141 ? 35.696 85.975 54.525 1.00 43.69 ? 140 TYR A CD2 1 ATOM 1095 C CE1 . TYR A 1 141 ? 37.174 88.281 54.797 1.00 42.55 ? 140 TYR A CE1 1 ATOM 1096 C CE2 . TYR A 1 141 ? 36.833 85.970 55.317 1.00 43.47 ? 140 TYR A CE2 1 ATOM 1097 C CZ . TYR A 1 141 ? 37.575 87.128 55.454 1.00 43.35 ? 140 TYR A CZ 1 ATOM 1098 O OH . TYR A 1 141 ? 38.712 87.124 56.249 1.00 41.71 ? 140 TYR A OH 1 ATOM 1099 N N . PHE A 1 142 ? 34.966 84.718 51.246 1.00 50.55 ? 141 PHE A N 1 ATOM 1100 C CA . PHE A 1 142 ? 35.946 83.641 51.011 1.00 52.14 ? 141 PHE A CA 1 ATOM 1101 C C . PHE A 1 142 ? 36.462 83.610 49.576 1.00 54.49 ? 141 PHE A C 1 ATOM 1102 O O . PHE A 1 142 ? 37.636 83.301 49.339 1.00 56.25 ? 141 PHE A O 1 ATOM 1103 C CB . PHE A 1 142 ? 35.379 82.290 51.429 1.00 51.10 ? 141 PHE A CB 1 ATOM 1104 C CG . PHE A 1 142 ? 35.063 82.224 52.897 1.00 50.23 ? 141 PHE A CG 1 ATOM 1105 C CD1 . PHE A 1 142 ? 36.086 82.198 53.832 1.00 48.66 ? 141 PHE A CD1 1 ATOM 1106 C CD2 . PHE A 1 142 ? 33.752 82.247 53.342 1.00 49.59 ? 141 PHE A CD2 1 ATOM 1107 C CE1 . PHE A 1 142 ? 35.805 82.165 55.181 1.00 48.09 ? 141 PHE A CE1 1 ATOM 1108 C CE2 . PHE A 1 142 ? 33.465 82.201 54.691 1.00 48.22 ? 141 PHE A CE2 1 ATOM 1109 C CZ . PHE A 1 142 ? 34.492 82.164 55.611 1.00 48.00 ? 141 PHE A CZ 1 ATOM 1110 N N . LEU A 1 143 ? 35.598 83.938 48.622 1.00 57.09 ? 142 LEU A N 1 ATOM 1111 C CA . LEU A 1 143 ? 36.041 84.084 47.241 1.00 59.31 ? 142 LEU A CA 1 ATOM 1112 C C . LEU A 1 143 ? 37.075 85.220 47.106 1.00 57.56 ? 142 LEU A C 1 ATOM 1113 O O . LEU A 1 143 ? 38.121 85.052 46.469 1.00 59.20 ? 142 LEU A O 1 ATOM 1114 C CB . LEU A 1 143 ? 34.849 84.349 46.315 1.00 62.75 ? 142 LEU A CB 1 ATOM 1115 C CG . LEU A 1 143 ? 33.860 83.191 46.098 1.00 65.99 ? 142 LEU A CG 1 ATOM 1116 C CD1 . LEU A 1 143 ? 32.562 83.701 45.474 1.00 66.40 ? 142 LEU A CD1 1 ATOM 1117 C CD2 . LEU A 1 143 ? 34.470 82.087 45.237 1.00 68.03 ? 142 LEU A CD2 1 ATOM 1118 N N . ALA A 1 144 ? 36.773 86.363 47.716 1.00 54.60 ? 143 ALA A N 1 ATOM 1119 C CA . ALA A 1 144 ? 37.673 87.513 47.669 1.00 53.07 ? 143 ALA A CA 1 ATOM 1120 C C . ALA A 1 144 ? 38.997 87.221 48.385 1.00 51.70 ? 143 ALA A C 1 ATOM 1121 O O . ALA A 1 144 ? 40.064 87.641 47.925 1.00 53.10 ? 143 ALA A O 1 ATOM 1122 C CB . ALA A 1 144 ? 36.998 88.739 48.261 1.00 50.83 ? 143 ALA A CB 1 ATOM 1123 N N . LEU A 1 145 ? 38.926 86.500 49.497 1.00 48.99 ? 144 LEU A N 1 ATOM 1124 C CA . LEU A 1 145 ? 40.129 86.114 50.222 1.00 48.47 ? 144 LEU A CA 1 ATOM 1125 C C . LEU A 1 145 ? 41.033 85.210 49.375 1.00 50.45 ? 144 LEU A C 1 ATOM 1126 O O . LEU A 1 145 ? 42.251 85.409 49.297 1.00 48.27 ? 144 LEU A O 1 ATOM 1127 C CB . LEU A 1 145 ? 39.747 85.393 51.513 1.00 46.68 ? 144 LEU A CB 1 ATOM 1128 C CG . LEU A 1 145 ? 40.889 84.880 52.389 1.00 45.98 ? 144 LEU A CG 1 ATOM 1129 C CD1 . LEU A 1 145 ? 41.762 86.030 52.869 1.00 46.12 ? 144 LEU A CD1 1 ATOM 1130 C CD2 . LEU A 1 145 ? 40.329 84.102 53.569 1.00 45.11 ? 144 LEU A CD2 1 ATOM 1131 N N . ARG A 1 146 ? 40.430 84.219 48.731 1.00 53.03 ? 145 ARG A N 1 ATOM 1132 C CA . ARG A 1 146 ? 41.185 83.340 47.839 1.00 55.65 ? 145 ARG A CA 1 ATOM 1133 C C . ARG A 1 146 ? 41.858 84.127 46.719 1.00 56.89 ? 145 ARG A C 1 ATOM 1134 O O . ARG A 1 146 ? 43.034 83.930 46.450 1.00 58.37 ? 145 ARG A O 1 ATOM 1135 C CB . ARG A 1 146 ? 40.254 82.287 47.247 1.00 58.10 ? 145 ARG A CB 1 ATOM 1136 C CG . ARG A 1 146 ? 40.873 81.333 46.229 1.00 61.39 ? 145 ARG A CG 1 ATOM 1137 C CD . ARG A 1 146 ? 39.854 80.231 45.953 1.00 63.09 ? 145 ARG A CD 1 ATOM 1138 N NE . ARG A 1 146 ? 39.957 79.603 44.633 1.00 69.33 ? 145 ARG A NE 1 ATOM 1139 C CZ . ARG A 1 146 ? 40.482 78.392 44.367 1.00 75.04 ? 145 ARG A CZ 1 ATOM 1140 N NH1 . ARG A 1 146 ? 40.978 77.598 45.326 1.00 76.52 ? 145 ARG A NH1 1 ATOM 1141 N NH2 . ARG A 1 146 ? 40.499 77.951 43.103 1.00 74.97 ? 145 ARG A NH2 1 ATOM 1142 N N . GLU A 1 147 ? 41.111 85.017 46.083 1.00 58.00 ? 146 GLU A N 1 ATOM 1143 C CA . GLU A 1 147 ? 41.680 85.833 45.024 1.00 61.19 ? 146 GLU A CA 1 ATOM 1144 C C . GLU A 1 147 ? 42.814 86.732 45.506 1.00 57.81 ? 146 GLU A C 1 ATOM 1145 O O . GLU A 1 147 ? 43.818 86.908 44.811 1.00 57.74 ? 146 GLU A O 1 ATOM 1146 C CB . GLU A 1 147 ? 40.617 86.717 44.374 1.00 66.93 ? 146 GLU A CB 1 ATOM 1147 C CG . GLU A 1 147 ? 39.638 85.985 43.470 1.00 74.24 ? 146 GLU A CG 1 ATOM 1148 C CD . GLU A 1 147 ? 38.627 86.939 42.841 1.00 83.49 ? 146 GLU A CD 1 ATOM 1149 O OE1 . GLU A 1 147 ? 38.153 87.847 43.569 1.00 91.54 ? 146 GLU A OE1 1 ATOM 1150 O OE2 . GLU A 1 147 ? 38.306 86.800 41.627 1.00 89.57 ? 146 GLU A OE2 1 ATOM 1151 N N . MET A 1 148 ? 42.636 87.334 46.677 1.00 55.24 ? 147 MET A N 1 ATOM 1152 C CA . MET A 1 148 ? 43.652 88.233 47.229 1.00 53.96 ? 147 MET A CA 1 ATOM 1153 C C . MET A 1 148 ? 44.936 87.468 47.554 1.00 53.85 ? 147 MET A C 1 ATOM 1154 O O . MET A 1 148 ? 46.031 87.940 47.261 1.00 54.65 ? 147 MET A O 1 ATOM 1155 C CB . MET A 1 148 ? 43.137 88.929 48.479 1.00 52.89 ? 147 MET A CB 1 ATOM 1156 C CG . MET A 1 148 ? 44.139 89.891 49.085 1.00 53.40 ? 147 MET A CG 1 ATOM 1157 S SD . MET A 1 148 ? 43.414 90.901 50.373 1.00 53.50 ? 147 MET A SD 1 ATOM 1158 C CE . MET A 1 148 ? 43.189 89.702 51.686 1.00 51.32 ? 147 MET A CE 1 ATOM 1159 N N . ILE A 1 149 ? 44.795 86.276 48.123 1.00 52.56 ? 148 ILE A N 1 ATOM 1160 C CA . ILE A 1 149 ? 45.949 85.429 48.404 1.00 52.37 ? 148 ILE A CA 1 ATOM 1161 C C . ILE A 1 149 ? 46.699 85.078 47.120 1.00 53.89 ? 148 ILE A C 1 ATOM 1162 O O . ILE A 1 149 ? 47.924 85.169 47.075 1.00 53.87 ? 148 ILE A O 1 ATOM 1163 C CB . ILE A 1 149 ? 45.534 84.168 49.190 1.00 51.35 ? 148 ILE A CB 1 ATOM 1164 C CG1 . ILE A 1 149 ? 45.169 84.572 50.620 1.00 49.36 ? 148 ILE A CG1 1 ATOM 1165 C CG2 . ILE A 1 149 ? 46.657 83.141 49.205 1.00 51.81 ? 148 ILE A CG2 1 ATOM 1166 C CD1 . ILE A 1 149 ? 44.478 83.493 51.423 1.00 48.94 ? 148 ILE A CD1 1 ATOM 1167 N N . GLU A 1 150 ? 45.970 84.689 46.078 1.00 55.53 ? 149 GLU A N 1 ATOM 1168 C CA . GLU A 1 150 ? 46.598 84.365 44.785 1.00 57.21 ? 149 GLU A CA 1 ATOM 1169 C C . GLU A 1 150 ? 47.369 85.573 44.207 1.00 57.28 ? 149 GLU A C 1 ATOM 1170 O O . GLU A 1 150 ? 48.507 85.442 43.712 1.00 56.94 ? 149 GLU A O 1 ATOM 1171 C CB . GLU A 1 150 ? 45.543 83.844 43.803 1.00 58.85 ? 149 GLU A CB 1 ATOM 1172 C CG . GLU A 1 150 ? 44.989 82.471 44.184 1.00 60.98 ? 149 GLU A CG 1 ATOM 1173 C CD . GLU A 1 150 ? 43.840 81.989 43.301 1.00 64.96 ? 149 GLU A CD 1 ATOM 1174 O OE1 . GLU A 1 150 ? 43.455 82.706 42.345 1.00 70.46 ? 149 GLU A OE1 1 ATOM 1175 O OE2 . GLU A 1 150 ? 43.324 80.876 43.552 1.00 64.68 ? 149 GLU A OE2 1 ATOM 1176 N N . GLU A 1 151 ? 46.742 86.747 44.289 1.00 56.79 ? 150 GLU A N 1 ATOM 1177 C CA . GLU A 1 151 ? 47.372 87.983 43.814 1.00 57.22 ? 150 GLU A CA 1 ATOM 1178 C C . GLU A 1 151 ? 48.664 88.292 44.577 1.00 55.90 ? 150 GLU A C 1 ATOM 1179 O O . GLU A 1 151 ? 49.684 88.666 43.992 1.00 57.62 ? 150 GLU A O 1 ATOM 1180 C CB . GLU A 1 151 ? 46.385 89.145 43.955 1.00 56.93 ? 150 GLU A CB 1 ATOM 1181 C CG . GLU A 1 151 ? 46.958 90.533 43.707 1.00 58.05 ? 150 GLU A CG 1 ATOM 1182 C CD . GLU A 1 151 ? 45.969 91.638 44.053 1.00 58.24 ? 150 GLU A CD 1 ATOM 1183 O OE1 . GLU A 1 151 ? 44.756 91.342 44.157 1.00 58.56 ? 150 GLU A OE1 1 ATOM 1184 O OE2 . GLU A 1 151 ? 46.397 92.804 44.199 1.00 56.85 ? 150 GLU A OE2 1 ATOM 1185 N N . MET A 1 152 ? 48.596 88.163 45.890 1.00 53.82 ? 151 MET A N 1 ATOM 1186 C CA . MET A 1 152 ? 49.737 88.480 46.732 1.00 53.36 ? 151 MET A CA 1 ATOM 1187 C C . MET A 1 152 ? 50.891 87.521 46.461 1.00 53.94 ? 151 MET A C 1 ATOM 1188 O O . MET A 1 152 ? 52.044 87.921 46.436 1.00 54.04 ? 151 MET A O 1 ATOM 1189 C CB . MET A 1 152 ? 49.335 88.459 48.199 1.00 51.84 ? 151 MET A CB 1 ATOM 1190 C CG . MET A 1 152 ? 48.393 89.591 48.568 1.00 51.11 ? 151 MET A CG 1 ATOM 1191 S SD . MET A 1 152 ? 47.791 89.464 50.263 1.00 49.33 ? 151 MET A SD 1 ATOM 1192 C CE . MET A 1 152 ? 49.123 90.270 51.139 1.00 49.95 ? 151 MET A CE 1 ATOM 1193 N N . TYR A 1 153 ? 50.573 86.255 46.243 1.00 54.70 ? 152 TYR A N 1 ATOM 1194 C CA . TYR A 1 153 ? 51.562 85.232 45.853 1.00 56.18 ? 152 TYR A CA 1 ATOM 1195 C C . TYR A 1 153 ? 52.309 85.643 44.600 1.00 57.32 ? 152 TYR A C 1 ATOM 1196 O O . TYR A 1 153 ? 53.559 85.593 44.532 1.00 58.84 ? 152 TYR A O 1 ATOM 1197 C CB . TYR A 1 153 ? 50.852 83.893 45.602 1.00 55.93 ? 152 TYR A CB 1 ATOM 1198 C CG . TYR A 1 153 ? 51.680 82.824 44.924 1.00 57.15 ? 152 TYR A CG 1 ATOM 1199 C CD1 . TYR A 1 153 ? 52.396 81.893 45.672 1.00 57.61 ? 152 TYR A CD1 1 ATOM 1200 C CD2 . TYR A 1 153 ? 51.723 82.719 43.529 1.00 58.84 ? 152 TYR A CD2 1 ATOM 1201 C CE1 . TYR A 1 153 ? 53.143 80.903 45.055 1.00 59.14 ? 152 TYR A CE1 1 ATOM 1202 C CE2 . TYR A 1 153 ? 52.475 81.737 42.902 1.00 59.22 ? 152 TYR A CE2 1 ATOM 1203 C CZ . TYR A 1 153 ? 53.180 80.834 43.669 1.00 60.02 ? 152 TYR A CZ 1 ATOM 1204 O OH . TYR A 1 153 ? 53.924 79.860 43.062 1.00 61.46 ? 152 TYR A OH 1 ATOM 1205 N N . GLN A 1 154 ? 51.531 86.040 43.592 1.00 58.09 ? 153 GLN A N 1 ATOM 1206 C CA . GLN A 1 154 ? 52.107 86.442 42.316 1.00 59.57 ? 153 GLN A CA 1 ATOM 1207 C C . GLN A 1 154 ? 52.932 87.716 42.395 1.00 58.80 ? 153 GLN A C 1 ATOM 1208 O O . GLN A 1 154 ? 54.002 87.805 41.798 1.00 59.96 ? 153 GLN A O 1 ATOM 1209 C CB . GLN A 1 154 ? 51.011 86.622 41.271 1.00 61.03 ? 153 GLN A CB 1 ATOM 1210 C CG . GLN A 1 154 ? 50.406 85.303 40.850 1.00 62.14 ? 153 GLN A CG 1 ATOM 1211 C CD . GLN A 1 154 ? 51.406 84.414 40.166 1.00 64.77 ? 153 GLN A CD 1 ATOM 1212 O OE1 . GLN A 1 154 ? 52.439 84.863 39.627 1.00 66.64 ? 153 GLN A OE1 1 ATOM 1213 N NE2 . GLN A 1 154 ? 51.107 83.140 40.181 1.00 65.69 ? 153 GLN A NE2 1 ATOM 1214 N N . LEU A 1 155 ? 52.391 88.715 43.077 1.00 57.92 ? 154 LEU A N 1 ATOM 1215 C CA . LEU A 1 155 ? 53.037 90.025 43.167 1.00 57.69 ? 154 LEU A CA 1 ATOM 1216 C C . LEU A 1 155 ? 54.298 89.993 43.997 1.00 57.59 ? 154 LEU A C 1 ATOM 1217 O O . LEU A 1 155 ? 55.311 90.567 43.614 1.00 58.13 ? 154 LEU A O 1 ATOM 1218 C CB . LEU A 1 155 ? 52.078 91.070 43.744 1.00 56.21 ? 154 LEU A CB 1 ATOM 1219 C CG . LEU A 1 155 ? 50.958 91.589 42.840 1.00 56.66 ? 154 LEU A CG 1 ATOM 1220 C CD1 . LEU A 1 155 ? 50.290 92.778 43.523 1.00 55.77 ? 154 LEU A CD1 1 ATOM 1221 C CD2 . LEU A 1 155 ? 51.438 91.956 41.441 1.00 57.69 ? 154 LEU A CD2 1 ATOM 1222 N N . TYR A 1 156 ? 54.241 89.323 45.132 1.00 57.86 ? 155 TYR A N 1 ATOM 1223 C CA . TYR A 1 156 ? 55.336 89.415 46.097 1.00 58.96 ? 155 TYR A CA 1 ATOM 1224 C C . TYR A 1 156 ? 56.224 88.179 46.112 1.00 61.31 ? 155 TYR A C 1 ATOM 1225 O O . TYR A 1 156 ? 57.158 88.101 46.903 1.00 62.59 ? 155 TYR A O 1 ATOM 1226 C CB . TYR A 1 156 ? 54.787 89.774 47.477 1.00 57.21 ? 155 TYR A CB 1 ATOM 1227 C CG . TYR A 1 156 ? 53.851 90.950 47.343 1.00 56.37 ? 155 TYR A CG 1 ATOM 1228 C CD1 . TYR A 1 156 ? 54.306 92.157 46.820 1.00 57.15 ? 155 TYR A CD1 1 ATOM 1229 C CD2 . TYR A 1 156 ? 52.503 90.842 47.654 1.00 54.95 ? 155 TYR A CD2 1 ATOM 1230 C CE1 . TYR A 1 156 ? 53.454 93.229 46.642 1.00 56.11 ? 155 TYR A CE1 1 ATOM 1231 C CE2 . TYR A 1 156 ? 51.645 91.915 47.478 1.00 54.05 ? 155 TYR A CE2 1 ATOM 1232 C CZ . TYR A 1 156 ? 52.130 93.101 46.970 1.00 54.23 ? 155 TYR A CZ 1 ATOM 1233 O OH . TYR A 1 156 ? 51.300 94.169 46.780 1.00 53.55 ? 155 TYR A OH 1 ATOM 1234 N N . GLY A 1 157 ? 55.941 87.214 45.235 1.00 61.97 ? 156 GLY A N 1 ATOM 1235 C CA . GLY A 1 157 ? 56.897 86.153 44.925 1.00 63.30 ? 156 GLY A CA 1 ATOM 1236 C C . GLY A 1 157 ? 57.007 84.973 45.876 1.00 62.92 ? 156 GLY A C 1 ATOM 1237 O O . GLY A 1 157 ? 58.016 84.268 45.887 1.00 64.76 ? 156 GLY A O 1 ATOM 1238 N N . GLY A 1 158 ? 55.971 84.734 46.666 1.00 60.90 ? 157 GLY A N 1 ATOM 1239 C CA . GLY A 1 158 ? 55.910 83.504 47.430 1.00 61.42 ? 157 GLY A CA 1 ATOM 1240 C C . GLY A 1 158 ? 54.604 83.316 48.169 1.00 60.51 ? 157 GLY A C 1 ATOM 1241 O O . GLY A 1 158 ? 53.762 84.217 48.215 1.00 58.13 ? 157 GLY A O 1 ATOM 1242 N N . PRO A 1 159 ? 54.443 82.144 48.805 1.00 60.74 ? 158 PRO A N 1 ATOM 1243 C CA . PRO A 1 159 ? 53.231 81.820 49.563 1.00 59.61 ? 158 PRO A CA 1 ATOM 1244 C C . PRO A 1 159 ? 53.021 82.741 50.772 1.00 58.33 ? 158 PRO A C 1 ATOM 1245 O O . PRO A 1 159 ? 53.991 83.315 51.296 1.00 59.04 ? 158 PRO A O 1 ATOM 1246 C CB . PRO A 1 159 ? 53.464 80.372 50.001 1.00 60.10 ? 158 PRO A CB 1 ATOM 1247 C CG . PRO A 1 159 ? 54.942 80.190 49.974 1.00 61.59 ? 158 PRO A CG 1 ATOM 1248 C CD . PRO A 1 159 ? 55.426 81.044 48.845 1.00 61.90 ? 158 PRO A CD 1 ATOM 1249 N N . VAL A 1 160 ? 51.758 82.861 51.189 1.00 57.03 ? 159 VAL A N 1 ATOM 1250 C CA . VAL A 1 160 ? 51.337 83.865 52.162 1.00 57.60 ? 159 VAL A CA 1 ATOM 1251 C C . VAL A 1 160 ? 51.229 83.283 53.576 1.00 55.90 ? 159 VAL A C 1 ATOM 1252 O O . VAL A 1 160 ? 50.943 82.088 53.766 1.00 55.64 ? 159 VAL A O 1 ATOM 1253 C CB . VAL A 1 160 ? 50.011 84.590 51.789 1.00 58.37 ? 159 VAL A CB 1 ATOM 1254 C CG1 . VAL A 1 160 ? 49.912 84.812 50.286 1.00 58.79 ? 159 VAL A CG1 1 ATOM 1255 C CG2 . VAL A 1 160 ? 48.791 83.844 52.309 1.00 58.82 ? 159 VAL A CG2 1 ATOM 1256 N N . VAL A 1 161 ? 51.494 84.142 54.554 1.00 54.43 ? 160 VAL A N 1 ATOM 1257 C CA . VAL A 1 161 ? 51.299 83.791 55.949 1.00 54.13 ? 160 VAL A CA 1 ATOM 1258 C C . VAL A 1 161 ? 49.995 84.423 56.405 1.00 52.41 ? 160 VAL A C 1 ATOM 1259 O O . VAL A 1 161 ? 49.823 85.642 56.283 1.00 51.92 ? 160 VAL A O 1 ATOM 1260 C CB . VAL A 1 161 ? 52.463 84.270 56.835 1.00 54.71 ? 160 VAL A CB 1 ATOM 1261 C CG1 . VAL A 1 161 ? 52.118 84.099 58.303 1.00 54.45 ? 160 VAL A CG1 1 ATOM 1262 C CG2 . VAL A 1 161 ? 53.730 83.496 56.502 1.00 56.55 ? 160 VAL A CG2 1 ATOM 1263 N N . LEU A 1 162 ? 49.077 83.586 56.890 1.00 51.22 ? 161 LEU A N 1 ATOM 1264 C CA . LEU A 1 162 ? 47.815 84.048 57.464 1.00 49.29 ? 161 LEU A CA 1 ATOM 1265 C C . LEU A 1 162 ? 48.013 84.254 58.952 1.00 48.55 ? 161 LEU A C 1 ATOM 1266 O O . LEU A 1 162 ? 48.529 83.369 59.631 1.00 48.39 ? 161 LEU A O 1 ATOM 1267 C CB . LEU A 1 162 ? 46.720 83.008 57.252 1.00 49.67 ? 161 LEU A CB 1 ATOM 1268 C CG . LEU A 1 162 ? 46.366 82.682 55.800 1.00 50.68 ? 161 LEU A CG 1 ATOM 1269 C CD1 . LEU A 1 162 ? 45.444 81.475 55.733 1.00 50.80 ? 161 LEU A CD1 1 ATOM 1270 C CD2 . LEU A 1 162 ? 45.725 83.881 55.128 1.00 51.27 ? 161 LEU A CD2 1 ATOM 1271 N N . VAL A 1 163 ? 47.605 85.415 59.461 1.00 46.77 ? 162 VAL A N 1 ATOM 1272 C CA . VAL A 1 163 ? 47.667 85.693 60.885 1.00 46.50 ? 162 VAL A CA 1 ATOM 1273 C C . VAL A 1 163 ? 46.255 86.021 61.318 1.00 45.35 ? 162 VAL A C 1 ATOM 1274 O O . VAL A 1 163 ? 45.682 86.997 60.832 1.00 46.42 ? 162 VAL A O 1 ATOM 1275 C CB . VAL A 1 163 ? 48.590 86.884 61.198 1.00 46.58 ? 162 VAL A CB 1 ATOM 1276 C CG1 . VAL A 1 163 ? 48.667 87.120 62.701 1.00 46.16 ? 162 VAL A CG1 1 ATOM 1277 C CG2 . VAL A 1 163 ? 49.974 86.645 60.622 1.00 48.07 ? 162 VAL A CG2 1 ATOM 1278 N N . ALA A 1 164 ? 45.688 85.216 62.214 1.00 44.92 ? 163 ALA A N 1 ATOM 1279 C CA . ALA A 1 164 ? 44.282 85.383 62.626 1.00 44.17 ? 163 ALA A CA 1 ATOM 1280 C C . ALA A 1 164 ? 44.155 85.493 64.130 1.00 43.58 ? 163 ALA A C 1 ATOM 1281 O O . ALA A 1 164 ? 44.923 84.884 64.871 1.00 43.29 ? 163 ALA A O 1 ATOM 1282 C CB . ALA A 1 164 ? 43.438 84.224 62.116 1.00 43.68 ? 163 ALA A CB 1 ATOM 1283 N N . HIS A 1 165 ? 43.184 86.282 64.571 1.00 44.22 ? 164 HIS A N 1 ATOM 1284 C CA . HIS A 1 165 ? 42.944 86.482 65.985 1.00 44.38 ? 164 HIS A CA 1 ATOM 1285 C C . HIS A 1 165 ? 41.538 86.066 66.336 1.00 43.38 ? 164 HIS A C 1 ATOM 1286 O O . HIS A 1 165 ? 40.583 86.386 65.629 1.00 41.13 ? 164 HIS A O 1 ATOM 1287 C CB . HIS A 1 165 ? 43.152 87.938 66.381 1.00 45.32 ? 164 HIS A CB 1 ATOM 1288 C CG . HIS A 1 165 ? 42.939 88.183 67.840 1.00 46.58 ? 164 HIS A CG 1 ATOM 1289 N ND1 . HIS A 1 165 ? 41.903 88.954 68.322 1.00 46.07 ? 164 HIS A ND1 1 ATOM 1290 C CD2 . HIS A 1 165 ? 43.602 87.715 68.925 1.00 47.16 ? 164 HIS A CD2 1 ATOM 1291 C CE1 . HIS A 1 165 ? 41.951 88.969 69.642 1.00 47.36 ? 164 HIS A CE1 1 ATOM 1292 N NE2 . HIS A 1 165 ? 42.969 88.221 70.034 1.00 47.36 ? 164 HIS A NE2 1 ATOM 1293 N N . SER A 1 166 ? 41.428 85.353 67.452 1.00 43.61 ? 165 SER A N 1 ATOM 1294 C CA . SER A 1 166 ? 40.138 85.046 68.059 1.00 43.49 ? 165 SER A CA 1 ATOM 1295 C C . SER A 1 166 ? 39.234 84.317 67.048 1.00 42.42 ? 165 SER A C 1 ATOM 1296 O O . SER A 1 166 ? 39.678 83.364 66.414 1.00 45.05 ? 165 SER A O 1 ATOM 1297 C CB . SER A 1 166 ? 39.499 86.355 68.580 1.00 44.05 ? 165 SER A CB 1 ATOM 1298 O OG . SER A 1 166 ? 38.355 86.124 69.389 1.00 43.76 ? 165 SER A OG 1 ATOM 1299 N N . MET A 1 167 ? 37.997 84.770 66.869 1.00 41.75 ? 166 MET A N 1 ATOM 1300 C CA . MET A 1 167 ? 37.077 84.145 65.912 1.00 42.81 ? 166 MET A CA 1 ATOM 1301 C C . MET A 1 167 ? 37.613 84.100 64.473 1.00 43.28 ? 166 MET A C 1 ATOM 1302 O O . MET A 1 167 ? 37.213 83.256 63.680 1.00 43.10 ? 166 MET A O 1 ATOM 1303 C CB . MET A 1 167 ? 35.746 84.897 65.918 1.00 42.92 ? 166 MET A CB 1 ATOM 1304 C CG . MET A 1 167 ? 34.671 84.236 65.083 1.00 44.03 ? 166 MET A CG 1 ATOM 1305 S SD . MET A 1 167 ? 33.116 85.117 65.190 1.00 45.11 ? 166 MET A SD 1 ATOM 1306 C CE . MET A 1 167 ? 33.393 86.499 64.087 1.00 44.70 ? 166 MET A CE 1 ATOM 1307 N N . GLY A 1 168 ? 38.528 85.000 64.134 1.00 43.65 ? 167 GLY A N 1 ATOM 1308 C CA . GLY A 1 168 ? 39.160 84.965 62.818 1.00 45.26 ? 167 GLY A CA 1 ATOM 1309 C C . GLY A 1 168 ? 39.838 83.624 62.545 1.00 46.11 ? 167 GLY A C 1 ATOM 1310 O O . GLY A 1 168 ? 39.986 83.219 61.397 1.00 45.21 ? 167 GLY A O 1 ATOM 1311 N N . ASN A 1 169 ? 40.260 82.928 63.599 1.00 45.83 ? 168 ASN A N 1 ATOM 1312 C CA . ASN A 1 169 ? 40.838 81.611 63.432 1.00 46.72 ? 168 ASN A CA 1 ATOM 1313 C C . ASN A 1 169 ? 39.851 80.564 62.923 1.00 47.67 ? 168 ASN A C 1 ATOM 1314 O O . ASN A 1 169 ? 40.210 79.687 62.132 1.00 49.55 ? 168 ASN A O 1 ATOM 1315 C CB . ASN A 1 169 ? 41.462 81.137 64.743 1.00 46.32 ? 168 ASN A CB 1 ATOM 1316 C CG . ASN A 1 169 ? 42.687 81.935 65.113 1.00 46.64 ? 168 ASN A CG 1 ATOM 1317 O OD1 . ASN A 1 169 ? 43.739 81.775 64.501 1.00 49.29 ? 168 ASN A OD1 1 ATOM 1318 N ND2 . ASN A 1 169 ? 42.559 82.810 66.102 1.00 46.14 ? 168 ASN A ND2 1 ATOM 1319 N N . MET A 1 170 ? 38.606 80.675 63.367 1.00 48.06 ? 169 MET A N 1 ATOM 1320 C CA . MET A 1 170 ? 37.561 79.765 62.941 1.00 48.05 ? 169 MET A CA 1 ATOM 1321 C C . MET A 1 170 ? 37.137 80.072 61.502 1.00 46.63 ? 169 MET A C 1 ATOM 1322 O O . MET A 1 170 ? 36.890 79.153 60.716 1.00 48.66 ? 169 MET A O 1 ATOM 1323 C CB . MET A 1 170 ? 36.354 79.840 63.879 1.00 48.62 ? 169 MET A CB 1 ATOM 1324 C CG . MET A 1 170 ? 36.597 79.224 65.248 1.00 50.53 ? 169 MET A CG 1 ATOM 1325 S SD . MET A 1 170 ? 36.750 77.429 65.163 1.00 55.31 ? 169 MET A SD 1 ATOM 1326 C CE . MET A 1 170 ? 35.029 76.928 65.141 1.00 54.20 ? 169 MET A CE 1 ATOM 1327 N N . TYR A 1 171 ? 37.066 81.354 61.154 1.00 44.31 ? 170 TYR A N 1 ATOM 1328 C CA . TYR A 1 171 ? 36.894 81.765 59.745 1.00 44.56 ? 170 TYR A CA 1 ATOM 1329 C C . TYR A 1 171 ? 38.010 81.189 58.856 1.00 44.56 ? 170 TYR A C 1 ATOM 1330 O O . TYR A 1 171 ? 37.741 80.658 57.780 1.00 45.43 ? 170 TYR A O 1 ATOM 1331 C CB . TYR A 1 171 ? 36.828 83.297 59.616 1.00 43.56 ? 170 TYR A CB 1 ATOM 1332 C CG . TYR A 1 171 ? 35.415 83.809 59.502 1.00 43.78 ? 170 TYR A CG 1 ATOM 1333 C CD1 . TYR A 1 171 ? 34.545 83.788 60.597 1.00 43.12 ? 170 TYR A CD1 1 ATOM 1334 C CD2 . TYR A 1 171 ? 34.931 84.285 58.288 1.00 44.36 ? 170 TYR A CD2 1 ATOM 1335 C CE1 . TYR A 1 171 ? 33.239 84.244 60.482 1.00 43.27 ? 170 TYR A CE1 1 ATOM 1336 C CE2 . TYR A 1 171 ? 33.633 84.741 58.168 1.00 44.56 ? 170 TYR A CE2 1 ATOM 1337 C CZ . TYR A 1 171 ? 32.793 84.716 59.258 1.00 44.11 ? 170 TYR A CZ 1 ATOM 1338 O OH . TYR A 1 171 ? 31.507 85.164 59.099 1.00 45.01 ? 170 TYR A OH 1 ATOM 1339 N N . THR A 1 172 ? 39.253 81.308 59.314 1.00 43.23 ? 171 THR A N 1 ATOM 1340 C CA . THR A 1 172 ? 40.396 80.824 58.554 1.00 44.28 ? 171 THR A CA 1 ATOM 1341 C C . THR A 1 172 ? 40.395 79.298 58.414 1.00 45.11 ? 171 THR A C 1 ATOM 1342 O O . THR A 1 172 ? 40.662 78.768 57.321 1.00 44.80 ? 171 THR A O 1 ATOM 1343 C CB . THR A 1 172 ? 41.712 81.320 59.182 1.00 44.05 ? 171 THR A CB 1 ATOM 1344 O OG1 . THR A 1 172 ? 41.701 82.754 59.216 1.00 43.52 ? 171 THR A OG1 1 ATOM 1345 C CG2 . THR A 1 172 ? 42.920 80.854 58.378 1.00 45.13 ? 171 THR A CG2 1 ATOM 1346 N N . LEU A 1 173 ? 40.078 78.590 59.500 1.00 45.33 ? 172 LEU A N 1 ATOM 1347 C CA . LEU A 1 173 ? 39.967 77.128 59.430 1.00 46.43 ? 172 LEU A CA 1 ATOM 1348 C C . LEU A 1 173 ? 38.879 76.675 58.444 1.00 46.39 ? 172 LEU A C 1 ATOM 1349 O O . LEU A 1 173 ? 39.095 75.769 57.633 1.00 46.66 ? 172 LEU A O 1 ATOM 1350 C CB . LEU A 1 173 ? 39.697 76.536 60.817 1.00 46.57 ? 172 LEU A CB 1 ATOM 1351 C CG . LEU A 1 173 ? 39.569 75.009 60.885 1.00 47.88 ? 172 LEU A CG 1 ATOM 1352 C CD1 . LEU A 1 173 ? 40.782 74.316 60.278 1.00 49.32 ? 172 LEU A CD1 1 ATOM 1353 C CD2 . LEU A 1 173 ? 39.362 74.553 62.316 1.00 47.60 ? 172 LEU A CD2 1 ATOM 1354 N N . TYR A 1 174 ? 37.719 77.324 58.501 1.00 46.55 ? 173 TYR A N 1 ATOM 1355 C CA . TYR A 1 174 ? 36.651 77.050 57.542 1.00 47.65 ? 173 TYR A CA 1 ATOM 1356 C C . TYR A 1 174 ? 37.168 77.182 56.116 1.00 49.28 ? 173 TYR A C 1 ATOM 1357 O O . TYR A 1 174 ? 36.984 76.285 55.274 1.00 48.73 ? 173 TYR A O 1 ATOM 1358 C CB . TYR A 1 174 ? 35.490 78.014 57.758 1.00 46.68 ? 173 TYR A CB 1 ATOM 1359 C CG . TYR A 1 174 ? 34.334 77.876 56.789 1.00 47.20 ? 173 TYR A CG 1 ATOM 1360 C CD1 . TYR A 1 174 ? 33.315 76.968 57.021 1.00 47.81 ? 173 TYR A CD1 1 ATOM 1361 C CD2 . TYR A 1 174 ? 34.239 78.689 55.660 1.00 48.89 ? 173 TYR A CD2 1 ATOM 1362 C CE1 . TYR A 1 174 ? 32.245 76.851 56.146 1.00 49.50 ? 173 TYR A CE1 1 ATOM 1363 C CE2 . TYR A 1 174 ? 33.169 78.582 54.777 1.00 50.09 ? 173 TYR A CE2 1 ATOM 1364 C CZ . TYR A 1 174 ? 32.177 77.657 55.024 1.00 50.39 ? 173 TYR A CZ 1 ATOM 1365 O OH . TYR A 1 174 ? 31.116 77.543 54.162 1.00 51.04 ? 173 TYR A OH 1 ATOM 1366 N N . PHE A 1 175 ? 37.825 78.306 55.852 1.00 49.37 ? 174 PHE A N 1 ATOM 1367 C CA . PHE A 1 175 ? 38.369 78.575 54.536 1.00 49.68 ? 174 PHE A CA 1 ATOM 1368 C C . PHE A 1 175 ? 39.340 77.476 54.096 1.00 53.17 ? 174 PHE A C 1 ATOM 1369 O O . PHE A 1 175 ? 39.200 76.904 52.990 1.00 56.60 ? 174 PHE A O 1 ATOM 1370 C CB . PHE A 1 175 ? 39.054 79.938 54.547 1.00 49.22 ? 174 PHE A CB 1 ATOM 1371 C CG . PHE A 1 175 ? 39.788 80.264 53.287 1.00 50.33 ? 174 PHE A CG 1 ATOM 1372 C CD1 . PHE A 1 175 ? 39.094 80.516 52.110 1.00 51.19 ? 174 PHE A CD1 1 ATOM 1373 C CD2 . PHE A 1 175 ? 41.173 80.332 53.279 1.00 50.27 ? 174 PHE A CD2 1 ATOM 1374 C CE1 . PHE A 1 175 ? 39.771 80.826 50.945 1.00 52.55 ? 174 PHE A CE1 1 ATOM 1375 C CE2 . PHE A 1 175 ? 41.856 80.636 52.116 1.00 52.05 ? 174 PHE A CE2 1 ATOM 1376 C CZ . PHE A 1 175 ? 41.156 80.886 50.946 1.00 52.73 ? 174 PHE A CZ 1 ATOM 1377 N N . LEU A 1 176 ? 40.311 77.173 54.956 1.00 52.50 ? 175 LEU A N 1 ATOM 1378 C CA . LEU A 1 176 ? 41.349 76.202 54.601 1.00 54.30 ? 175 LEU A CA 1 ATOM 1379 C C . LEU A 1 176 ? 40.816 74.778 54.436 1.00 55.43 ? 175 LEU A C 1 ATOM 1380 O O . LEU A 1 176 ? 41.271 74.035 53.557 1.00 55.98 ? 175 LEU A O 1 ATOM 1381 C CB . LEU A 1 176 ? 42.482 76.229 55.629 1.00 53.35 ? 175 LEU A CB 1 ATOM 1382 C CG . LEU A 1 176 ? 43.277 77.537 55.652 1.00 52.75 ? 175 LEU A CG 1 ATOM 1383 C CD1 . LEU A 1 176 ? 44.188 77.587 56.871 1.00 52.32 ? 175 LEU A CD1 1 ATOM 1384 C CD2 . LEU A 1 176 ? 44.081 77.719 54.369 1.00 53.52 ? 175 LEU A CD2 1 ATOM 1385 N N . GLN A 1 177 ? 39.862 74.398 55.278 1.00 55.32 ? 176 GLN A N 1 ATOM 1386 C CA . GLN A 1 177 ? 39.224 73.078 55.144 1.00 57.12 ? 176 GLN A CA 1 ATOM 1387 C C . GLN A 1 177 ? 38.572 72.873 53.775 1.00 59.13 ? 176 GLN A C 1 ATOM 1388 O O . GLN A 1 177 ? 38.489 71.746 53.287 1.00 59.26 ? 176 GLN A O 1 ATOM 1389 C CB . GLN A 1 177 ? 38.183 72.869 56.246 1.00 56.04 ? 176 GLN A CB 1 ATOM 1390 C CG . GLN A 1 177 ? 38.787 72.536 57.601 1.00 55.51 ? 176 GLN A CG 1 ATOM 1391 C CD . GLN A 1 177 ? 37.739 72.238 58.657 1.00 55.26 ? 176 GLN A CD 1 ATOM 1392 O OE1 . GLN A 1 177 ? 36.555 72.534 58.487 1.00 54.69 ? 176 GLN A OE1 1 ATOM 1393 N NE2 . GLN A 1 177 ? 38.175 71.654 59.761 1.00 55.93 ? 176 GLN A NE2 1 ATOM 1394 N N . ARG A 1 178 ? 38.126 73.970 53.165 1.00 61.14 ? 177 ARG A N 1 ATOM 1395 C CA . ARG A 1 178 ? 37.432 73.914 51.894 1.00 63.59 ? 177 ARG A CA 1 ATOM 1396 C C . ARG A 1 178 ? 38.296 74.158 50.660 1.00 62.92 ? 177 ARG A C 1 ATOM 1397 O O . ARG A 1 178 ? 37.768 74.183 49.554 1.00 63.91 ? 177 ARG A O 1 ATOM 1398 C CB . ARG A 1 178 ? 36.239 74.874 51.925 1.00 66.05 ? 177 ARG A CB 1 ATOM 1399 C CG . ARG A 1 178 ? 35.138 74.387 52.846 1.00 70.38 ? 177 ARG A CG 1 ATOM 1400 C CD . ARG A 1 178 ? 34.024 75.406 53.030 1.00 76.59 ? 177 ARG A CD 1 ATOM 1401 N NE . ARG A 1 178 ? 32.733 74.755 53.300 1.00 86.04 ? 177 ARG A NE 1 ATOM 1402 C CZ . ARG A 1 178 ? 32.409 74.099 54.423 1.00 89.86 ? 177 ARG A CZ 1 ATOM 1403 N NH1 . ARG A 1 178 ? 33.274 73.976 55.433 1.00 90.27 ? 177 ARG A NH1 1 ATOM 1404 N NH2 . ARG A 1 178 ? 31.198 73.555 54.544 1.00 91.74 ? 177 ARG A NH2 1 ATOM 1405 N N . GLN A 1 179 ? 39.597 74.371 50.835 1.00 61.70 ? 178 GLN A N 1 ATOM 1406 C CA . GLN A 1 179 ? 40.484 74.499 49.689 1.00 61.75 ? 178 GLN A CA 1 ATOM 1407 C C . GLN A 1 179 ? 41.200 73.182 49.464 1.00 61.53 ? 178 GLN A C 1 ATOM 1408 O O . GLN A 1 179 ? 41.595 72.537 50.420 1.00 61.70 ? 178 GLN A O 1 ATOM 1409 C CB . GLN A 1 179 ? 41.536 75.584 49.910 1.00 61.32 ? 178 GLN A CB 1 ATOM 1410 C CG . GLN A 1 179 ? 40.995 76.969 50.196 1.00 60.97 ? 178 GLN A CG 1 ATOM 1411 C CD . GLN A 1 179 ? 39.814 77.344 49.326 1.00 62.02 ? 178 GLN A CD 1 ATOM 1412 O OE1 . GLN A 1 179 ? 39.914 77.386 48.097 1.00 62.33 ? 178 GLN A OE1 1 ATOM 1413 N NE2 . GLN A 1 179 ? 38.685 77.635 49.967 1.00 62.05 ? 178 GLN A NE2 1 ATOM 1414 N N . PRO A 1 180 ? 41.402 72.797 48.196 1.00 62.39 ? 179 PRO A N 1 ATOM 1415 C CA . PRO A 1 180 ? 42.154 71.575 47.916 1.00 63.30 ? 179 PRO A CA 1 ATOM 1416 C C . PRO A 1 180 ? 43.571 71.641 48.480 1.00 63.30 ? 179 PRO A C 1 ATOM 1417 O O . PRO A 1 180 ? 44.176 72.717 48.548 1.00 62.78 ? 179 PRO A O 1 ATOM 1418 C CB . PRO A 1 180 ? 42.191 71.510 46.381 1.00 63.99 ? 179 PRO A CB 1 ATOM 1419 C CG . PRO A 1 180 ? 41.107 72.409 45.909 1.00 63.60 ? 179 PRO A CG 1 ATOM 1420 C CD . PRO A 1 180 ? 40.950 73.468 46.959 1.00 61.97 ? 179 PRO A CD 1 ATOM 1421 N N . GLN A 1 181 ? 44.093 70.486 48.867 1.00 64.22 ? 180 GLN A N 1 ATOM 1422 C CA . GLN A 1 181 ? 45.435 70.403 49.427 1.00 64.24 ? 180 GLN A CA 1 ATOM 1423 C C . GLN A 1 181 ? 46.491 70.997 48.487 1.00 64.87 ? 180 GLN A C 1 ATOM 1424 O O . GLN A 1 181 ? 47.405 71.669 48.937 1.00 64.29 ? 180 GLN A O 1 ATOM 1425 C CB . GLN A 1 181 ? 45.788 68.948 49.761 1.00 65.97 ? 180 GLN A CB 1 ATOM 1426 C CG . GLN A 1 181 ? 47.099 68.769 50.518 1.00 67.19 ? 180 GLN A CG 1 ATOM 1427 C CD . GLN A 1 181 ? 47.088 69.434 51.886 1.00 66.11 ? 180 GLN A CD 1 ATOM 1428 O OE1 . GLN A 1 181 ? 46.216 69.168 52.712 1.00 65.42 ? 180 GLN A OE1 1 ATOM 1429 N NE2 . GLN A 1 181 ? 48.069 70.294 52.135 1.00 66.43 ? 180 GLN A NE2 1 ATOM 1430 N N . ALA A 1 182 ? 46.360 70.760 47.183 1.00 65.75 ? 181 ALA A N 1 ATOM 1431 C CA . ALA A 1 182 ? 47.319 71.287 46.213 1.00 66.88 ? 181 ALA A CA 1 ATOM 1432 C C . ALA A 1 182 ? 47.326 72.815 46.187 1.00 65.28 ? 181 ALA A C 1 ATOM 1433 O O . ALA A 1 182 ? 48.395 73.427 46.022 1.00 65.21 ? 181 ALA A O 1 ATOM 1434 C CB . ALA A 1 182 ? 47.023 70.741 44.824 1.00 68.29 ? 181 ALA A CB 1 ATOM 1435 N N . TRP A 1 183 ? 46.151 73.426 46.368 1.00 64.08 ? 182 TRP A N 1 ATOM 1436 C CA . TRP A 1 183 ? 46.047 74.879 46.419 1.00 62.71 ? 182 TRP A CA 1 ATOM 1437 C C . TRP A 1 183 ? 46.782 75.408 47.663 1.00 61.81 ? 182 TRP A C 1 ATOM 1438 O O . TRP A 1 183 ? 47.574 76.349 47.584 1.00 61.69 ? 182 TRP A O 1 ATOM 1439 C CB . TRP A 1 183 ? 44.583 75.327 46.406 1.00 62.08 ? 182 TRP A CB 1 ATOM 1440 C CG . TRP A 1 183 ? 44.434 76.809 46.324 1.00 61.77 ? 182 TRP A CG 1 ATOM 1441 C CD1 . TRP A 1 183 ? 44.278 77.555 45.194 1.00 61.47 ? 182 TRP A CD1 1 ATOM 1442 C CD2 . TRP A 1 183 ? 44.440 77.736 47.426 1.00 59.38 ? 182 TRP A CD2 1 ATOM 1443 N NE1 . TRP A 1 183 ? 44.189 78.887 45.522 1.00 61.15 ? 182 TRP A NE1 1 ATOM 1444 C CE2 . TRP A 1 183 ? 44.289 79.025 46.883 1.00 58.47 ? 182 TRP A CE2 1 ATOM 1445 C CE3 . TRP A 1 183 ? 44.571 77.597 48.815 1.00 58.41 ? 182 TRP A CE3 1 ATOM 1446 C CZ2 . TRP A 1 183 ? 44.262 80.172 47.677 1.00 57.91 ? 182 TRP A CZ2 1 ATOM 1447 C CZ3 . TRP A 1 183 ? 44.543 78.744 49.612 1.00 57.04 ? 182 TRP A CZ3 1 ATOM 1448 C CH2 . TRP A 1 183 ? 44.389 80.012 49.039 1.00 57.02 ? 182 TRP A CH2 1 ATOM 1449 N N . LYS A 1 184 ? 46.560 74.758 48.800 1.00 59.80 ? 183 LYS A N 1 ATOM 1450 C CA . LYS A 1 184 ? 47.184 75.199 50.040 1.00 58.67 ? 183 LYS A CA 1 ATOM 1451 C C . LYS A 1 184 ? 48.704 75.029 50.015 1.00 59.18 ? 183 LYS A C 1 ATOM 1452 O O . LYS A 1 184 ? 49.441 75.888 50.498 1.00 56.92 ? 183 LYS A O 1 ATOM 1453 C CB . LYS A 1 184 ? 46.553 74.487 51.247 1.00 57.36 ? 183 LYS A CB 1 ATOM 1454 C CG . LYS A 1 184 ? 45.098 74.882 51.443 1.00 55.58 ? 183 LYS A CG 1 ATOM 1455 C CD . LYS A 1 184 ? 44.459 74.201 52.631 1.00 55.28 ? 183 LYS A CD 1 ATOM 1456 C CE . LYS A 1 184 ? 44.261 72.721 52.384 1.00 57.57 ? 183 LYS A CE 1 ATOM 1457 N NZ . LYS A 1 184 ? 43.356 72.121 53.395 1.00 57.81 ? 183 LYS A NZ 1 ATOM 1458 N N . ASP A 1 185 ? 49.158 73.935 49.407 1.00 61.38 ? 184 ASP A N 1 ATOM 1459 C CA . ASP A 1 185 ? 50.592 73.659 49.276 1.00 62.59 ? 184 ASP A CA 1 ATOM 1460 C C . ASP A 1 185 ? 51.294 74.726 48.451 1.00 62.65 ? 184 ASP A C 1 ATOM 1461 O O . ASP A 1 185 ? 52.439 75.065 48.730 1.00 62.86 ? 184 ASP A O 1 ATOM 1462 C CB . ASP A 1 185 ? 50.828 72.280 48.648 1.00 64.97 ? 184 ASP A CB 1 ATOM 1463 C CG . ASP A 1 185 ? 50.527 71.123 49.605 1.00 67.03 ? 184 ASP A CG 1 ATOM 1464 O OD1 . ASP A 1 185 ? 50.344 71.350 50.824 1.00 64.16 ? 184 ASP A OD1 1 ATOM 1465 O OD2 . ASP A 1 185 ? 50.494 69.963 49.124 1.00 70.56 ? 184 ASP A OD2 1 ATOM 1466 N N . LYS A 1 186 ? 50.607 75.263 47.450 1.00 62.62 ? 185 LYS A N 1 ATOM 1467 C CA . LYS A 1 186 ? 51.171 76.299 46.610 1.00 63.46 ? 185 LYS A CA 1 ATOM 1468 C C . LYS A 1 186 ? 51.111 77.677 47.261 1.00 62.68 ? 185 LYS A C 1 ATOM 1469 O O . LYS A 1 186 ? 52.098 78.413 47.245 1.00 64.92 ? 185 LYS A O 1 ATOM 1470 C CB . LYS A 1 186 ? 50.427 76.349 45.276 1.00 65.37 ? 185 LYS A CB 1 ATOM 1471 C CG . LYS A 1 186 ? 50.887 77.465 44.354 1.00 67.00 ? 185 LYS A CG 1 ATOM 1472 C CD . LYS A 1 186 ? 50.265 77.333 42.973 1.00 69.16 ? 185 LYS A CD 1 ATOM 1473 C CE . LYS A 1 186 ? 50.680 78.485 42.074 1.00 70.02 ? 185 LYS A CE 1 ATOM 1474 N NZ . LYS A 1 186 ? 49.921 78.489 40.795 1.00 71.39 ? 185 LYS A NZ 1 ATOM 1475 N N . TYR A 1 187 ? 49.954 78.033 47.815 1.00 60.59 ? 186 TYR A N 1 ATOM 1476 C CA . TYR A 1 187 ? 49.666 79.434 48.148 1.00 58.57 ? 186 TYR A CA 1 ATOM 1477 C C . TYR A 1 187 ? 49.838 79.829 49.616 1.00 57.16 ? 186 TYR A C 1 ATOM 1478 O O . TYR A 1 187 ? 49.931 81.018 49.912 1.00 56.02 ? 186 TYR A O 1 ATOM 1479 C CB . TYR A 1 187 ? 48.251 79.805 47.681 1.00 57.72 ? 186 TYR A CB 1 ATOM 1480 C CG . TYR A 1 187 ? 48.119 79.931 46.181 1.00 58.57 ? 186 TYR A CG 1 ATOM 1481 C CD1 . TYR A 1 187 ? 48.718 80.985 45.498 1.00 59.02 ? 186 TYR A CD1 1 ATOM 1482 C CD2 . TYR A 1 187 ? 47.401 78.998 45.439 1.00 60.60 ? 186 TYR A CD2 1 ATOM 1483 C CE1 . TYR A 1 187 ? 48.602 81.112 44.122 1.00 60.23 ? 186 TYR A CE1 1 ATOM 1484 C CE2 . TYR A 1 187 ? 47.283 79.110 44.058 1.00 61.55 ? 186 TYR A CE2 1 ATOM 1485 C CZ . TYR A 1 187 ? 47.885 80.168 43.405 1.00 61.37 ? 186 TYR A CZ 1 ATOM 1486 O OH . TYR A 1 187 ? 47.763 80.283 42.046 1.00 61.29 ? 186 TYR A OH 1 ATOM 1487 N N . ILE A 1 188 ? 49.866 78.859 50.528 1.00 57.74 ? 187 ILE A N 1 ATOM 1488 C CA . ILE A 1 188 ? 49.926 79.159 51.960 1.00 56.83 ? 187 ILE A CA 1 ATOM 1489 C C . ILE A 1 188 ? 51.256 78.720 52.535 1.00 57.51 ? 187 ILE A C 1 ATOM 1490 O O . ILE A 1 188 ? 51.612 77.551 52.449 1.00 58.19 ? 187 ILE A O 1 ATOM 1491 C CB . ILE A 1 188 ? 48.789 78.459 52.731 1.00 56.51 ? 187 ILE A CB 1 ATOM 1492 C CG1 . ILE A 1 188 ? 47.420 78.875 52.174 1.00 55.74 ? 187 ILE A CG1 1 ATOM 1493 C CG2 . ILE A 1 188 ? 48.880 78.770 54.221 1.00 55.91 ? 187 ILE A CG2 1 ATOM 1494 C CD1 . ILE A 1 188 ? 47.101 80.349 52.317 1.00 54.76 ? 187 ILE A CD1 1 ATOM 1495 N N . ARG A 1 189 ? 51.974 79.657 53.141 1.00 58.26 ? 188 ARG A N 1 ATOM 1496 C CA . ARG A 1 189 ? 53.247 79.359 53.779 1.00 60.08 ? 188 ARG A CA 1 ATOM 1497 C C . ARG A 1 189 ? 53.026 78.864 55.200 1.00 59.22 ? 188 ARG A C 1 ATOM 1498 O O . ARG A 1 189 ? 53.615 77.873 55.607 1.00 59.54 ? 188 ARG A O 1 ATOM 1499 C CB . ARG A 1 189 ? 54.127 80.600 53.805 1.00 62.00 ? 188 ARG A CB 1 ATOM 1500 C CG . ARG A 1 189 ? 55.517 80.379 54.365 1.00 65.39 ? 188 ARG A CG 1 ATOM 1501 C CD . ARG A 1 189 ? 56.295 81.680 54.326 1.00 69.49 ? 188 ARG A CD 1 ATOM 1502 N NE . ARG A 1 189 ? 57.635 81.531 54.894 1.00 74.80 ? 188 ARG A NE 1 ATOM 1503 C CZ . ARG A 1 189 ? 58.784 81.664 54.237 1.00 80.24 ? 188 ARG A CZ 1 ATOM 1504 N NH1 . ARG A 1 189 ? 58.809 81.959 52.936 1.00 82.38 ? 188 ARG A NH1 1 ATOM 1505 N NH2 . ARG A 1 189 ? 59.927 81.502 54.899 1.00 83.54 ? 188 ARG A NH2 1 ATOM 1506 N N . ALA A 1 190 ? 52.175 79.554 55.946 1.00 57.23 ? 189 ALA A N 1 ATOM 1507 C CA . ALA A 1 190 ? 51.914 79.197 57.333 1.00 56.66 ? 189 ALA A CA 1 ATOM 1508 C C . ALA A 1 190 ? 50.665 79.909 57.811 1.00 54.18 ? 189 ALA A C 1 ATOM 1509 O O . ALA A 1 190 ? 50.220 80.875 57.192 1.00 52.90 ? 189 ALA A O 1 ATOM 1510 C CB . ALA A 1 190 ? 53.100 79.571 58.211 1.00 57.05 ? 189 ALA A CB 1 ATOM 1511 N N . PHE A 1 191 ? 50.116 79.405 58.912 1.00 52.41 ? 190 PHE A N 1 ATOM 1512 C CA . PHE A 1 191 ? 48.936 79.952 59.568 1.00 50.82 ? 190 PHE A CA 1 ATOM 1513 C C . PHE A 1 191 ? 49.350 80.174 61.021 1.00 51.61 ? 190 PHE A C 1 ATOM 1514 O O . PHE A 1 191 ? 49.670 79.218 61.736 1.00 52.22 ? 190 PHE A O 1 ATOM 1515 C CB . PHE A 1 191 ? 47.777 78.949 59.417 1.00 50.00 ? 190 PHE A CB 1 ATOM 1516 C CG . PHE A 1 191 ? 46.533 79.258 60.226 1.00 47.63 ? 190 PHE A CG 1 ATOM 1517 C CD1 . PHE A 1 191 ? 46.311 80.502 60.813 1.00 47.16 ? 190 PHE A CD1 1 ATOM 1518 C CD2 . PHE A 1 191 ? 45.553 78.286 60.361 1.00 46.94 ? 190 PHE A CD2 1 ATOM 1519 C CE1 . PHE A 1 191 ? 45.157 80.746 61.545 1.00 46.12 ? 190 PHE A CE1 1 ATOM 1520 C CE2 . PHE A 1 191 ? 44.394 78.527 61.086 1.00 46.47 ? 190 PHE A CE2 1 ATOM 1521 C CZ . PHE A 1 191 ? 44.194 79.760 61.680 1.00 45.61 ? 190 PHE A CZ 1 ATOM 1522 N N . VAL A 1 192 ? 49.413 81.446 61.418 1.00 52.09 ? 191 VAL A N 1 ATOM 1523 C CA . VAL A 1 192 ? 49.719 81.840 62.785 1.00 52.14 ? 191 VAL A CA 1 ATOM 1524 C C . VAL A 1 192 ? 48.387 82.147 63.459 1.00 51.22 ? 191 VAL A C 1 ATOM 1525 O O . VAL A 1 192 ? 47.673 83.079 63.068 1.00 50.05 ? 191 VAL A O 1 ATOM 1526 C CB . VAL A 1 192 ? 50.620 83.085 62.821 1.00 52.94 ? 191 VAL A CB 1 ATOM 1527 C CG1 . VAL A 1 192 ? 50.832 83.559 64.251 1.00 53.00 ? 191 VAL A CG1 1 ATOM 1528 C CG2 . VAL A 1 192 ? 51.955 82.786 62.141 1.00 54.75 ? 191 VAL A CG2 1 ATOM 1529 N N . SER A 1 193 ? 48.064 81.345 64.468 1.00 51.92 ? 192 SER A N 1 ATOM 1530 C CA . SER A 1 193 ? 46.760 81.340 65.094 1.00 51.42 ? 192 SER A CA 1 ATOM 1531 C C . SER A 1 193 ? 46.879 81.937 66.486 1.00 51.07 ? 192 SER A C 1 ATOM 1532 O O . SER A 1 193 ? 47.558 81.379 67.338 1.00 51.67 ? 192 SER A O 1 ATOM 1533 C CB . SER A 1 193 ? 46.260 79.900 65.172 1.00 52.60 ? 192 SER A CB 1 ATOM 1534 O OG . SER A 1 193 ? 44.975 79.841 65.747 1.00 53.33 ? 192 SER A OG 1 ATOM 1535 N N . LEU A 1 194 ? 46.234 83.078 66.704 1.00 50.80 ? 193 LEU A N 1 ATOM 1536 C CA . LEU A 1 194 ? 46.333 83.795 67.975 1.00 50.12 ? 193 LEU A CA 1 ATOM 1537 C C . LEU A 1 194 ? 45.022 83.750 68.738 1.00 48.01 ? 193 LEU A C 1 ATOM 1538 O O . LEU A 1 194 ? 44.018 84.347 68.318 1.00 46.86 ? 193 LEU A O 1 ATOM 1539 C CB . LEU A 1 194 ? 46.727 85.253 67.728 1.00 51.67 ? 193 LEU A CB 1 ATOM 1540 C CG . LEU A 1 194 ? 47.950 85.483 66.836 1.00 53.60 ? 193 LEU A CG 1 ATOM 1541 C CD1 . LEU A 1 194 ? 48.101 86.955 66.494 1.00 53.88 ? 193 LEU A CD1 1 ATOM 1542 C CD2 . LEU A 1 194 ? 49.207 84.956 67.502 1.00 55.68 ? 193 LEU A CD2 1 ATOM 1543 N N . GLY A 1 195 ? 45.014 83.045 69.868 1.00 48.30 ? 194 GLY A N 1 ATOM 1544 C CA . GLY A 1 195 ? 43.820 83.024 70.729 1.00 46.65 ? 194 GLY A CA 1 ATOM 1545 C C . GLY A 1 195 ? 42.596 82.388 70.086 1.00 44.28 ? 194 GLY A C 1 ATOM 1546 O O . GLY A 1 195 ? 41.480 82.894 70.199 1.00 42.22 ? 194 GLY A O 1 ATOM 1547 N N . ALA A 1 196 ? 42.808 81.262 69.413 1.00 43.92 ? 195 ALA A N 1 ATOM 1548 C CA . ALA A 1 196 ? 41.746 80.578 68.691 1.00 43.08 ? 195 ALA A CA 1 ATOM 1549 C C . ALA A 1 196 ? 40.773 79.847 69.625 1.00 42.90 ? 195 ALA A C 1 ATOM 1550 O O . ALA A 1 196 ? 41.203 79.014 70.437 1.00 44.41 ? 195 ALA A O 1 ATOM 1551 C CB . ALA A 1 196 ? 42.365 79.588 67.727 1.00 44.45 ? 195 ALA A CB 1 ATOM 1552 N N . PRO A 1 197 ? 39.459 80.115 69.483 1.00 42.71 ? 196 PRO A N 1 ATOM 1553 C CA . PRO A 1 197 ? 38.427 79.438 70.256 1.00 43.55 ? 196 PRO A CA 1 ATOM 1554 C C . PRO A 1 197 ? 37.968 78.149 69.574 1.00 46.02 ? 196 PRO A C 1 ATOM 1555 O O . PRO A 1 197 ? 36.787 77.998 69.260 1.00 48.07 ? 196 PRO A O 1 ATOM 1556 C CB . PRO A 1 197 ? 37.305 80.468 70.277 1.00 41.69 ? 196 PRO A CB 1 ATOM 1557 C CG . PRO A 1 197 ? 37.396 81.092 68.927 1.00 41.28 ? 196 PRO A CG 1 ATOM 1558 C CD . PRO A 1 197 ? 38.865 81.116 68.578 1.00 41.95 ? 196 PRO A CD 1 ATOM 1559 N N . TRP A 1 198 ? 38.907 77.235 69.332 1.00 47.86 ? 197 TRP A N 1 ATOM 1560 C CA . TRP A 1 198 ? 38.560 75.928 68.793 1.00 49.13 ? 197 TRP A CA 1 ATOM 1561 C C . TRP A 1 198 ? 37.552 75.308 69.763 1.00 51.43 ? 197 TRP A C 1 ATOM 1562 O O . TRP A 1 198 ? 37.694 75.427 70.990 1.00 52.63 ? 197 TRP A O 1 ATOM 1563 C CB . TRP A 1 198 ? 39.784 75.008 68.682 1.00 50.06 ? 197 TRP A CB 1 ATOM 1564 C CG . TRP A 1 198 ? 41.001 75.581 68.005 1.00 50.26 ? 197 TRP A CG 1 ATOM 1565 C CD1 . TRP A 1 198 ? 42.275 75.616 68.504 1.00 50.66 ? 197 TRP A CD1 1 ATOM 1566 C CD2 . TRP A 1 198 ? 41.064 76.191 66.712 1.00 48.88 ? 197 TRP A CD2 1 ATOM 1567 N NE1 . TRP A 1 198 ? 43.123 76.211 67.602 1.00 50.74 ? 197 TRP A NE1 1 ATOM 1568 C CE2 . TRP A 1 198 ? 42.406 76.567 66.491 1.00 49.63 ? 197 TRP A CE2 1 ATOM 1569 C CE3 . TRP A 1 198 ? 40.120 76.453 65.719 1.00 49.00 ? 197 TRP A CE3 1 ATOM 1570 C CZ2 . TRP A 1 198 ? 42.825 77.191 65.323 1.00 49.07 ? 197 TRP A CZ2 1 ATOM 1571 C CZ3 . TRP A 1 198 ? 40.536 77.076 64.554 1.00 49.70 ? 197 TRP A CZ3 1 ATOM 1572 C CH2 . TRP A 1 198 ? 41.881 77.439 64.369 1.00 49.47 ? 197 TRP A CH2 1 ATOM 1573 N N . GLY A 1 199 ? 36.510 74.689 69.227 1.00 52.19 ? 198 GLY A N 1 ATOM 1574 C CA . GLY A 1 199 ? 35.487 74.087 70.078 1.00 50.21 ? 198 GLY A CA 1 ATOM 1575 C C . GLY A 1 199 ? 34.650 75.048 70.913 1.00 47.50 ? 198 GLY A C 1 ATOM 1576 O O . GLY A 1 199 ? 33.961 74.616 71.814 1.00 47.02 ? 198 GLY A O 1 ATOM 1577 N N . GLY A 1 200 ? 34.688 76.343 70.615 1.00 46.44 ? 199 GLY A N 1 ATOM 1578 C CA . GLY A 1 200 ? 33.800 77.305 71.270 1.00 46.43 ? 199 GLY A CA 1 ATOM 1579 C C . GLY A 1 200 ? 34.306 77.748 72.632 1.00 46.72 ? 199 GLY A C 1 ATOM 1580 O O . GLY A 1 200 ? 35.315 77.242 73.122 1.00 48.69 ? 199 GLY A O 1 ATOM 1581 N N . VAL A 1 201 ? 33.617 78.711 73.232 1.00 46.13 ? 200 VAL A N 1 ATOM 1582 C CA . VAL A 1 201 ? 34.020 79.253 74.536 1.00 47.19 ? 200 VAL A CA 1 ATOM 1583 C C . VAL A 1 201 ? 32.844 79.270 75.508 1.00 43.93 ? 200 VAL A C 1 ATOM 1584 O O . VAL A 1 201 ? 31.716 79.562 75.115 1.00 41.24 ? 200 VAL A O 1 ATOM 1585 C CB . VAL A 1 201 ? 34.610 80.680 74.405 1.00 49.23 ? 200 VAL A CB 1 ATOM 1586 C CG1 . VAL A 1 201 ? 35.777 80.679 73.430 1.00 52.73 ? 200 VAL A CG1 1 ATOM 1587 C CG2 . VAL A 1 201 ? 33.570 81.679 73.944 1.00 48.97 ? 200 VAL A CG2 1 ATOM 1588 N N . ALA A 1 202 ? 33.111 78.971 76.775 1.00 43.94 ? 201 ALA A N 1 ATOM 1589 C CA . ALA A 1 202 ? 32.049 78.843 77.757 1.00 44.69 ? 201 ALA A CA 1 ATOM 1590 C C . ALA A 1 202 ? 31.308 80.158 77.967 1.00 45.38 ? 201 ALA A C 1 ATOM 1591 O O . ALA A 1 202 ? 30.103 80.178 78.211 1.00 45.10 ? 201 ALA A O 1 ATOM 1592 C CB . ALA A 1 202 ? 32.618 78.354 79.074 1.00 45.41 ? 201 ALA A CB 1 ATOM 1593 N N . LYS A 1 203 ? 32.017 81.276 77.866 1.00 47.76 ? 202 LYS A N 1 ATOM 1594 C CA . LYS A 1 203 ? 31.376 82.562 78.183 1.00 50.30 ? 202 LYS A CA 1 ATOM 1595 C C . LYS A 1 203 ? 30.245 82.959 77.231 1.00 50.30 ? 202 LYS A C 1 ATOM 1596 O O . LYS A 1 203 ? 29.470 83.852 77.550 1.00 50.26 ? 202 LYS A O 1 ATOM 1597 C CB . LYS A 1 203 ? 32.401 83.703 78.270 1.00 54.26 ? 202 LYS A CB 1 ATOM 1598 C CG . LYS A 1 203 ? 32.621 84.487 76.977 1.00 59.23 ? 202 LYS A CG 1 ATOM 1599 C CD . LYS A 1 203 ? 33.842 85.394 77.065 1.00 63.64 ? 202 LYS A CD 1 ATOM 1600 C CE . LYS A 1 203 ? 33.669 86.528 78.068 1.00 66.21 ? 202 LYS A CE 1 ATOM 1601 N NZ . LYS A 1 203 ? 34.971 86.902 78.687 1.00 68.86 ? 202 LYS A NZ 1 ATOM 1602 N N . THR A 1 204 ? 30.146 82.313 76.069 1.00 48.61 ? 203 THR A N 1 ATOM 1603 C CA . THR A 1 204 ? 29.032 82.520 75.142 1.00 45.51 ? 203 THR A CA 1 ATOM 1604 C C . THR A 1 204 ? 27.665 82.283 75.808 1.00 43.36 ? 203 THR A C 1 ATOM 1605 O O . THR A 1 204 ? 26.693 82.949 75.481 1.00 43.07 ? 203 THR A O 1 ATOM 1606 C CB . THR A 1 204 ? 29.158 81.595 73.900 1.00 45.52 ? 203 THR A CB 1 ATOM 1607 O OG1 . THR A 1 204 ? 30.439 81.761 73.295 1.00 44.50 ? 203 THR A OG1 1 ATOM 1608 C CG2 . THR A 1 204 ? 28.117 81.912 72.882 1.00 45.51 ? 203 THR A CG2 1 ATOM 1609 N N . LEU A 1 205 ? 27.587 81.361 76.754 1.00 43.43 ? 204 LEU A N 1 ATOM 1610 C CA . LEU A 1 205 ? 26.331 81.140 77.455 1.00 43.39 ? 204 LEU A CA 1 ATOM 1611 C C . LEU A 1 205 ? 25.876 82.375 78.242 1.00 43.65 ? 204 LEU A C 1 ATOM 1612 O O . LEU A 1 205 ? 24.710 82.736 78.222 1.00 43.68 ? 204 LEU A O 1 ATOM 1613 C CB . LEU A 1 205 ? 26.434 79.883 78.317 1.00 44.31 ? 204 LEU A CB 1 ATOM 1614 C CG . LEU A 1 205 ? 26.417 78.662 77.370 1.00 45.48 ? 204 LEU A CG 1 ATOM 1615 C CD1 . LEU A 1 205 ? 27.582 77.704 77.558 1.00 45.82 ? 204 LEU A CD1 1 ATOM 1616 C CD2 . LEU A 1 205 ? 25.078 77.949 77.451 1.00 46.38 ? 204 LEU A CD2 1 ATOM 1617 N N . ARG A 1 206 ? 26.796 83.032 78.926 1.00 43.53 ? 205 ARG A N 1 ATOM 1618 C CA . ARG A 1 206 ? 26.471 84.244 79.670 1.00 45.96 ? 205 ARG A CA 1 ATOM 1619 C C . ARG A 1 206 ? 26.094 85.380 78.716 1.00 43.62 ? 205 ARG A C 1 ATOM 1620 O O . ARG A 1 206 ? 25.176 86.122 78.977 1.00 43.13 ? 205 ARG A O 1 ATOM 1621 C CB . ARG A 1 206 ? 27.660 84.643 80.548 1.00 51.31 ? 205 ARG A CB 1 ATOM 1622 C CG . ARG A 1 206 ? 27.504 85.953 81.305 1.00 56.97 ? 205 ARG A CG 1 ATOM 1623 C CD . ARG A 1 206 ? 28.830 86.324 81.944 1.00 65.39 ? 205 ARG A CD 1 ATOM 1624 N NE . ARG A 1 206 ? 28.619 87.317 82.986 1.00 71.34 ? 205 ARG A NE 1 ATOM 1625 C CZ . ARG A 1 206 ? 28.563 88.633 82.787 1.00 75.83 ? 205 ARG A CZ 1 ATOM 1626 N NH1 . ARG A 1 206 ? 28.742 89.164 81.574 1.00 80.38 ? 205 ARG A NH1 1 ATOM 1627 N NH2 . ARG A 1 206 ? 28.342 89.431 83.821 1.00 78.69 ? 205 ARG A NH2 1 ATOM 1628 N N . VAL A 1 207 ? 26.832 85.509 77.620 1.00 41.19 ? 206 VAL A N 1 ATOM 1629 C CA . VAL A 1 207 ? 26.537 86.525 76.604 1.00 41.28 ? 206 VAL A CA 1 ATOM 1630 C C . VAL A 1 207 ? 25.087 86.408 76.145 1.00 41.71 ? 206 VAL A C 1 ATOM 1631 O O . VAL A 1 207 ? 24.341 87.394 76.163 1.00 43.57 ? 206 VAL A O 1 ATOM 1632 C CB . VAL A 1 207 ? 27.453 86.377 75.355 1.00 40.74 ? 206 VAL A CB 1 ATOM 1633 C CG1 . VAL A 1 207 ? 26.952 87.238 74.205 1.00 41.00 ? 206 VAL A CG1 1 ATOM 1634 C CG2 . VAL A 1 207 ? 28.895 86.737 75.686 1.00 39.95 ? 206 VAL A CG2 1 ATOM 1635 N N . LEU A 1 208 ? 24.669 85.196 75.774 1.00 40.17 ? 207 LEU A N 1 ATOM 1636 C CA . LEU A 1 208 ? 23.313 84.972 75.281 1.00 40.81 ? 207 LEU A CA 1 ATOM 1637 C C . LEU A 1 208 ? 22.241 85.122 76.368 1.00 41.84 ? 207 LEU A C 1 ATOM 1638 O O . LEU A 1 208 ? 21.177 85.687 76.111 1.00 43.11 ? 207 LEU A O 1 ATOM 1639 C CB . LEU A 1 208 ? 23.209 83.594 74.628 1.00 41.34 ? 207 LEU A CB 1 ATOM 1640 C CG . LEU A 1 208 ? 23.996 83.459 73.318 1.00 41.29 ? 207 LEU A CG 1 ATOM 1641 C CD1 . LEU A 1 208 ? 24.216 81.999 72.974 1.00 42.38 ? 207 LEU A CD1 1 ATOM 1642 C CD2 . LEU A 1 208 ? 23.278 84.169 72.183 1.00 41.90 ? 207 LEU A CD2 1 ATOM 1643 N N . ALA A 1 209 ? 22.533 84.646 77.576 1.00 41.80 ? 208 ALA A N 1 ATOM 1644 C CA . ALA A 1 209 ? 21.556 84.710 78.660 1.00 42.78 ? 208 ALA A CA 1 ATOM 1645 C C . ALA A 1 209 ? 21.332 86.149 79.139 1.00 43.85 ? 208 ALA A C 1 ATOM 1646 O O . ALA A 1 209 ? 20.201 86.622 79.169 1.00 43.97 ? 208 ALA A O 1 ATOM 1647 C CB . ALA A 1 209 ? 21.982 83.817 79.821 1.00 43.48 ? 208 ALA A CB 1 ATOM 1648 N N . SER A 1 210 ? 22.406 86.840 79.498 1.00 43.80 ? 209 SER A N 1 ATOM 1649 C CA . SER A 1 210 ? 22.287 88.094 80.237 1.00 45.71 ? 209 SER A CA 1 ATOM 1650 C C . SER A 1 210 ? 23.095 89.274 79.660 1.00 47.47 ? 209 SER A C 1 ATOM 1651 O O . SER A 1 210 ? 23.061 90.382 80.211 1.00 49.03 ? 209 SER A O 1 ATOM 1652 C CB . SER A 1 210 ? 22.629 87.833 81.720 1.00 45.78 ? 209 SER A CB 1 ATOM 1653 O OG . SER A 1 210 ? 23.827 87.117 81.864 1.00 46.87 ? 209 SER A OG 1 ATOM 1654 N N . GLY A 1 211 ? 23.785 89.058 78.540 1.00 47.71 ? 210 GLY A N 1 ATOM 1655 C CA . GLY A 1 211 ? 24.571 90.115 77.890 1.00 48.29 ? 210 GLY A CA 1 ATOM 1656 C C . GLY A 1 211 ? 25.965 90.232 78.486 1.00 50.32 ? 210 GLY A C 1 ATOM 1657 O O . GLY A 1 211 ? 26.187 89.852 79.619 1.00 55.74 ? 210 GLY A O 1 ATOM 1658 N N . ASP A 1 212 ? 26.902 90.757 77.709 1.00 52.50 ? 211 ASP A N 1 ATOM 1659 C CA . ASP A 1 212 ? 28.280 90.935 78.162 1.00 54.16 ? 211 ASP A CA 1 ATOM 1660 C C . ASP A 1 212 ? 28.809 92.264 77.641 1.00 53.41 ? 211 ASP A C 1 ATOM 1661 O O . ASP A 1 212 ? 29.079 92.419 76.449 1.00 49.08 ? 211 ASP A O 1 ATOM 1662 C CB . ASP A 1 212 ? 29.164 89.797 77.657 1.00 57.69 ? 211 ASP A CB 1 ATOM 1663 C CG . ASP A 1 212 ? 30.557 89.812 78.281 1.00 61.82 ? 211 ASP A CG 1 ATOM 1664 O OD1 . ASP A 1 212 ? 31.039 90.893 78.690 1.00 64.71 ? 211 ASP A OD1 1 ATOM 1665 O OD2 . ASP A 1 212 ? 31.181 88.735 78.361 1.00 66.84 ? 211 ASP A OD2 1 ATOM 1666 N N . ASN A 1 213 ? 28.940 93.240 78.535 1.00 55.86 ? 212 ASN A N 1 ATOM 1667 C CA . ASN A 1 213 ? 29.409 94.580 78.148 1.00 57.37 ? 212 ASN A CA 1 ATOM 1668 C C . ASN A 1 213 ? 30.854 94.834 78.470 1.00 59.97 ? 212 ASN A C 1 ATOM 1669 O O . ASN A 1 213 ? 31.315 95.960 78.284 1.00 60.63 ? 212 ASN A O 1 ATOM 1670 C CB . ASN A 1 213 ? 28.543 95.673 78.768 1.00 58.37 ? 212 ASN A CB 1 ATOM 1671 C CG . ASN A 1 213 ? 28.722 95.787 80.262 1.00 59.61 ? 212 ASN A CG 1 ATOM 1672 O OD1 . ASN A 1 213 ? 29.559 95.112 80.855 1.00 59.60 ? 212 ASN A OD1 1 ATOM 1673 N ND2 . ASN A 1 213 ? 27.922 96.641 80.885 1.00 61.77 ? 212 ASN A ND2 1 ATOM 1674 N N . ASN A 1 214 ? 31.584 93.831 78.955 1.00 62.75 ? 213 ASN A N 1 ATOM 1675 C CA . ASN A 1 214 ? 32.973 94.054 79.416 1.00 67.99 ? 213 ASN A CA 1 ATOM 1676 C C . ASN A 1 214 ? 33.871 94.728 78.351 1.00 68.48 ? 213 ASN A C 1 ATOM 1677 O O . ASN A 1 214 ? 34.857 95.423 78.660 1.00 67.04 ? 213 ASN A O 1 ATOM 1678 C CB . ASN A 1 214 ? 33.618 92.754 79.961 1.00 69.41 ? 213 ASN A CB 1 ATOM 1679 C CG . ASN A 1 214 ? 34.458 92.008 78.917 1.00 71.92 ? 213 ASN A CG 1 ATOM 1680 O OD1 . ASN A 1 214 ? 35.685 92.143 78.872 1.00 74.76 ? 213 ASN A OD1 1 ATOM 1681 N ND2 . ASN A 1 214 ? 33.798 91.211 78.079 1.00 70.51 ? 213 ASN A ND2 1 ATOM 1682 N N . ARG A 1 215 ? 33.513 94.520 77.094 1.00 72.10 ? 214 ARG A N 1 ATOM 1683 C CA . ARG A 1 215 ? 34.286 95.121 76.002 1.00 77.21 ? 214 ARG A CA 1 ATOM 1684 C C . ARG A 1 215 ? 33.841 96.547 75.700 1.00 78.31 ? 214 ARG A C 1 ATOM 1685 O O . ARG A 1 215 ? 34.589 97.318 75.108 1.00 76.83 ? 214 ARG A O 1 ATOM 1686 C CB . ARG A 1 215 ? 34.235 94.270 74.722 1.00 83.14 ? 214 ARG A CB 1 ATOM 1687 C CG . ARG A 1 215 ? 35.031 92.967 74.766 1.00 88.03 ? 214 ARG A CG 1 ATOM 1688 C CD . ARG A 1 215 ? 36.532 93.195 74.895 1.00 92.52 ? 214 ARG A CD 1 ATOM 1689 N NE . ARG A 1 215 ? 37.229 92.000 75.383 1.00 95.70 ? 214 ARG A NE 1 ATOM 1690 C CZ . ARG A 1 215 ? 38.415 92.005 75.998 1.00 92.79 ? 214 ARG A CZ 1 ATOM 1691 N NH1 . ARG A 1 215 ? 39.077 93.143 76.211 1.00 91.63 ? 214 ARG A NH1 1 ATOM 1692 N NH2 . ARG A 1 215 ? 38.950 90.860 76.399 1.00 87.76 ? 214 ARG A NH2 1 ATOM 1693 N N . ILE A 1 216 ? 32.590 96.869 76.042 1.00 79.46 ? 215 ILE A N 1 ATOM 1694 C CA . ILE A 1 216 ? 32.016 98.185 75.763 1.00 77.32 ? 215 ILE A CA 1 ATOM 1695 C C . ILE A 1 216 ? 31.054 98.635 76.913 1.00 71.68 ? 215 ILE A C 1 ATOM 1696 O O . ILE A 1 216 ? 29.801 98.554 76.831 1.00 69.83 ? 215 ILE A O 1 ATOM 1697 C CB . ILE A 1 216 ? 31.485 98.187 74.295 1.00 79.48 ? 215 ILE A CB 1 ATOM 1698 C CG1 . ILE A 1 216 ? 31.120 99.595 73.819 1.00 81.68 ? 215 ILE A CG1 1 ATOM 1699 C CG2 . ILE A 1 216 ? 30.347 97.202 74.078 1.00 80.44 ? 215 ILE A CG2 1 ATOM 1700 C CD1 . ILE A 1 216 ? 32.314 100.431 73.410 1.00 82.02 ? 215 ILE A CD1 1 ATOM 1701 N N . PRO A 1 217 ? 31.678 99.070 78.037 1.00 70.64 ? 216 PRO A N 1 ATOM 1702 C CA . PRO A 1 217 ? 30.992 99.348 79.295 1.00 68.63 ? 216 PRO A CA 1 ATOM 1703 C C . PRO A 1 217 ? 30.029 100.525 79.267 1.00 69.13 ? 216 PRO A C 1 ATOM 1704 O O . PRO A 1 217 ? 29.232 100.672 80.180 1.00 69.02 ? 216 PRO A O 1 ATOM 1705 C CB . PRO A 1 217 ? 32.137 99.636 80.284 1.00 69.13 ? 216 PRO A CB 1 ATOM 1706 C CG . PRO A 1 217 ? 33.375 99.131 79.637 1.00 69.51 ? 216 PRO A CG 1 ATOM 1707 C CD . PRO A 1 217 ? 33.135 99.266 78.162 1.00 70.49 ? 216 PRO A CD 1 ATOM 1708 N N . VAL A 1 218 ? 30.092 101.369 78.238 1.00 74.05 ? 217 VAL A N 1 ATOM 1709 C CA . VAL A 1 218 ? 29.123 102.441 78.062 1.00 75.88 ? 217 VAL A CA 1 ATOM 1710 C C . VAL A 1 218 ? 27.748 101.901 77.600 1.00 72.10 ? 217 VAL A C 1 ATOM 1711 O O . VAL A 1 218 ? 26.765 102.644 77.642 1.00 71.33 ? 217 VAL A O 1 ATOM 1712 C CB . VAL A 1 218 ? 29.602 103.470 76.999 1.00 79.37 ? 217 VAL A CB 1 ATOM 1713 C CG1 . VAL A 1 218 ? 28.773 104.758 77.064 1.00 81.86 ? 217 VAL A CG1 1 ATOM 1714 C CG2 . VAL A 1 218 ? 31.088 103.779 77.169 1.00 82.48 ? 217 VAL A CG2 1 ATOM 1715 N N . ILE A 1 219 ? 27.696 100.621 77.185 1.00 67.40 ? 218 ILE A N 1 ATOM 1716 C CA . ILE A 1 219 ? 26.443 99.975 76.902 1.00 64.02 ? 218 ILE A CA 1 ATOM 1717 C C . ILE A 1 219 ? 26.078 99.040 78.065 1.00 61.43 ? 218 ILE A C 1 ATOM 1718 O O . ILE A 1 219 ? 26.797 98.149 78.470 1.00 63.53 ? 218 ILE A O 1 ATOM 1719 C CB . ILE A 1 219 ? 26.504 99.192 75.580 1.00 64.94 ? 218 ILE A CB 1 ATOM 1720 C CG1 . ILE A 1 219 ? 27.262 100.007 74.521 1.00 66.05 ? 218 ILE A CG1 1 ATOM 1721 C CG2 . ILE A 1 219 ? 25.098 98.875 75.103 1.00 64.92 ? 218 ILE A CG2 1 ATOM 1722 C CD1 . ILE A 1 219 ? 27.442 99.302 73.196 1.00 64.71 ? 218 ILE A CD1 1 ATOM 1723 N N . GLY A 1 220 ? 24.857 99.249 78.547 1.00 59.62 ? 219 GLY A N 1 ATOM 1724 C CA . GLY A 1 220 ? 24.236 98.370 79.561 1.00 59.70 ? 219 GLY A CA 1 ATOM 1725 C C . GLY A 1 220 ? 24.067 96.939 79.045 1.00 58.82 ? 219 GLY A C 1 ATOM 1726 O O . GLY A 1 220 ? 23.863 96.755 77.918 1.00 54.68 ? 219 GLY A O 1 ATOM 1727 N N . PRO A 1 221 ? 24.263 95.960 79.903 1.00 58.06 ? 220 PRO A N 1 ATOM 1728 C CA . PRO A 1 221 ? 24.299 94.571 79.470 1.00 55.81 ? 220 PRO A CA 1 ATOM 1729 C C . PRO A 1 221 ? 23.035 94.096 78.771 1.00 54.90 ? 220 PRO A C 1 ATOM 1730 O O . PRO A 1 221 ? 23.124 93.383 77.771 1.00 52.37 ? 220 PRO A O 1 ATOM 1731 C CB . PRO A 1 221 ? 24.482 93.789 80.783 1.00 56.59 ? 220 PRO A CB 1 ATOM 1732 C CG . PRO A 1 221 ? 24.029 94.713 81.863 1.00 57.62 ? 220 PRO A CG 1 ATOM 1733 C CD . PRO A 1 221 ? 24.385 96.083 81.369 1.00 58.17 ? 220 PRO A CD 1 ATOM 1734 N N . LEU A 1 222 ? 21.880 94.487 79.284 1.00 57.42 ? 221 LEU A N 1 ATOM 1735 C CA . LEU A 1 222 ? 20.597 93.994 78.674 1.00 58.63 ? 221 LEU A CA 1 ATOM 1736 C C . LEU A 1 222 ? 20.334 94.635 77.315 1.00 58.04 ? 221 LEU A C 1 ATOM 1737 O O . LEU A 1 222 ? 19.653 94.059 76.465 1.00 57.98 ? 221 LEU A O 1 ATOM 1738 C CB . LEU A 1 222 ? 19.380 94.239 79.574 1.00 59.86 ? 221 LEU A CB 1 ATOM 1739 C CG . LEU A 1 222 ? 19.296 93.474 80.891 1.00 62.03 ? 221 LEU A CG 1 ATOM 1740 C CD1 . LEU A 1 222 ? 17.964 93.765 81.568 1.00 63.61 ? 221 LEU A CD1 1 ATOM 1741 C CD2 . LEU A 1 222 ? 19.475 91.973 80.704 1.00 62.63 ? 221 LEU A CD2 1 ATOM 1742 N N . LYS A 1 223 ? 20.884 95.828 77.120 1.00 58.38 ? 222 LYS A N 1 ATOM 1743 C CA . LYS A 1 223 ? 20.746 96.533 75.839 1.00 58.45 ? 222 LYS A CA 1 ATOM 1744 C C . LYS A 1 223 ? 21.640 95.889 74.787 1.00 56.32 ? 222 LYS A C 1 ATOM 1745 O O . LYS A 1 223 ? 21.192 95.553 73.721 1.00 56.44 ? 222 LYS A O 1 ATOM 1746 C CB . LYS A 1 223 ? 21.062 98.036 75.979 1.00 59.90 ? 222 LYS A CB 1 ATOM 1747 C CG . LYS A 1 223 ? 19.872 98.874 76.430 1.00 63.62 ? 222 LYS A CG 1 ATOM 1748 C CD . LYS A 1 223 ? 18.853 99.007 75.309 1.00 65.77 ? 222 LYS A CD 1 ATOM 1749 C CE . LYS A 1 223 ? 17.417 98.919 75.798 1.00 66.90 ? 222 LYS A CE 1 ATOM 1750 N NZ . LYS A 1 223 ? 16.995 100.207 76.396 1.00 70.13 ? 222 LYS A NZ 1 ATOM 1751 N N . ILE A 1 224 ? 22.910 95.682 75.106 1.00 52.18 ? 223 ILE A N 1 ATOM 1752 C CA . ILE A 1 224 ? 23.863 95.076 74.168 1.00 50.43 ? 223 ILE A CA 1 ATOM 1753 C C . ILE A 1 224 ? 23.561 93.603 73.910 1.00 50.79 ? 223 ILE A C 1 ATOM 1754 O O . ILE A 1 224 ? 23.913 93.093 72.864 1.00 49.27 ? 223 ILE A O 1 ATOM 1755 C CB . ILE A 1 224 ? 25.336 95.236 74.645 1.00 50.52 ? 223 ILE A CB 1 ATOM 1756 C CG1 . ILE A 1 224 ? 26.308 95.038 73.462 1.00 51.42 ? 223 ILE A CG1 1 ATOM 1757 C CG2 . ILE A 1 224 ? 25.666 94.280 75.785 1.00 50.29 ? 223 ILE A CG2 1 ATOM 1758 C CD1 . ILE A 1 224 ? 27.763 94.846 73.854 1.00 50.47 ? 223 ILE A CD1 1 ATOM 1759 N N . ARG A 1 225 ? 22.888 92.929 74.837 1.00 49.75 ? 224 ARG A N 1 ATOM 1760 C CA . ARG A 1 225 ? 22.459 91.531 74.634 1.00 46.95 ? 224 ARG A CA 1 ATOM 1761 C C . ARG A 1 225 ? 21.635 91.407 73.344 1.00 46.99 ? 224 ARG A C 1 ATOM 1762 O O . ARG A 1 225 ? 21.710 90.401 72.641 1.00 43.99 ? 224 ARG A O 1 ATOM 1763 C CB . ARG A 1 225 ? 21.635 91.037 75.832 1.00 46.26 ? 224 ARG A CB 1 ATOM 1764 C CG . ARG A 1 225 ? 21.294 89.560 75.799 1.00 45.14 ? 224 ARG A CG 1 ATOM 1765 C CD . ARG A 1 225 ? 20.481 89.152 77.006 1.00 45.62 ? 224 ARG A CD 1 ATOM 1766 N NE . ARG A 1 225 ? 19.156 89.755 76.998 1.00 47.10 ? 224 ARG A NE 1 ATOM 1767 C CZ . ARG A 1 225 ? 18.253 89.602 77.962 1.00 47.04 ? 224 ARG A CZ 1 ATOM 1768 N NH1 . ARG A 1 225 ? 18.522 88.870 79.033 1.00 47.62 ? 224 ARG A NH1 1 ATOM 1769 N NH2 . ARG A 1 225 ? 17.075 90.192 77.862 1.00 47.49 ? 224 ARG A NH2 1 ATOM 1770 N N . GLU A 1 226 ? 20.831 92.424 73.054 1.00 49.26 ? 225 GLU A N 1 ATOM 1771 C CA . GLU A 1 226 ? 20.000 92.422 71.843 1.00 51.73 ? 225 GLU A CA 1 ATOM 1772 C C . GLU A 1 226 ? 20.842 92.283 70.587 1.00 48.69 ? 225 GLU A C 1 ATOM 1773 O O . GLU A 1 226 ? 20.502 91.506 69.720 1.00 46.44 ? 225 GLU A O 1 ATOM 1774 C CB . GLU A 1 226 ? 19.101 93.672 71.754 1.00 57.74 ? 225 GLU A CB 1 ATOM 1775 C CG . GLU A 1 226 ? 17.926 93.669 72.728 1.00 64.33 ? 225 GLU A CG 1 ATOM 1776 C CD . GLU A 1 226 ? 17.135 94.983 72.735 1.00 73.73 ? 225 GLU A CD 1 ATOM 1777 O OE1 . GLU A 1 226 ? 16.512 95.313 71.698 1.00 80.28 ? 225 GLU A OE1 1 ATOM 1778 O OE2 . GLU A 1 226 ? 17.111 95.684 73.782 1.00 75.43 ? 225 GLU A OE2 1 ATOM 1779 N N . GLN A 1 227 ? 21.945 93.011 70.493 1.00 46.59 ? 226 GLN A N 1 ATOM 1780 C CA . GLN A 1 227 ? 22.847 92.882 69.351 1.00 47.43 ? 226 GLN A CA 1 ATOM 1781 C C . GLN A 1 227 ? 23.542 91.524 69.351 1.00 46.90 ? 226 GLN A C 1 ATOM 1782 O O . GLN A 1 227 ? 23.664 90.874 68.348 1.00 47.26 ? 226 GLN A O 1 ATOM 1783 C CB . GLN A 1 227 ? 23.917 93.986 69.419 1.00 47.01 ? 226 GLN A CB 1 ATOM 1784 C CG . GLN A 1 227 ? 24.882 94.036 68.240 1.00 46.04 ? 226 GLN A CG 1 ATOM 1785 C CD . GLN A 1 227 ? 26.089 93.117 68.393 1.00 45.86 ? 226 GLN A CD 1 ATOM 1786 O OE1 . GLN A 1 227 ? 26.642 92.956 69.487 1.00 45.27 ? 226 GLN A OE1 1 ATOM 1787 N NE2 . GLN A 1 227 ? 26.501 92.505 67.288 1.00 43.79 ? 226 GLN A NE2 1 ATOM 1788 N N . GLN A 1 228 ? 24.020 91.118 70.518 1.00 46.01 ? 227 GLN A N 1 ATOM 1789 C CA . GLN A 1 228 ? 24.827 89.897 70.633 1.00 43.90 ? 227 GLN A CA 1 ATOM 1790 C C . GLN A 1 228 ? 24.009 88.669 70.271 1.00 43.33 ? 227 GLN A C 1 ATOM 1791 O O . GLN A 1 228 ? 24.502 87.793 69.616 1.00 42.85 ? 227 GLN A O 1 ATOM 1792 C CB . GLN A 1 228 ? 25.428 89.780 72.033 1.00 43.76 ? 227 GLN A CB 1 ATOM 1793 C CG . GLN A 1 228 ? 26.465 90.857 72.308 1.00 44.91 ? 227 GLN A CG 1 ATOM 1794 C CD . GLN A 1 228 ? 26.883 90.942 73.764 1.00 46.42 ? 227 GLN A CD 1 ATOM 1795 O OE1 . GLN A 1 228 ? 26.071 90.797 74.686 1.00 48.70 ? 227 GLN A OE1 1 ATOM 1796 N NE2 . GLN A 1 228 ? 28.150 91.234 73.978 1.00 47.00 ? 227 GLN A NE2 1 ATOM 1797 N N . ARG A 1 229 ? 22.738 88.630 70.659 1.00 41.90 ? 228 ARG A N 1 ATOM 1798 C CA . ARG A 1 229 ? 21.865 87.525 70.287 1.00 42.29 ? 228 ARG A CA 1 ATOM 1799 C C . ARG A 1 229 ? 21.613 87.502 68.785 1.00 44.43 ? 228 ARG A C 1 ATOM 1800 O O . ARG A 1 229 ? 21.514 86.402 68.196 1.00 45.62 ? 228 ARG A O 1 ATOM 1801 C CB . ARG A 1 229 ? 20.521 87.623 71.016 1.00 41.95 ? 228 ARG A CB 1 ATOM 1802 C CG . ARG A 1 229 ? 20.589 87.241 72.481 1.00 41.52 ? 228 ARG A CG 1 ATOM 1803 C CD . ARG A 1 229 ? 19.240 87.389 73.159 1.00 40.83 ? 228 ARG A CD 1 ATOM 1804 N NE . ARG A 1 229 ? 19.276 86.907 74.535 1.00 40.69 ? 228 ARG A NE 1 ATOM 1805 C CZ . ARG A 1 229 ? 18.220 86.844 75.340 1.00 42.76 ? 228 ARG A CZ 1 ATOM 1806 N NH1 . ARG A 1 229 ? 17.035 87.247 74.916 1.00 43.91 ? 228 ARG A NH1 1 ATOM 1807 N NH2 . ARG A 1 229 ? 18.341 86.368 76.578 1.00 43.75 ? 228 ARG A NH2 1 ATOM 1808 N N . SER A 1 230 ? 21.459 88.689 68.180 1.00 43.88 ? 229 SER A N 1 ATOM 1809 C CA . SER A 1 230 ? 21.082 88.769 66.781 1.00 44.58 ? 229 SER A CA 1 ATOM 1810 C C . SER A 1 230 ? 22.192 88.325 65.826 1.00 45.11 ? 229 SER A C 1 ATOM 1811 O O . SER A 1 230 ? 21.941 87.951 64.681 1.00 46.81 ? 229 SER A O 1 ATOM 1812 C CB . SER A 1 230 ? 20.607 90.179 66.431 1.00 44.17 ? 229 SER A CB 1 ATOM 1813 O OG . SER A 1 230 ? 21.682 91.102 66.427 1.00 44.59 ? 229 SER A OG 1 ATOM 1814 N N . ALA A 1 231 ? 23.427 88.368 66.319 1.00 44.78 ? 230 ALA A N 1 ATOM 1815 C CA . ALA A 1 231 ? 24.594 87.969 65.583 1.00 44.00 ? 230 ALA A CA 1 ATOM 1816 C C . ALA A 1 231 ? 24.736 86.453 65.564 1.00 43.74 ? 230 ALA A C 1 ATOM 1817 O O . ALA A 1 231 ? 24.979 85.825 66.587 1.00 42.87 ? 230 ALA A O 1 ATOM 1818 C CB . ALA A 1 231 ? 25.852 88.600 66.168 1.00 43.66 ? 230 ALA A CB 1 ATOM 1819 N N . VAL A 1 232 ? 24.632 85.877 64.373 1.00 44.29 ? 231 VAL A N 1 ATOM 1820 C CA . VAL A 1 232 ? 24.779 84.430 64.200 1.00 43.92 ? 231 VAL A CA 1 ATOM 1821 C C . VAL A 1 232 ? 26.114 83.933 64.771 1.00 42.97 ? 231 VAL A C 1 ATOM 1822 O O . VAL A 1 232 ? 26.196 82.827 65.341 1.00 45.21 ? 231 VAL A O 1 ATOM 1823 C CB . VAL A 1 232 ? 24.621 84.007 62.729 1.00 44.73 ? 231 VAL A CB 1 ATOM 1824 C CG1 . VAL A 1 232 ? 24.690 82.492 62.597 1.00 44.70 ? 231 VAL A CG1 1 ATOM 1825 C CG2 . VAL A 1 232 ? 23.302 84.519 62.176 1.00 45.72 ? 231 VAL A CG2 1 ATOM 1826 N N . SER A 1 233 ? 27.160 84.743 64.641 1.00 41.43 ? 232 SER A N 1 ATOM 1827 C CA . SER A 1 233 ? 28.486 84.348 65.103 1.00 40.66 ? 232 SER A CA 1 ATOM 1828 C C . SER A 1 233 ? 28.535 84.034 66.607 1.00 39.35 ? 232 SER A C 1 ATOM 1829 O O . SER A 1 233 ? 29.347 83.228 67.043 1.00 39.41 ? 232 SER A O 1 ATOM 1830 C CB . SER A 1 233 ? 29.510 85.438 64.773 1.00 40.49 ? 232 SER A CB 1 ATOM 1831 O OG . SER A 1 233 ? 29.034 86.716 65.155 1.00 40.16 ? 232 SER A OG 1 ATOM 1832 N N . THR A 1 234 ? 27.658 84.644 67.393 1.00 38.56 ? 233 THR A N 1 ATOM 1833 C CA . THR A 1 234 ? 27.601 84.340 68.826 1.00 39.00 ? 233 THR A CA 1 ATOM 1834 C C . THR A 1 234 ? 27.186 82.886 69.097 1.00 39.99 ? 233 THR A C 1 ATOM 1835 O O . THR A 1 234 ? 27.864 82.159 69.826 1.00 40.78 ? 233 THR A O 1 ATOM 1836 C CB . THR A 1 234 ? 26.636 85.280 69.587 1.00 39.45 ? 233 THR A CB 1 ATOM 1837 O OG1 . THR A 1 234 ? 26.944 86.657 69.302 1.00 38.45 ? 233 THR A OG1 1 ATOM 1838 C CG2 . THR A 1 234 ? 26.739 85.037 71.090 1.00 39.57 ? 233 THR A CG2 1 ATOM 1839 N N . SER A 1 235 ? 26.092 82.448 68.485 1.00 41.18 ? 234 SER A N 1 ATOM 1840 C CA . SER A 1 235 ? 25.619 81.073 68.644 1.00 42.82 ? 234 SER A CA 1 ATOM 1841 C C . SER A 1 235 ? 26.577 80.043 68.041 1.00 43.42 ? 234 SER A C 1 ATOM 1842 O O . SER A 1 235 ? 26.705 78.933 68.534 1.00 44.90 ? 234 SER A O 1 ATOM 1843 C CB . SER A 1 235 ? 24.222 80.908 68.046 1.00 43.64 ? 234 SER A CB 1 ATOM 1844 O OG . SER A 1 235 ? 23.279 81.648 68.804 1.00 44.04 ? 234 SER A OG 1 ATOM 1845 N N . TRP A 1 236 ? 27.240 80.430 66.958 1.00 43.81 ? 235 TRP A N 1 ATOM 1846 C CA . TRP A 1 236 ? 28.261 79.601 66.321 1.00 43.50 ? 235 TRP A CA 1 ATOM 1847 C C . TRP A 1 236 ? 29.380 79.212 67.287 1.00 43.60 ? 235 TRP A C 1 ATOM 1848 O O . TRP A 1 236 ? 29.987 78.148 67.147 1.00 43.32 ? 235 TRP A O 1 ATOM 1849 C CB . TRP A 1 236 ? 28.831 80.375 65.135 1.00 43.49 ? 235 TRP A CB 1 ATOM 1850 C CG . TRP A 1 236 ? 29.834 79.640 64.316 1.00 43.17 ? 235 TRP A CG 1 ATOM 1851 C CD1 . TRP A 1 236 ? 29.805 78.321 63.958 1.00 42.90 ? 235 TRP A CD1 1 ATOM 1852 C CD2 . TRP A 1 236 ? 31.013 80.192 63.726 1.00 41.66 ? 235 TRP A CD2 1 ATOM 1853 N NE1 . TRP A 1 236 ? 30.903 78.017 63.198 1.00 42.81 ? 235 TRP A NE1 1 ATOM 1854 C CE2 . TRP A 1 236 ? 31.660 79.149 63.035 1.00 41.75 ? 235 TRP A CE2 1 ATOM 1855 C CE3 . TRP A 1 236 ? 31.588 81.466 63.722 1.00 40.83 ? 235 TRP A CE3 1 ATOM 1856 C CZ2 . TRP A 1 236 ? 32.851 79.341 62.342 1.00 40.92 ? 235 TRP A CZ2 1 ATOM 1857 C CZ3 . TRP A 1 236 ? 32.780 81.655 63.038 1.00 40.94 ? 235 TRP A CZ3 1 ATOM 1858 C CH2 . TRP A 1 236 ? 33.393 80.598 62.353 1.00 40.74 ? 235 TRP A CH2 1 ATOM 1859 N N . LEU A 1 237 ? 29.679 80.092 68.241 1.00 44.09 ? 236 LEU A N 1 ATOM 1860 C CA . LEU A 1 237 ? 30.783 79.876 69.165 1.00 44.65 ? 236 LEU A CA 1 ATOM 1861 C C . LEU A 1 237 ? 30.410 79.251 70.513 1.00 42.29 ? 236 LEU A C 1 ATOM 1862 O O . LEU A 1 237 ? 31.255 79.198 71.423 1.00 43.28 ? 236 LEU A O 1 ATOM 1863 C CB . LEU A 1 237 ? 31.557 81.176 69.406 1.00 46.52 ? 236 LEU A CB 1 ATOM 1864 C CG . LEU A 1 237 ? 32.361 81.724 68.220 1.00 50.18 ? 236 LEU A CG 1 ATOM 1865 C CD1 . LEU A 1 237 ? 33.322 82.794 68.718 1.00 51.76 ? 236 LEU A CD1 1 ATOM 1866 C CD2 . LEU A 1 237 ? 33.125 80.642 67.477 1.00 51.19 ? 236 LEU A CD2 1 ATOM 1867 N N . LEU A 1 238 ? 29.186 78.747 70.650 1.00 39.75 ? 237 LEU A N 1 ATOM 1868 C CA . LEU A 1 238 ? 28.838 77.946 71.822 1.00 39.72 ? 237 LEU A CA 1 ATOM 1869 C C . LEU A 1 238 ? 29.731 76.705 71.855 1.00 40.05 ? 237 LEU A C 1 ATOM 1870 O O . LEU A 1 238 ? 30.105 76.187 70.802 1.00 41.74 ? 237 LEU A O 1 ATOM 1871 C CB . LEU A 1 238 ? 27.377 77.507 71.773 1.00 39.71 ? 237 LEU A CB 1 ATOM 1872 C CG . LEU A 1 238 ? 26.348 78.566 72.162 1.00 39.93 ? 237 LEU A CG 1 ATOM 1873 C CD1 . LEU A 1 238 ? 24.969 78.165 71.670 1.00 41.14 ? 237 LEU A CD1 1 ATOM 1874 C CD2 . LEU A 1 238 ? 26.331 78.811 73.663 1.00 38.71 ? 237 LEU A CD2 1 ATOM 1875 N N . PRO A 1 239 ? 30.041 76.194 73.057 1.00 39.53 ? 238 PRO A N 1 ATOM 1876 C CA . PRO A 1 239 ? 30.855 74.993 73.200 1.00 40.52 ? 238 PRO A CA 1 ATOM 1877 C C . PRO A 1 239 ? 30.440 73.807 72.323 1.00 41.38 ? 238 PRO A C 1 ATOM 1878 O O . PRO A 1 239 ? 29.252 73.521 72.182 1.00 40.42 ? 238 PRO A O 1 ATOM 1879 C CB . PRO A 1 239 ? 30.685 74.653 74.676 1.00 39.99 ? 238 PRO A CB 1 ATOM 1880 C CG . PRO A 1 239 ? 30.539 75.970 75.336 1.00 38.80 ? 238 PRO A CG 1 ATOM 1881 C CD . PRO A 1 239 ? 29.788 76.828 74.364 1.00 39.07 ? 238 PRO A CD 1 ATOM 1882 N N . TYR A 1 240 ? 31.441 73.120 71.778 1.00 42.25 ? 239 TYR A N 1 ATOM 1883 C CA . TYR A 1 240 ? 31.250 71.934 70.939 1.00 43.85 ? 239 TYR A CA 1 ATOM 1884 C C . TYR A 1 240 ? 31.705 70.669 71.662 1.00 47.33 ? 239 TYR A C 1 ATOM 1885 O O . TYR A 1 240 ? 32.614 70.709 72.485 1.00 47.51 ? 239 TYR A O 1 ATOM 1886 C CB . TYR A 1 240 ? 32.062 72.064 69.649 1.00 43.14 ? 239 TYR A CB 1 ATOM 1887 C CG . TYR A 1 240 ? 31.508 73.060 68.655 1.00 41.92 ? 239 TYR A CG 1 ATOM 1888 C CD1 . TYR A 1 240 ? 31.800 74.415 68.768 1.00 40.93 ? 239 TYR A CD1 1 ATOM 1889 C CD2 . TYR A 1 240 ? 30.703 72.645 67.588 1.00 41.34 ? 239 TYR A CD2 1 ATOM 1890 C CE1 . TYR A 1 240 ? 31.295 75.331 67.860 1.00 40.15 ? 239 TYR A CE1 1 ATOM 1891 C CE2 . TYR A 1 240 ? 30.194 73.554 66.678 1.00 40.84 ? 239 TYR A CE2 1 ATOM 1892 C CZ . TYR A 1 240 ? 30.492 74.891 66.817 1.00 40.18 ? 239 TYR A CZ 1 ATOM 1893 O OH . TYR A 1 240 ? 29.997 75.790 65.911 1.00 39.85 ? 239 TYR A OH 1 ATOM 1894 N N . ASN A 1 241 ? 31.107 69.535 71.305 1.00 51.46 ? 240 ASN A N 1 ATOM 1895 C CA . ASN A 1 241 ? 31.434 68.251 71.932 1.00 56.03 ? 240 ASN A CA 1 ATOM 1896 C C . ASN A 1 241 ? 32.774 67.631 71.553 1.00 56.41 ? 240 ASN A C 1 ATOM 1897 O O . ASN A 1 241 ? 33.183 66.631 72.128 1.00 57.56 ? 240 ASN A O 1 ATOM 1898 C CB . ASN A 1 241 ? 30.338 67.231 71.626 1.00 61.08 ? 240 ASN A CB 1 ATOM 1899 C CG . ASN A 1 241 ? 30.194 66.953 70.146 1.00 66.82 ? 240 ASN A CG 1 ATOM 1900 O OD1 . ASN A 1 241 ? 31.094 67.223 69.361 1.00 72.42 ? 240 ASN A OD1 1 ATOM 1901 N ND2 . ASN A 1 241 ? 29.027 66.449 69.748 1.00 75.13 ? 240 ASN A ND2 1 ATOM 1902 N N . TYR A 1 242 ? 33.458 68.199 70.576 1.00 56.35 ? 241 TYR A N 1 ATOM 1903 C CA . TYR A 1 242 ? 34.789 67.692 70.247 1.00 57.47 ? 241 TYR A CA 1 ATOM 1904 C C . TYR A 1 242 ? 35.876 68.284 71.140 1.00 56.95 ? 241 TYR A C 1 ATOM 1905 O O . TYR A 1 242 ? 37.019 67.838 71.108 1.00 58.41 ? 241 TYR A O 1 ATOM 1906 C CB . TYR A 1 242 ? 35.112 67.881 68.755 1.00 57.44 ? 241 TYR A CB 1 ATOM 1907 C CG . TYR A 1 242 ? 35.061 69.295 68.211 1.00 56.03 ? 241 TYR A CG 1 ATOM 1908 C CD1 . TYR A 1 242 ? 36.110 70.177 68.427 1.00 55.91 ? 241 TYR A CD1 1 ATOM 1909 C CD2 . TYR A 1 242 ? 33.984 69.736 67.436 1.00 55.13 ? 241 TYR A CD2 1 ATOM 1910 C CE1 . TYR A 1 242 ? 36.081 71.462 67.916 1.00 54.51 ? 241 TYR A CE1 1 ATOM 1911 C CE2 . TYR A 1 242 ? 33.946 71.023 66.922 1.00 53.56 ? 241 TYR A CE2 1 ATOM 1912 C CZ . TYR A 1 242 ? 35.004 71.880 67.165 1.00 53.45 ? 241 TYR A CZ 1 ATOM 1913 O OH . TYR A 1 242 ? 35.003 73.163 66.664 1.00 53.16 ? 241 TYR A OH 1 ATOM 1914 N N . THR A 1 243 ? 35.508 69.285 71.938 1.00 56.25 ? 242 THR A N 1 ATOM 1915 C CA . THR A 1 243 ? 36.392 69.888 72.926 1.00 54.00 ? 242 THR A CA 1 ATOM 1916 C C . THR A 1 243 ? 35.909 69.633 74.345 1.00 53.38 ? 242 THR A C 1 ATOM 1917 O O . THR A 1 243 ? 36.710 69.362 75.245 1.00 56.13 ? 242 THR A O 1 ATOM 1918 C CB . THR A 1 243 ? 36.482 71.407 72.699 1.00 53.69 ? 242 THR A CB 1 ATOM 1919 O OG1 . THR A 1 243 ? 37.032 71.648 71.403 1.00 54.90 ? 242 THR A OG1 1 ATOM 1920 C CG2 . THR A 1 243 ? 37.355 72.084 73.753 1.00 54.13 ? 242 THR A CG2 1 ATOM 1921 N N . TRP A 1 244 ? 34.600 69.735 74.551 1.00 51.14 ? 243 TRP A N 1 ATOM 1922 C CA . TRP A 1 244 ? 34.029 69.659 75.885 1.00 50.35 ? 243 TRP A CA 1 ATOM 1923 C C . TRP A 1 244 ? 33.247 68.374 76.064 1.00 51.23 ? 243 TRP A C 1 ATOM 1924 O O . TRP A 1 244 ? 32.752 67.802 75.101 1.00 54.06 ? 243 TRP A O 1 ATOM 1925 C CB . TRP A 1 244 ? 33.094 70.838 76.121 1.00 48.66 ? 243 TRP A CB 1 ATOM 1926 C CG . TRP A 1 244 ? 33.688 72.207 75.911 1.00 47.19 ? 243 TRP A CG 1 ATOM 1927 C CD1 . TRP A 1 244 ? 33.783 72.897 74.731 1.00 46.47 ? 243 TRP A CD1 1 ATOM 1928 C CD2 . TRP A 1 244 ? 34.220 73.065 76.917 1.00 45.65 ? 243 TRP A CD2 1 ATOM 1929 N NE1 . TRP A 1 244 ? 34.349 74.131 74.949 1.00 45.35 ? 243 TRP A NE1 1 ATOM 1930 C CE2 . TRP A 1 244 ? 34.629 74.257 76.283 1.00 45.11 ? 243 TRP A CE2 1 ATOM 1931 C CE3 . TRP A 1 244 ? 34.394 72.941 78.293 1.00 46.55 ? 243 TRP A CE3 1 ATOM 1932 C CZ2 . TRP A 1 244 ? 35.201 75.314 76.982 1.00 44.94 ? 243 TRP A CZ2 1 ATOM 1933 C CZ3 . TRP A 1 244 ? 34.962 73.990 78.990 1.00 46.31 ? 243 TRP A CZ3 1 ATOM 1934 C CH2 . TRP A 1 244 ? 35.361 75.160 78.336 1.00 46.42 ? 243 TRP A CH2 1 ATOM 1935 N N . SER A 1 245 ? 33.124 67.938 77.312 1.00 51.88 ? 244 SER A N 1 ATOM 1936 C CA . SER A 1 245 ? 32.354 66.755 77.652 1.00 52.41 ? 244 SER A CA 1 ATOM 1937 C C . SER A 1 245 ? 30.853 67.035 77.469 1.00 52.23 ? 244 SER A C 1 ATOM 1938 O O . SER A 1 245 ? 30.360 68.086 77.878 1.00 50.37 ? 244 SER A O 1 ATOM 1939 C CB . SER A 1 245 ? 32.622 66.357 79.108 1.00 52.30 ? 244 SER A CB 1 ATOM 1940 O OG . SER A 1 245 ? 31.742 65.327 79.524 1.00 52.71 ? 244 SER A OG 1 ATOM 1941 N N . PRO A 1 246 ? 30.113 66.091 76.872 1.00 54.11 ? 245 PRO A N 1 ATOM 1942 C CA . PRO A 1 246 ? 28.666 66.301 76.752 1.00 54.09 ? 245 PRO A CA 1 ATOM 1943 C C . PRO A 1 246 ? 27.945 66.368 78.088 1.00 54.42 ? 245 PRO A C 1 ATOM 1944 O O . PRO A 1 246 ? 26.804 66.794 78.144 1.00 55.22 ? 245 PRO A O 1 ATOM 1945 C CB . PRO A 1 246 ? 28.199 65.081 75.945 1.00 55.59 ? 245 PRO A CB 1 ATOM 1946 C CG . PRO A 1 246 ? 29.411 64.653 75.182 1.00 56.55 ? 245 PRO A CG 1 ATOM 1947 C CD . PRO A 1 246 ? 30.556 64.904 76.123 1.00 56.02 ? 245 PRO A CD 1 ATOM 1948 N N . GLU A 1 247 ? 28.596 65.943 79.164 1.00 55.54 ? 246 GLU A N 1 ATOM 1949 C CA . GLU A 1 247 ? 27.997 66.020 80.490 1.00 56.79 ? 246 GLU A CA 1 ATOM 1950 C C . GLU A 1 247 ? 28.400 67.255 81.310 1.00 54.21 ? 246 GLU A C 1 ATOM 1951 O O . GLU A 1 247 ? 27.895 67.451 82.393 1.00 55.60 ? 246 GLU A O 1 ATOM 1952 C CB . GLU A 1 247 ? 28.317 64.751 81.286 1.00 61.11 ? 246 GLU A CB 1 ATOM 1953 C CG . GLU A 1 247 ? 27.830 63.458 80.611 1.00 65.98 ? 246 GLU A CG 1 ATOM 1954 C CD . GLU A 1 247 ? 26.457 63.578 79.919 1.00 69.43 ? 246 GLU A CD 1 ATOM 1955 O OE1 . GLU A 1 247 ? 25.532 64.157 80.529 1.00 69.16 ? 246 GLU A OE1 1 ATOM 1956 O OE2 . GLU A 1 247 ? 26.291 63.088 78.765 1.00 70.73 ? 246 GLU A OE2 1 ATOM 1957 N N . LYS A 1 248 ? 29.292 68.087 80.799 1.00 52.44 ? 247 LYS A N 1 ATOM 1958 C CA . LYS A 1 248 ? 29.693 69.292 81.518 1.00 51.01 ? 247 LYS A CA 1 ATOM 1959 C C . LYS A 1 248 ? 28.533 70.281 81.609 1.00 49.77 ? 247 LYS A C 1 ATOM 1960 O O . LYS A 1 248 ? 27.934 70.634 80.603 1.00 48.96 ? 247 LYS A O 1 ATOM 1961 C CB . LYS A 1 248 ? 30.861 69.935 80.778 1.00 52.19 ? 247 LYS A CB 1 ATOM 1962 C CG . LYS A 1 248 ? 31.140 71.392 81.087 1.00 53.63 ? 247 LYS A CG 1 ATOM 1963 C CD . LYS A 1 248 ? 32.112 71.549 82.224 1.00 55.46 ? 247 LYS A CD 1 ATOM 1964 C CE . LYS A 1 248 ? 32.374 73.014 82.520 1.00 56.13 ? 247 LYS A CE 1 ATOM 1965 N NZ . LYS A 1 248 ? 32.905 73.156 83.904 1.00 61.05 ? 247 LYS A NZ 1 ATOM 1966 N N . VAL A 1 249 ? 28.202 70.720 82.820 1.00 48.33 ? 248 VAL A N 1 ATOM 1967 C CA . VAL A 1 249 ? 27.149 71.713 83.017 1.00 46.04 ? 248 VAL A CA 1 ATOM 1968 C C . VAL A 1 249 ? 27.751 73.101 82.903 1.00 45.80 ? 248 VAL A C 1 ATOM 1969 O O . VAL A 1 249 ? 28.630 73.444 83.677 1.00 46.30 ? 248 VAL A O 1 ATOM 1970 C CB . VAL A 1 249 ? 26.512 71.559 84.401 1.00 46.44 ? 248 VAL A CB 1 ATOM 1971 C CG1 . VAL A 1 249 ? 25.475 72.638 84.622 1.00 45.18 ? 248 VAL A CG1 1 ATOM 1972 C CG2 . VAL A 1 249 ? 25.913 70.162 84.558 1.00 48.03 ? 248 VAL A CG2 1 ATOM 1973 N N . PHE A 1 250 ? 27.299 73.868 81.913 1.00 44.92 ? 249 PHE A N 1 ATOM 1974 C CA . PHE A 1 250 ? 27.763 75.241 81.694 1.00 43.34 ? 249 PHE A CA 1 ATOM 1975 C C . PHE A 1 250 ? 26.913 76.261 82.430 1.00 42.51 ? 249 PHE A C 1 ATOM 1976 O O . PHE A 1 250 ? 27.411 77.310 82.827 1.00 40.79 ? 249 PHE A O 1 ATOM 1977 C CB . PHE A 1 250 ? 27.747 75.590 80.202 1.00 42.43 ? 249 PHE A CB 1 ATOM 1978 C CG . PHE A 1 250 ? 28.810 74.894 79.416 1.00 43.75 ? 249 PHE A CG 1 ATOM 1979 C CD1 . PHE A 1 250 ? 30.120 75.317 79.488 1.00 43.88 ? 249 PHE A CD1 1 ATOM 1980 C CD2 . PHE A 1 250 ? 28.506 73.795 78.626 1.00 45.34 ? 249 PHE A CD2 1 ATOM 1981 C CE1 . PHE A 1 250 ? 31.111 74.664 78.780 1.00 44.85 ? 249 PHE A CE1 1 ATOM 1982 C CE2 . PHE A 1 250 ? 29.494 73.133 77.917 1.00 45.97 ? 249 PHE A CE2 1 ATOM 1983 C CZ . PHE A 1 250 ? 30.800 73.569 77.995 1.00 45.16 ? 249 PHE A CZ 1 ATOM 1984 N N . VAL A 1 251 ? 25.620 75.965 82.566 1.00 42.45 ? 250 VAL A N 1 ATOM 1985 C CA . VAL A 1 251 ? 24.697 76.836 83.270 1.00 42.86 ? 250 VAL A CA 1 ATOM 1986 C C . VAL A 1 251 ? 23.873 75.988 84.231 1.00 44.38 ? 250 VAL A C 1 ATOM 1987 O O . VAL A 1 251 ? 23.204 75.039 83.844 1.00 43.47 ? 250 VAL A O 1 ATOM 1988 C CB . VAL A 1 251 ? 23.757 77.597 82.317 1.00 42.26 ? 250 VAL A CB 1 ATOM 1989 C CG1 . VAL A 1 251 ? 22.709 78.375 83.105 1.00 43.21 ? 250 VAL A CG1 1 ATOM 1990 C CG2 . VAL A 1 251 ? 24.540 78.532 81.404 1.00 41.19 ? 250 VAL A CG2 1 ATOM 1991 N N . GLN A 1 252 ? 23.914 76.356 85.501 1.00 46.54 ? 251 GLN A N 1 ATOM 1992 C CA . GLN A 1 252 ? 23.134 75.700 86.538 1.00 49.41 ? 251 GLN A CA 1 ATOM 1993 C C . GLN A 1 252 ? 22.135 76.683 87.130 1.00 48.50 ? 251 GLN A C 1 ATOM 1994 O O . GLN A 1 252 ? 22.449 77.864 87.310 1.00 50.87 ? 251 GLN A O 1 ATOM 1995 C CB . GLN A 1 252 ? 24.067 75.267 87.665 1.00 52.00 ? 251 GLN A CB 1 ATOM 1996 C CG . GLN A 1 252 ? 23.453 74.313 88.679 1.00 54.52 ? 251 GLN A CG 1 ATOM 1997 C CD . GLN A 1 252 ? 24.443 73.858 89.742 1.00 56.85 ? 251 GLN A CD 1 ATOM 1998 O OE1 . GLN A 1 252 ? 24.887 74.654 90.555 1.00 59.00 ? 251 GLN A OE1 1 ATOM 1999 N NE2 . GLN A 1 252 ? 24.765 72.576 89.753 1.00 58.71 ? 251 GLN A NE2 1 ATOM 2000 N N . THR A 1 253 ? 20.932 76.177 87.370 1.00 48.87 ? 252 THR A N 1 ATOM 2001 C CA . THR A 1 253 ? 19.892 76.938 88.036 1.00 50.20 ? 252 THR A CA 1 ATOM 2002 C C . THR A 1 253 ? 19.319 76.027 89.122 1.00 51.27 ? 252 THR A C 1 ATOM 2003 O O . THR A 1 253 ? 19.679 74.847 89.187 1.00 50.77 ? 252 THR A O 1 ATOM 2004 C CB . THR A 1 253 ? 18.772 77.326 87.049 1.00 49.96 ? 252 THR A CB 1 ATOM 2005 O OG1 . THR A 1 253 ? 17.966 76.177 86.766 1.00 50.04 ? 252 THR A OG1 1 ATOM 2006 C CG2 . THR A 1 253 ? 19.345 77.872 85.748 1.00 47.69 ? 252 THR A CG2 1 ATOM 2007 N N . PRO A 1 254 ? 18.417 76.562 89.970 1.00 54.27 ? 253 PRO A N 1 ATOM 2008 C CA . PRO A 1 254 ? 17.878 75.683 91.031 1.00 56.49 ? 253 PRO A CA 1 ATOM 2009 C C . PRO A 1 254 ? 17.060 74.493 90.509 1.00 58.39 ? 253 PRO A C 1 ATOM 2010 O O . PRO A 1 254 ? 16.940 73.493 91.206 1.00 57.91 ? 253 PRO A O 1 ATOM 2011 C CB . PRO A 1 254 ? 17.012 76.627 91.874 1.00 55.66 ? 253 PRO A CB 1 ATOM 2012 C CG . PRO A 1 254 ? 17.482 78.007 91.526 1.00 55.00 ? 253 PRO A CG 1 ATOM 2013 C CD . PRO A 1 254 ? 17.873 77.927 90.077 1.00 54.81 ? 253 PRO A CD 1 ATOM 2014 N N . THR A 1 255 ? 16.524 74.594 89.291 1.00 61.76 ? 254 THR A N 1 ATOM 2015 C CA . THR A 1 255 ? 15.613 73.576 88.764 1.00 63.35 ? 254 THR A CA 1 ATOM 2016 C C . THR A 1 255 ? 16.099 72.849 87.508 1.00 62.71 ? 254 THR A C 1 ATOM 2017 O O . THR A 1 255 ? 15.470 71.878 87.110 1.00 64.02 ? 254 THR A O 1 ATOM 2018 C CB . THR A 1 255 ? 14.240 74.189 88.409 1.00 64.80 ? 254 THR A CB 1 ATOM 2019 O OG1 . THR A 1 255 ? 14.383 75.080 87.296 1.00 63.27 ? 254 THR A OG1 1 ATOM 2020 C CG2 . THR A 1 255 ? 13.658 74.946 89.591 1.00 65.47 ? 254 THR A CG2 1 ATOM 2021 N N . ILE A 1 256 ? 17.184 73.306 86.882 1.00 59.41 ? 255 ILE A N 1 ATOM 2022 C CA . ILE A 1 256 ? 17.591 72.732 85.620 1.00 57.15 ? 255 ILE A CA 1 ATOM 2023 C C . ILE A 1 256 ? 19.063 73.056 85.323 1.00 52.46 ? 255 ILE A C 1 ATOM 2024 O O . ILE A 1 256 ? 19.571 74.130 85.703 1.00 52.18 ? 255 ILE A O 1 ATOM 2025 C CB . ILE A 1 256 ? 16.604 73.178 84.504 1.00 58.56 ? 255 ILE A CB 1 ATOM 2026 C CG1 . ILE A 1 256 ? 17.043 72.692 83.140 1.00 58.79 ? 255 ILE A CG1 1 ATOM 2027 C CG2 . ILE A 1 256 ? 16.454 74.689 84.457 1.00 61.18 ? 255 ILE A CG2 1 ATOM 2028 C CD1 . ILE A 1 256 ? 16.004 72.980 82.083 1.00 61.14 ? 255 ILE A CD1 1 ATOM 2029 N N . ASN A 1 257 ? 19.747 72.090 84.707 1.00 49.44 ? 256 ASN A N 1 ATOM 2030 C CA . ASN A 1 257 ? 21.124 72.246 84.248 1.00 50.72 ? 256 ASN A CA 1 ATOM 2031 C C . ASN A 1 257 ? 21.182 72.258 82.725 1.00 47.92 ? 256 ASN A C 1 ATOM 2032 O O . ASN A 1 257 ? 20.416 71.558 82.071 1.00 50.49 ? 256 ASN A O 1 ATOM 2033 C CB . ASN A 1 257 ? 22.066 71.159 84.815 1.00 54.19 ? 256 ASN A CB 1 ATOM 2034 C CG . ASN A 1 257 ? 22.194 71.214 86.326 1.00 58.32 ? 256 ASN A CG 1 ATOM 2035 O OD1 . ASN A 1 257 ? 21.676 72.114 86.975 1.00 62.31 ? 256 ASN A OD1 1 ATOM 2036 N ND2 . ASN A 1 257 ? 22.929 70.275 86.893 1.00 65.21 ? 256 ASN A ND2 1 ATOM 2037 N N . TYR A 1 258 ? 22.044 73.101 82.168 1.00 44.07 ? 257 TYR A N 1 ATOM 2038 C CA . TYR A 1 258 ? 22.274 73.127 80.724 1.00 42.98 ? 257 TYR A CA 1 ATOM 2039 C C . TYR A 1 258 ? 23.694 72.696 80.405 1.00 42.06 ? 257 TYR A C 1 ATOM 2040 O O . TYR A 1 258 ? 24.663 73.338 80.823 1.00 41.91 ? 257 TYR A O 1 ATOM 2041 C CB . TYR A 1 258 ? 22.011 74.513 80.122 1.00 42.06 ? 257 TYR A CB 1 ATOM 2042 C CG . TYR A 1 258 ? 20.639 75.036 80.445 1.00 43.20 ? 257 TYR A CG 1 ATOM 2043 C CD1 . TYR A 1 258 ? 19.552 74.763 79.623 1.00 42.54 ? 257 TYR A CD1 1 ATOM 2044 C CD2 . TYR A 1 258 ? 20.417 75.774 81.607 1.00 45.30 ? 257 TYR A CD2 1 ATOM 2045 C CE1 . TYR A 1 258 ? 18.284 75.223 79.936 1.00 44.69 ? 257 TYR A CE1 1 ATOM 2046 C CE2 . TYR A 1 258 ? 19.154 76.241 81.932 1.00 46.70 ? 257 TYR A CE2 1 ATOM 2047 C CZ . TYR A 1 258 ? 18.090 75.969 81.093 1.00 46.70 ? 257 TYR A CZ 1 ATOM 2048 O OH . TYR A 1 258 ? 16.843 76.437 81.427 1.00 47.82 ? 257 TYR A OH 1 ATOM 2049 N N . THR A 1 259 ? 23.774 71.586 79.658 1.00 41.32 ? 258 THR A N 1 ATOM 2050 C CA . THR A 1 259 ? 24.981 71.091 79.017 1.00 40.54 ? 258 THR A CA 1 ATOM 2051 C C . THR A 1 259 ? 24.928 71.418 77.527 1.00 40.36 ? 258 THR A C 1 ATOM 2052 O O . THR A 1 259 ? 23.953 71.988 77.045 1.00 39.18 ? 258 THR A O 1 ATOM 2053 C CB . THR A 1 259 ? 25.080 69.557 79.116 1.00 41.24 ? 258 THR A CB 1 ATOM 2054 O OG1 . THR A 1 259 ? 24.159 68.961 78.193 1.00 40.67 ? 258 THR A OG1 1 ATOM 2055 C CG2 . THR A 1 259 ? 24.780 69.059 80.536 1.00 41.25 ? 258 THR A CG2 1 ATOM 2056 N N . LEU A 1 260 ? 25.962 71.042 76.785 1.00 40.59 ? 259 LEU A N 1 ATOM 2057 C CA . LEU A 1 260 ? 25.967 71.311 75.340 1.00 40.90 ? 259 LEU A CA 1 ATOM 2058 C C . LEU A 1 260 ? 24.945 70.468 74.568 1.00 41.40 ? 259 LEU A C 1 ATOM 2059 O O . LEU A 1 260 ? 24.696 70.720 73.381 1.00 43.04 ? 259 LEU A O 1 ATOM 2060 C CB . LEU A 1 260 ? 27.371 71.152 74.757 1.00 40.82 ? 259 LEU A CB 1 ATOM 2061 C CG . LEU A 1 260 ? 28.006 69.765 74.765 1.00 41.39 ? 259 LEU A CG 1 ATOM 2062 C CD1 . LEU A 1 260 ? 27.608 68.957 73.542 1.00 41.16 ? 259 LEU A CD1 1 ATOM 2063 C CD2 . LEU A 1 260 ? 29.516 69.927 74.842 1.00 41.65 ? 259 LEU A CD2 1 ATOM 2064 N N . ARG A 1 261 ? 24.360 69.476 75.228 1.00 40.48 ? 260 ARG A N 1 ATOM 2065 C CA . ARG A 1 261 ? 23.250 68.732 74.625 1.00 40.86 ? 260 ARG A CA 1 ATOM 2066 C C . ARG A 1 261 ? 21.888 69.384 74.880 1.00 40.90 ? 260 ARG A C 1 ATOM 2067 O O . ARG A 1 261 ? 20.865 68.854 74.456 1.00 42.62 ? 260 ARG A O 1 ATOM 2068 C CB . ARG A 1 261 ? 23.247 67.285 75.130 1.00 41.47 ? 260 ARG A CB 1 ATOM 2069 C CG . ARG A 1 261 ? 24.552 66.554 74.861 1.00 41.72 ? 260 ARG A CG 1 ATOM 2070 C CD . ARG A 1 261 ? 24.367 65.051 74.765 1.00 43.22 ? 260 ARG A CD 1 ATOM 2071 N NE . ARG A 1 261 ? 24.059 64.463 76.053 1.00 43.56 ? 260 ARG A NE 1 ATOM 2072 C CZ . ARG A 1 261 ? 23.562 63.245 76.229 1.00 45.57 ? 260 ARG A CZ 1 ATOM 2073 N NH1 . ARG A 1 261 ? 23.286 62.456 75.189 1.00 46.45 ? 260 ARG A NH1 1 ATOM 2074 N NH2 . ARG A 1 261 ? 23.322 62.815 77.467 1.00 46.50 ? 260 ARG A NH2 1 ATOM 2075 N N . ASP A 1 262 ? 21.880 70.536 75.548 1.00 40.28 ? 261 ASP A N 1 ATOM 2076 C CA . ASP A 1 262 ? 20.640 71.169 75.996 1.00 39.98 ? 261 ASP A CA 1 ATOM 2077 C C . ASP A 1 262 ? 20.427 72.573 75.422 1.00 39.09 ? 261 ASP A C 1 ATOM 2078 O O . ASP A 1 262 ? 19.677 73.385 76.000 1.00 37.99 ? 261 ASP A O 1 ATOM 2079 C CB . ASP A 1 262 ? 20.605 71.249 77.536 1.00 39.22 ? 261 ASP A CB 1 ATOM 2080 C CG . ASP A 1 262 ? 20.739 69.891 78.209 1.00 40.82 ? 261 ASP A CG 1 ATOM 2081 O OD1 . ASP A 1 262 ? 19.973 68.961 77.877 1.00 41.78 ? 261 ASP A OD1 1 ATOM 2082 O OD2 . ASP A 1 262 ? 21.618 69.746 79.086 1.00 40.91 ? 261 ASP A OD2 1 ATOM 2083 N N . TYR A 1 263 ? 21.040 72.870 74.280 1.00 38.69 ? 262 TYR A N 1 ATOM 2084 C CA . TYR A 1 263 ? 20.931 74.218 73.725 1.00 38.96 ? 262 TYR A CA 1 ATOM 2085 C C . TYR A 1 263 ? 19.506 74.587 73.311 1.00 40.18 ? 262 TYR A C 1 ATOM 2086 O O . TYR A 1 263 ? 19.107 75.740 73.455 1.00 41.44 ? 262 TYR A O 1 ATOM 2087 C CB . TYR A 1 263 ? 21.889 74.447 72.548 1.00 38.58 ? 262 TYR A CB 1 ATOM 2088 C CG . TYR A 1 263 ? 23.367 74.454 72.925 1.00 37.91 ? 262 TYR A CG 1 ATOM 2089 C CD1 . TYR A 1 263 ? 23.815 75.006 74.140 1.00 36.98 ? 262 TYR A CD1 1 ATOM 2090 C CD2 . TYR A 1 263 ? 24.320 73.931 72.059 1.00 37.45 ? 262 TYR A CD2 1 ATOM 2091 C CE1 . TYR A 1 263 ? 25.159 75.016 74.477 1.00 36.17 ? 262 TYR A CE1 1 ATOM 2092 C CE2 . TYR A 1 263 ? 25.667 73.936 72.389 1.00 36.97 ? 262 TYR A CE2 1 ATOM 2093 C CZ . TYR A 1 263 ? 26.087 74.474 73.596 1.00 36.87 ? 262 TYR A CZ 1 ATOM 2094 O OH . TYR A 1 263 ? 27.435 74.480 73.921 1.00 36.60 ? 262 TYR A OH 1 ATOM 2095 N N . ARG A 1 264 ? 18.726 73.637 72.810 1.00 42.50 ? 263 ARG A N 1 ATOM 2096 C CA . ARG A 1 264 ? 17.350 73.954 72.447 1.00 44.98 ? 263 ARG A CA 1 ATOM 2097 C C . ARG A 1 264 ? 16.553 74.438 73.666 1.00 44.71 ? 263 ARG A C 1 ATOM 2098 O O . ARG A 1 264 ? 15.889 75.458 73.588 1.00 46.78 ? 263 ARG A O 1 ATOM 2099 C CB . ARG A 1 264 ? 16.647 72.786 71.773 1.00 48.21 ? 263 ARG A CB 1 ATOM 2100 C CG . ARG A 1 264 ? 15.339 73.230 71.163 1.00 51.33 ? 263 ARG A CG 1 ATOM 2101 C CD . ARG A 1 264 ? 14.611 72.118 70.463 1.00 55.91 ? 263 ARG A CD 1 ATOM 2102 N NE . ARG A 1 264 ? 13.324 72.618 70.004 1.00 63.11 ? 263 ARG A NE 1 ATOM 2103 C CZ . ARG A 1 264 ? 12.325 71.860 69.571 1.00 69.77 ? 263 ARG A CZ 1 ATOM 2104 N NH1 . ARG A 1 264 ? 12.448 70.536 69.519 1.00 72.97 ? 263 ARG A NH1 1 ATOM 2105 N NH2 . ARG A 1 264 ? 11.190 72.433 69.187 1.00 73.25 ? 263 ARG A NH2 1 ATOM 2106 N N . LYS A 1 265 ? 16.658 73.721 74.779 1.00 44.54 ? 264 LYS A N 1 ATOM 2107 C CA . LYS A 1 265 ? 16.041 74.125 76.057 1.00 44.55 ? 264 LYS A CA 1 ATOM 2108 C C . LYS A 1 265 ? 16.534 75.495 76.533 1.00 43.88 ? 264 LYS A C 1 ATOM 2109 O O . LYS A 1 265 ? 15.759 76.319 77.012 1.00 44.21 ? 264 LYS A O 1 ATOM 2110 C CB . LYS A 1 265 ? 16.377 73.121 77.152 1.00 43.56 ? 264 LYS A CB 1 ATOM 2111 C CG . LYS A 1 265 ? 15.651 71.808 77.048 1.00 44.59 ? 264 LYS A CG 1 ATOM 2112 C CD . LYS A 1 265 ? 15.628 71.093 78.388 1.00 44.56 ? 264 LYS A CD 1 ATOM 2113 C CE . LYS A 1 265 ? 17.013 70.832 78.946 1.00 42.89 ? 264 LYS A CE 1 ATOM 2114 N NZ . LYS A 1 265 ? 16.948 69.730 79.942 1.00 43.28 ? 264 LYS A NZ 1 ATOM 2115 N N . PHE A 1 266 ? 17.851 75.681 76.454 1.00 43.35 ? 265 PHE A N 1 ATOM 2116 C CA . PHE A 1 266 ? 18.498 76.918 76.874 1.00 43.65 ? 265 PHE A CA 1 ATOM 2117 C C . PHE A 1 266 ? 17.916 78.116 76.129 1.00 43.89 ? 265 PHE A C 1 ATOM 2118 O O . PHE A 1 266 ? 17.509 79.126 76.733 1.00 42.91 ? 265 PHE A O 1 ATOM 2119 C CB . PHE A 1 266 ? 20.001 76.825 76.623 1.00 44.31 ? 265 PHE A CB 1 ATOM 2120 C CG . PHE A 1 266 ? 20.759 78.069 76.987 1.00 44.53 ? 265 PHE A CG 1 ATOM 2121 C CD1 . PHE A 1 266 ? 20.935 78.433 78.312 1.00 45.29 ? 265 PHE A CD1 1 ATOM 2122 C CD2 . PHE A 1 266 ? 21.310 78.869 75.995 1.00 45.67 ? 265 PHE A CD2 1 ATOM 2123 C CE1 . PHE A 1 266 ? 21.639 79.587 78.645 1.00 46.22 ? 265 PHE A CE1 1 ATOM 2124 C CE2 . PHE A 1 266 ? 22.016 80.017 76.313 1.00 45.48 ? 265 PHE A CE2 1 ATOM 2125 C CZ . PHE A 1 266 ? 22.181 80.382 77.642 1.00 45.92 ? 265 PHE A CZ 1 ATOM 2126 N N . PHE A 1 267 ? 17.835 77.994 74.808 1.00 44.52 ? 266 PHE A N 1 ATOM 2127 C CA . PHE A 1 267 ? 17.302 79.081 73.995 1.00 44.10 ? 266 PHE A CA 1 ATOM 2128 C C . PHE A 1 267 ? 15.818 79.321 74.262 1.00 46.88 ? 266 PHE A C 1 ATOM 2129 O O . PHE A 1 267 ? 15.381 80.464 74.283 1.00 49.36 ? 266 PHE A O 1 ATOM 2130 C CB . PHE A 1 267 ? 17.541 78.824 72.500 1.00 43.33 ? 266 PHE A CB 1 ATOM 2131 C CG . PHE A 1 267 ? 18.950 79.117 72.049 1.00 41.78 ? 266 PHE A CG 1 ATOM 2132 C CD1 . PHE A 1 267 ? 19.442 80.412 72.065 1.00 41.27 ? 266 PHE A CD1 1 ATOM 2133 C CD2 . PHE A 1 267 ? 19.778 78.104 71.592 1.00 41.20 ? 266 PHE A CD2 1 ATOM 2134 C CE1 . PHE A 1 267 ? 20.738 80.683 71.657 1.00 40.78 ? 266 PHE A CE1 1 ATOM 2135 C CE2 . PHE A 1 267 ? 21.072 78.369 71.175 1.00 40.72 ? 266 PHE A CE2 1 ATOM 2136 C CZ . PHE A 1 267 ? 21.553 79.660 71.208 1.00 40.44 ? 266 PHE A CZ 1 ATOM 2137 N N . GLN A 1 268 ? 15.044 78.267 74.475 1.00 48.82 ? 267 GLN A N 1 ATOM 2138 C CA . GLN A 1 268 ? 13.653 78.447 74.895 1.00 51.91 ? 267 GLN A CA 1 ATOM 2139 C C . GLN A 1 268 ? 13.572 79.197 76.212 1.00 50.36 ? 267 GLN A C 1 ATOM 2140 O O . GLN A 1 268 ? 12.771 80.113 76.360 1.00 50.80 ? 267 GLN A O 1 ATOM 2141 C CB . GLN A 1 268 ? 12.936 77.103 75.041 1.00 55.28 ? 267 GLN A CB 1 ATOM 2142 C CG . GLN A 1 268 ? 12.375 76.560 73.744 1.00 59.97 ? 267 GLN A CG 1 ATOM 2143 C CD . GLN A 1 268 ? 11.843 75.142 73.867 1.00 65.44 ? 267 GLN A CD 1 ATOM 2144 O OE1 . GLN A 1 268 ? 12.062 74.312 72.980 1.00 72.98 ? 267 GLN A OE1 1 ATOM 2145 N NE2 . GLN A 1 268 ? 11.133 74.857 74.954 1.00 65.40 ? 267 GLN A NE2 1 ATOM 2146 N N . ASP A 1 269 ? 14.398 78.797 77.165 1.00 48.06 ? 268 ASP A N 1 ATOM 2147 C CA . ASP A 1 269 ? 14.283 79.297 78.524 1.00 47.81 ? 268 ASP A CA 1 ATOM 2148 C C . ASP A 1 269 ? 14.800 80.726 78.709 1.00 48.68 ? 268 ASP A C 1 ATOM 2149 O O . ASP A 1 269 ? 14.395 81.386 79.648 1.00 47.77 ? 268 ASP A O 1 ATOM 2150 C CB . ASP A 1 269 ? 14.955 78.333 79.520 1.00 45.59 ? 268 ASP A CB 1 ATOM 2151 C CG . ASP A 1 269 ? 14.233 76.992 79.624 1.00 45.22 ? 268 ASP A CG 1 ATOM 2152 O OD1 . ASP A 1 269 ? 13.092 76.869 79.137 1.00 44.84 ? 268 ASP A OD1 1 ATOM 2153 O OD2 . ASP A 1 269 ? 14.807 76.047 80.205 1.00 44.54 ? 268 ASP A OD2 1 ATOM 2154 N N . ILE A 1 270 ? 15.696 81.204 77.842 1.00 50.98 ? 269 ILE A N 1 ATOM 2155 C CA . ILE A 1 270 ? 16.090 82.591 77.871 1.00 50.93 ? 269 ILE A CA 1 ATOM 2156 C C . ILE A 1 270 ? 15.219 83.490 76.995 1.00 52.35 ? 269 ILE A C 1 ATOM 2157 O O . ILE A 1 270 ? 15.433 84.696 76.937 1.00 55.21 ? 269 ILE A O 1 ATOM 2158 C CB . ILE A 1 270 ? 17.571 82.806 77.488 1.00 50.43 ? 269 ILE A CB 1 ATOM 2159 C CG1 . ILE A 1 270 ? 17.838 82.475 76.006 1.00 51.06 ? 269 ILE A CG1 1 ATOM 2160 C CG2 . ILE A 1 270 ? 18.461 81.990 78.412 1.00 50.44 ? 269 ILE A CG2 1 ATOM 2161 C CD1 . ILE A 1 270 ? 19.295 82.622 75.602 1.00 50.45 ? 269 ILE A CD1 1 ATOM 2162 N N . GLY A 1 271 ? 14.280 82.892 76.268 1.00 52.22 ? 270 GLY A N 1 ATOM 2163 C CA . GLY A 1 271 ? 13.352 83.648 75.444 1.00 53.30 ? 270 GLY A CA 1 ATOM 2164 C C . GLY A 1 271 ? 13.937 84.032 74.095 1.00 55.01 ? 270 GLY A C 1 ATOM 2165 O O . GLY A 1 271 ? 13.626 85.092 73.586 1.00 57.33 ? 270 GLY A O 1 ATOM 2166 N N . PHE A 1 272 ? 14.777 83.180 73.515 1.00 55.98 ? 271 PHE A N 1 ATOM 2167 C CA . PHE A 1 272 ? 15.388 83.455 72.230 1.00 54.02 ? 271 PHE A CA 1 ATOM 2168 C C . PHE A 1 272 ? 15.478 82.203 71.354 1.00 55.76 ? 271 PHE A C 1 ATOM 2169 O O . PHE A 1 272 ? 16.570 81.677 71.082 1.00 55.32 ? 271 PHE A O 1 ATOM 2170 C CB . PHE A 1 272 ? 16.767 84.098 72.424 1.00 51.53 ? 271 PHE A CB 1 ATOM 2171 C CG . PHE A 1 272 ? 17.405 84.551 71.146 1.00 51.99 ? 271 PHE A CG 1 ATOM 2172 C CD1 . PHE A 1 272 ? 16.760 85.465 70.316 1.00 53.27 ? 271 PHE A CD1 1 ATOM 2173 C CD2 . PHE A 1 272 ? 18.648 84.068 70.763 1.00 51.17 ? 271 PHE A CD2 1 ATOM 2174 C CE1 . PHE A 1 272 ? 17.338 85.883 69.130 1.00 52.42 ? 271 PHE A CE1 1 ATOM 2175 C CE2 . PHE A 1 272 ? 19.232 84.482 69.576 1.00 50.92 ? 271 PHE A CE2 1 ATOM 2176 C CZ . PHE A 1 272 ? 18.574 85.390 68.755 1.00 52.00 ? 271 PHE A CZ 1 ATOM 2177 N N . GLU A 1 273 ? 14.324 81.743 70.884 1.00 59.87 ? 272 GLU A N 1 ATOM 2178 C CA . GLU A 1 273 ? 14.264 80.493 70.121 1.00 61.77 ? 272 GLU A CA 1 ATOM 2179 C C . GLU A 1 273 ? 15.011 80.551 68.778 1.00 59.86 ? 272 GLU A C 1 ATOM 2180 O O . GLU A 1 273 ? 15.516 79.536 68.320 1.00 62.14 ? 272 GLU A O 1 ATOM 2181 C CB . GLU A 1 273 ? 12.817 80.031 69.935 1.00 67.10 ? 272 GLU A CB 1 ATOM 2182 C CG . GLU A 1 273 ? 12.158 79.634 71.255 1.00 69.00 ? 272 GLU A CG 1 ATOM 2183 C CD . GLU A 1 273 ? 10.989 78.671 71.090 1.00 74.27 ? 272 GLU A CD 1 ATOM 2184 O OE1 . GLU A 1 273 ? 11.123 77.647 70.375 1.00 73.14 ? 272 GLU A OE1 1 ATOM 2185 O OE2 . GLU A 1 273 ? 9.931 78.928 71.703 1.00 80.97 ? 272 GLU A OE2 1 ATOM 2186 N N . ASP A 1 274 ? 15.106 81.723 68.162 1.00 59.50 ? 273 ASP A N 1 ATOM 2187 C CA . ASP A 1 274 ? 15.870 81.871 66.911 1.00 59.71 ? 273 ASP A CA 1 ATOM 2188 C C . ASP A 1 274 ? 17.330 81.455 67.073 1.00 55.75 ? 273 ASP A C 1 ATOM 2189 O O . ASP A 1 274 ? 17.963 81.026 66.112 1.00 57.51 ? 273 ASP A O 1 ATOM 2190 C CB . ASP A 1 274 ? 15.863 83.333 66.401 1.00 62.04 ? 273 ASP A CB 1 ATOM 2191 C CG . ASP A 1 274 ? 14.510 83.785 65.854 1.00 64.29 ? 273 ASP A CG 1 ATOM 2192 O OD1 . ASP A 1 274 ? 13.655 82.941 65.495 1.00 66.46 ? 273 ASP A OD1 1 ATOM 2193 O OD2 . ASP A 1 274 ? 14.322 85.016 65.771 1.00 64.84 ? 273 ASP A OD2 1 ATOM 2194 N N . GLY A 1 275 ? 17.882 81.626 68.271 1.00 50.85 ? 274 GLY A N 1 ATOM 2195 C CA . GLY A 1 275 ? 19.260 81.234 68.514 1.00 48.34 ? 274 GLY A CA 1 ATOM 2196 C C . GLY A 1 275 ? 19.498 79.755 68.278 1.00 47.37 ? 274 GLY A C 1 ATOM 2197 O O . GLY A 1 275 ? 20.583 79.361 67.846 1.00 47.60 ? 274 GLY A O 1 ATOM 2198 N N . TRP A 1 276 ? 18.501 78.931 68.590 1.00 47.74 ? 275 TRP A N 1 ATOM 2199 C CA . TRP A 1 276 ? 18.612 77.496 68.360 1.00 48.24 ? 275 TRP A CA 1 ATOM 2200 C C . TRP A 1 276 ? 18.679 77.208 66.862 1.00 48.47 ? 275 TRP A C 1 ATOM 2201 O O . TRP A 1 276 ? 19.471 76.384 66.407 1.00 47.44 ? 275 TRP A O 1 ATOM 2202 C CB . TRP A 1 276 ? 17.446 76.760 69.014 1.00 49.20 ? 275 TRP A CB 1 ATOM 2203 C CG . TRP A 1 276 ? 17.332 75.323 68.602 1.00 50.34 ? 275 TRP A CG 1 ATOM 2204 C CD1 . TRP A 1 276 ? 16.270 74.737 67.973 1.00 51.98 ? 275 TRP A CD1 1 ATOM 2205 C CD2 . TRP A 1 276 ? 18.317 74.298 68.775 1.00 49.43 ? 275 TRP A CD2 1 ATOM 2206 N NE1 . TRP A 1 276 ? 16.532 73.407 67.746 1.00 53.67 ? 275 TRP A NE1 1 ATOM 2207 C CE2 . TRP A 1 276 ? 17.782 73.110 68.226 1.00 51.85 ? 275 TRP A CE2 1 ATOM 2208 C CE3 . TRP A 1 276 ? 19.599 74.268 69.332 1.00 48.24 ? 275 TRP A CE3 1 ATOM 2209 C CZ2 . TRP A 1 276 ? 18.485 71.900 68.225 1.00 51.59 ? 275 TRP A CZ2 1 ATOM 2210 C CZ3 . TRP A 1 276 ? 20.299 73.066 69.333 1.00 49.44 ? 275 TRP A CZ3 1 ATOM 2211 C CH2 . TRP A 1 276 ? 19.738 71.898 68.778 1.00 51.09 ? 275 TRP A CH2 1 ATOM 2212 N N . LEU A 1 277 ? 17.856 77.915 66.095 1.00 49.96 ? 276 LEU A N 1 ATOM 2213 C CA . LEU A 1 277 ? 17.895 77.779 64.633 1.00 51.17 ? 276 LEU A CA 1 ATOM 2214 C C . LEU A 1 277 ? 19.259 78.227 64.087 1.00 49.30 ? 276 LEU A C 1 ATOM 2215 O O . LEU A 1 277 ? 19.833 77.571 63.215 1.00 48.33 ? 276 LEU A O 1 ATOM 2216 C CB . LEU A 1 277 ? 16.765 78.570 63.963 1.00 52.43 ? 276 LEU A CB 1 ATOM 2217 C CG . LEU A 1 277 ? 15.336 78.211 64.388 1.00 54.82 ? 276 LEU A CG 1 ATOM 2218 C CD1 . LEU A 1 277 ? 14.344 79.191 63.778 1.00 57.07 ? 276 LEU A CD1 1 ATOM 2219 C CD2 . LEU A 1 277 ? 14.975 76.793 63.989 1.00 56.31 ? 276 LEU A CD2 1 ATOM 2220 N N . MET A 1 278 ? 19.797 79.320 64.624 1.00 47.34 ? 277 MET A N 1 ATOM 2221 C CA . MET A 1 278 ? 21.140 79.773 64.245 1.00 47.52 ? 277 MET A CA 1 ATOM 2222 C C . MET A 1 278 ? 22.233 78.733 64.559 1.00 46.13 ? 277 MET A C 1 ATOM 2223 O O . MET A 1 278 ? 23.152 78.484 63.750 1.00 45.16 ? 277 MET A O 1 ATOM 2224 C CB . MET A 1 278 ? 21.474 81.074 64.971 1.00 48.13 ? 277 MET A CB 1 ATOM 2225 C CG . MET A 1 278 ? 20.714 82.298 64.484 1.00 49.29 ? 277 MET A CG 1 ATOM 2226 S SD . MET A 1 278 ? 20.994 83.685 65.603 1.00 48.37 ? 277 MET A SD 1 ATOM 2227 C CE . MET A 1 278 ? 20.049 84.976 64.795 1.00 52.90 ? 277 MET A CE 1 ATOM 2228 N N . ARG A 1 279 ? 22.135 78.126 65.740 1.00 44.87 ? 278 ARG A N 1 ATOM 2229 C CA . ARG A 1 279 ? 23.075 77.080 66.121 1.00 43.76 ? 278 ARG A CA 1 ATOM 2230 C C . ARG A 1 279 ? 22.969 75.888 65.173 1.00 46.75 ? 278 ARG A C 1 ATOM 2231 O O . ARG A 1 279 ? 23.990 75.356 64.723 1.00 49.13 ? 278 ARG A O 1 ATOM 2232 C CB . ARG A 1 279 ? 22.847 76.613 67.550 1.00 42.72 ? 278 ARG A CB 1 ATOM 2233 C CG . ARG A 1 279 ? 23.792 75.504 68.016 1.00 42.06 ? 278 ARG A CG 1 ATOM 2234 C CD . ARG A 1 279 ? 25.250 75.940 68.044 1.00 40.89 ? 278 ARG A CD 1 ATOM 2235 N NE . ARG A 1 279 ? 26.137 74.902 68.585 1.00 40.68 ? 278 ARG A NE 1 ATOM 2236 C CZ . ARG A 1 279 ? 27.429 75.079 68.861 1.00 40.65 ? 278 ARG A CZ 1 ATOM 2237 N NH1 . ARG A 1 279 ? 28.009 76.256 68.667 1.00 40.35 ? 278 ARG A NH1 1 ATOM 2238 N NH2 . ARG A 1 279 ? 28.154 74.076 69.339 1.00 42.16 ? 278 ARG A NH2 1 ATOM 2239 N N . GLN A 1 280 ? 21.749 75.462 64.856 1.00 49.05 ? 279 GLN A N 1 ATOM 2240 C CA . GLN A 1 280 ? 21.576 74.387 63.889 1.00 52.35 ? 279 GLN A CA 1 ATOM 2241 C C . GLN A 1 280 ? 22.160 74.736 62.531 1.00 52.78 ? 279 GLN A C 1 ATOM 2242 O O . GLN A 1 280 ? 22.715 73.860 61.889 1.00 53.48 ? 279 GLN A O 1 ATOM 2243 C CB . GLN A 1 280 ? 20.107 74.019 63.718 1.00 54.98 ? 279 GLN A CB 1 ATOM 2244 C CG . GLN A 1 280 ? 19.531 73.295 64.916 1.00 56.98 ? 279 GLN A CG 1 ATOM 2245 C CD . GLN A 1 280 ? 18.183 72.677 64.620 1.00 60.47 ? 279 GLN A CD 1 ATOM 2246 O OE1 . GLN A 1 280 ? 17.252 73.359 64.188 1.00 62.06 ? 279 GLN A OE1 1 ATOM 2247 N NE2 . GLN A 1 280 ? 18.075 71.371 64.836 1.00 63.01 ? 279 GLN A NE2 1 ATOM 2248 N N . ASP A 1 281 ? 22.005 75.989 62.089 1.00 53.27 ? 280 ASP A N 1 ATOM 2249 C CA . ASP A 1 281 ? 22.559 76.434 60.804 1.00 53.82 ? 280 ASP A CA 1 ATOM 2250 C C . ASP A 1 281 ? 24.088 76.352 60.768 1.00 52.59 ? 280 ASP A C 1 ATOM 2251 O O . ASP A 1 281 ? 24.683 76.175 59.707 1.00 53.59 ? 280 ASP A O 1 ATOM 2252 C CB . ASP A 1 281 ? 22.211 77.894 60.500 1.00 54.52 ? 280 ASP A CB 1 ATOM 2253 C CG . ASP A 1 281 ? 20.733 78.138 60.303 1.00 56.39 ? 280 ASP A CG 1 ATOM 2254 O OD1 . ASP A 1 281 ? 19.967 77.170 60.106 1.00 57.30 ? 280 ASP A OD1 1 ATOM 2255 O OD2 . ASP A 1 281 ? 20.351 79.332 60.348 1.00 57.79 ? 280 ASP A OD2 1 ATOM 2256 N N . THR A 1 282 ? 24.727 76.538 61.920 1.00 51.69 ? 281 THR A N 1 ATOM 2257 C CA . THR A 1 282 ? 26.171 76.778 61.958 1.00 50.54 ? 281 THR A CA 1 ATOM 2258 C C . THR A 1 282 ? 27.045 75.685 62.609 1.00 49.92 ? 281 THR A C 1 ATOM 2259 O O . THR A 1 282 ? 28.255 75.661 62.384 1.00 49.05 ? 281 THR A O 1 ATOM 2260 C CB . THR A 1 282 ? 26.491 78.107 62.668 1.00 50.42 ? 281 THR A CB 1 ATOM 2261 O OG1 . THR A 1 282 ? 25.977 78.084 64.007 1.00 48.95 ? 281 THR A OG1 1 ATOM 2262 C CG2 . THR A 1 282 ? 25.887 79.281 61.909 1.00 50.59 ? 281 THR A CG2 1 ATOM 2263 N N . GLU A 1 283 ? 26.443 74.783 63.381 1.00 50.53 ? 282 GLU A N 1 ATOM 2264 C CA . GLU A 1 283 ? 27.194 73.807 64.183 1.00 51.99 ? 282 GLU A CA 1 ATOM 2265 C C . GLU A 1 283 ? 28.043 72.847 63.340 1.00 51.75 ? 282 GLU A C 1 ATOM 2266 O O . GLU A 1 283 ? 29.055 72.324 63.813 1.00 53.70 ? 282 GLU A O 1 ATOM 2267 C CB . GLU A 1 283 ? 26.260 73.012 65.108 1.00 53.74 ? 282 GLU A CB 1 ATOM 2268 C CG . GLU A 1 283 ? 25.289 72.057 64.416 1.00 57.06 ? 282 GLU A CG 1 ATOM 2269 C CD . GLU A 1 283 ? 24.341 71.367 65.390 1.00 58.91 ? 282 GLU A CD 1 ATOM 2270 O OE1 . GLU A 1 283 ? 24.695 71.232 66.579 1.00 61.88 ? 282 GLU A OE1 1 ATOM 2271 O OE2 . GLU A 1 283 ? 23.237 70.955 64.972 1.00 59.97 ? 282 GLU A OE2 1 ATOM 2272 N N . GLY A 1 284 ? 27.636 72.615 62.099 1.00 51.36 ? 283 GLY A N 1 ATOM 2273 C CA . GLY A 1 284 ? 28.356 71.706 61.225 1.00 51.15 ? 283 GLY A CA 1 ATOM 2274 C C . GLY A 1 284 ? 29.333 72.362 60.257 1.00 51.57 ? 283 GLY A C 1 ATOM 2275 O O . GLY A 1 284 ? 29.943 71.661 59.457 1.00 52.15 ? 283 GLY A O 1 ATOM 2276 N N . LEU A 1 285 ? 29.495 73.683 60.313 1.00 50.36 ? 284 LEU A N 1 ATOM 2277 C CA . LEU A 1 285 ? 30.297 74.373 59.299 1.00 51.34 ? 284 LEU A CA 1 ATOM 2278 C C . LEU A 1 285 ? 31.765 73.981 59.318 1.00 52.10 ? 284 LEU A C 1 ATOM 2279 O O . LEU A 1 285 ? 32.355 73.742 58.271 1.00 53.55 ? 284 LEU A O 1 ATOM 2280 C CB . LEU A 1 285 ? 30.168 75.888 59.440 1.00 50.71 ? 284 LEU A CB 1 ATOM 2281 C CG . LEU A 1 285 ? 28.773 76.431 59.134 1.00 51.39 ? 284 LEU A CG 1 ATOM 2282 C CD1 . LEU A 1 285 ? 28.742 77.930 59.388 1.00 50.66 ? 284 LEU A CD1 1 ATOM 2283 C CD2 . LEU A 1 285 ? 28.345 76.103 57.711 1.00 52.01 ? 284 LEU A CD2 1 ATOM 2284 N N . VAL A 1 286 ? 32.351 73.937 60.504 1.00 52.52 ? 285 VAL A N 1 ATOM 2285 C CA . VAL A 1 286 ? 33.747 73.577 60.659 1.00 53.65 ? 285 VAL A CA 1 ATOM 2286 C C . VAL A 1 286 ? 33.828 72.099 60.991 1.00 56.06 ? 285 VAL A C 1 ATOM 2287 O O . VAL A 1 286 ? 33.244 71.651 61.963 1.00 58.30 ? 285 VAL A O 1 ATOM 2288 C CB . VAL A 1 286 ? 34.418 74.424 61.769 1.00 52.00 ? 285 VAL A CB 1 ATOM 2289 C CG1 . VAL A 1 286 ? 35.708 73.777 62.269 1.00 53.06 ? 285 VAL A CG1 1 ATOM 2290 C CG2 . VAL A 1 286 ? 34.696 75.823 61.252 1.00 51.63 ? 285 VAL A CG2 1 ATOM 2291 N N . GLU A 1 287 ? 34.561 71.348 60.189 1.00 58.16 ? 286 GLU A N 1 ATOM 2292 C CA . GLU A 1 287 ? 34.679 69.920 60.414 1.00 61.73 ? 286 GLU A CA 1 ATOM 2293 C C . GLU A 1 287 ? 35.498 69.659 61.682 1.00 59.69 ? 286 GLU A C 1 ATOM 2294 O O . GLU A 1 287 ? 36.649 70.077 61.804 1.00 55.33 ? 286 GLU A O 1 ATOM 2295 C CB . GLU A 1 287 ? 35.316 69.229 59.197 1.00 66.02 ? 286 GLU A CB 1 ATOM 2296 C CG . GLU A 1 287 ? 34.684 67.895 58.811 1.00 70.59 ? 286 GLU A CG 1 ATOM 2297 C CD . GLU A 1 287 ? 34.834 66.816 59.875 1.00 74.87 ? 286 GLU A CD 1 ATOM 2298 O OE1 . GLU A 1 287 ? 35.848 66.809 60.611 1.00 77.99 ? 286 GLU A OE1 1 ATOM 2299 O OE2 . GLU A 1 287 ? 33.932 65.959 59.971 1.00 78.12 ? 286 GLU A OE2 1 ATOM 2300 N N . ALA A 1 288 ? 34.873 68.943 62.606 1.00 61.23 ? 287 ALA A N 1 ATOM 2301 C CA . ALA A 1 288 ? 35.370 68.752 63.969 1.00 61.44 ? 287 ALA A CA 1 ATOM 2302 C C . ALA A 1 288 ? 36.832 68.298 64.069 1.00 62.38 ? 287 ALA A C 1 ATOM 2303 O O . ALA A 1 288 ? 37.587 68.798 64.912 1.00 63.07 ? 287 ALA A O 1 ATOM 2304 C CB . ALA A 1 288 ? 34.463 67.768 64.693 1.00 61.70 ? 287 ALA A CB 1 ATOM 2305 N N . THR A 1 289 ? 37.227 67.365 63.205 1.00 63.15 ? 288 THR A N 1 ATOM 2306 C CA . THR A 1 289 ? 38.547 66.731 63.317 1.00 64.71 ? 288 THR A CA 1 ATOM 2307 C C . THR A 1 289 ? 39.537 67.102 62.218 1.00 65.62 ? 288 THR A C 1 ATOM 2308 O O . THR A 1 289 ? 40.739 66.865 62.386 1.00 68.55 ? 288 THR A O 1 ATOM 2309 C CB . THR A 1 289 ? 38.441 65.178 63.359 1.00 66.75 ? 288 THR A CB 1 ATOM 2310 O OG1 . THR A 1 289 ? 37.849 64.694 62.151 1.00 66.89 ? 288 THR A OG1 1 ATOM 2311 C CG2 . THR A 1 289 ? 37.603 64.714 64.544 1.00 66.35 ? 288 THR A CG2 1 ATOM 2312 N N . MET A 1 290 ? 39.057 67.650 61.101 1.00 64.21 ? 289 MET A N 1 ATOM 2313 C CA . MET A 1 290 ? 39.898 67.903 59.925 1.00 64.79 ? 289 MET A CA 1 ATOM 2314 C C . MET A 1 290 ? 40.877 69.054 60.175 1.00 63.58 ? 289 MET A C 1 ATOM 2315 O O . MET A 1 290 ? 40.454 70.164 60.484 1.00 62.57 ? 289 MET A O 1 ATOM 2316 C CB . MET A 1 290 ? 39.011 68.233 58.730 1.00 66.41 ? 289 MET A CB 1 ATOM 2317 C CG . MET A 1 290 ? 39.726 68.303 57.397 1.00 68.67 ? 289 MET A CG 1 ATOM 2318 S SD . MET A 1 290 ? 38.592 68.833 56.094 1.00 71.74 ? 289 MET A SD 1 ATOM 2319 C CE . MET A 1 290 ? 39.695 68.846 54.682 1.00 71.05 ? 289 MET A CE 1 ATOM 2320 N N . PRO A 1 291 ? 42.190 68.801 60.035 1.00 64.73 ? 290 PRO A N 1 ATOM 2321 C CA . PRO A 1 291 ? 43.193 69.835 60.272 1.00 63.86 ? 290 PRO A CA 1 ATOM 2322 C C . PRO A 1 291 ? 43.203 70.821 59.111 1.00 63.90 ? 290 PRO A C 1 ATOM 2323 O O . PRO A 1 291 ? 42.653 70.527 58.054 1.00 65.95 ? 290 PRO A O 1 ATOM 2324 C CB . PRO A 1 291 ? 44.494 69.049 60.323 1.00 66.34 ? 290 PRO A CB 1 ATOM 2325 C CG . PRO A 1 291 ? 44.259 67.909 59.391 1.00 68.44 ? 290 PRO A CG 1 ATOM 2326 C CD . PRO A 1 291 ? 42.801 67.560 59.523 1.00 67.62 ? 290 PRO A CD 1 ATOM 2327 N N . PRO A 1 292 ? 43.843 71.984 59.287 1.00 61.67 ? 291 PRO A N 1 ATOM 2328 C CA . PRO A 1 292 ? 43.867 72.950 58.197 1.00 59.57 ? 291 PRO A CA 1 ATOM 2329 C C . PRO A 1 292 ? 44.755 72.510 57.025 1.00 59.70 ? 291 PRO A C 1 ATOM 2330 O O . PRO A 1 292 ? 44.538 72.943 55.905 1.00 59.97 ? 291 PRO A O 1 ATOM 2331 C CB . PRO A 1 292 ? 44.414 74.223 58.861 1.00 58.90 ? 291 PRO A CB 1 ATOM 2332 C CG . PRO A 1 292 ? 45.152 73.759 60.070 1.00 59.62 ? 291 PRO A CG 1 ATOM 2333 C CD . PRO A 1 292 ? 44.469 72.502 60.520 1.00 60.46 ? 291 PRO A CD 1 ATOM 2334 N N . GLY A 1 293 ? 45.741 71.658 57.281 1.00 59.64 ? 292 GLY A N 1 ATOM 2335 C CA . GLY A 1 293 ? 46.584 71.127 56.221 1.00 60.89 ? 292 GLY A CA 1 ATOM 2336 C C . GLY A 1 293 ? 47.696 72.070 55.780 1.00 61.10 ? 292 GLY A C 1 ATOM 2337 O O . GLY A 1 293 ? 48.182 71.972 54.653 1.00 61.70 ? 292 GLY A O 1 ATOM 2338 N N . VAL A 1 294 ? 48.093 72.978 56.677 1.00 60.29 ? 293 VAL A N 1 ATOM 2339 C CA . VAL A 1 294 ? 49.225 73.880 56.461 1.00 59.60 ? 293 VAL A CA 1 ATOM 2340 C C . VAL A 1 294 ? 50.057 73.963 57.738 1.00 59.73 ? 293 VAL A C 1 ATOM 2341 O O . VAL A 1 294 ? 49.618 73.533 58.805 1.00 59.79 ? 293 VAL A O 1 ATOM 2342 C CB . VAL A 1 294 ? 48.761 75.295 56.064 1.00 58.75 ? 293 VAL A CB 1 ATOM 2343 C CG1 . VAL A 1 294 ? 47.853 75.235 54.847 1.00 58.58 ? 293 VAL A CG1 1 ATOM 2344 C CG2 . VAL A 1 294 ? 48.050 76.000 57.221 1.00 57.58 ? 293 VAL A CG2 1 ATOM 2345 N N . GLN A 1 295 ? 51.262 74.507 57.628 1.00 60.90 ? 294 GLN A N 1 ATOM 2346 C CA . GLN A 1 295 ? 52.101 74.728 58.803 1.00 61.77 ? 294 GLN A CA 1 ATOM 2347 C C . GLN A 1 295 ? 51.355 75.650 59.760 1.00 60.24 ? 294 GLN A C 1 ATOM 2348 O O . GLN A 1 295 ? 50.898 76.710 59.357 1.00 60.50 ? 294 GLN A O 1 ATOM 2349 C CB . GLN A 1 295 ? 53.451 75.338 58.414 1.00 62.77 ? 294 GLN A CB 1 ATOM 2350 C CG . GLN A 1 295 ? 54.357 75.605 59.605 1.00 63.91 ? 294 GLN A CG 1 ATOM 2351 C CD . GLN A 1 295 ? 55.732 76.093 59.215 1.00 65.63 ? 294 GLN A CD 1 ATOM 2352 O OE1 . GLN A 1 295 ? 56.089 77.240 59.472 1.00 65.71 ? 294 GLN A OE1 1 ATOM 2353 N NE2 . GLN A 1 295 ? 56.519 75.219 58.605 1.00 67.99 ? 294 GLN A NE2 1 ATOM 2354 N N . LEU A 1 296 ? 51.198 75.211 61.000 1.00 60.92 ? 295 LEU A N 1 ATOM 2355 C CA . LEU A 1 296 ? 50.339 75.892 61.963 1.00 60.58 ? 295 LEU A CA 1 ATOM 2356 C C . LEU A 1 296 ? 51.112 76.245 63.229 1.00 59.78 ? 295 LEU A C 1 ATOM 2357 O O . LEU A 1 296 ? 51.809 75.399 63.793 1.00 60.21 ? 295 LEU A O 1 ATOM 2358 C CB . LEU A 1 296 ? 49.160 74.983 62.315 1.00 60.99 ? 295 LEU A CB 1 ATOM 2359 C CG . LEU A 1 296 ? 48.179 75.487 63.371 1.00 60.76 ? 295 LEU A CG 1 ATOM 2360 C CD1 . LEU A 1 296 ? 47.561 76.812 62.956 1.00 60.16 ? 295 LEU A CD1 1 ATOM 2361 C CD2 . LEU A 1 296 ? 47.100 74.444 63.604 1.00 61.09 ? 295 LEU A CD2 1 ATOM 2362 N N . HIS A 1 297 ? 50.992 77.496 63.659 1.00 58.65 ? 296 HIS A N 1 ATOM 2363 C CA . HIS A 1 297 ? 51.556 77.964 64.921 1.00 58.70 ? 296 HIS A CA 1 ATOM 2364 C C . HIS A 1 297 ? 50.393 78.360 65.805 1.00 57.61 ? 296 HIS A C 1 ATOM 2365 O O . HIS A 1 297 ? 49.730 79.354 65.530 1.00 55.54 ? 296 HIS A O 1 ATOM 2366 C CB . HIS A 1 297 ? 52.489 79.145 64.695 1.00 58.71 ? 296 HIS A CB 1 ATOM 2367 C CG . HIS A 1 297 ? 53.618 78.840 63.765 1.00 61.20 ? 296 HIS A CG 1 ATOM 2368 N ND1 . HIS A 1 297 ? 54.907 78.620 64.201 1.00 63.40 ? 296 HIS A ND1 1 ATOM 2369 C CD2 . HIS A 1 297 ? 53.648 78.704 62.419 1.00 61.37 ? 296 HIS A CD2 1 ATOM 2370 C CE1 . HIS A 1 297 ? 55.685 78.380 63.162 1.00 64.61 ? 296 HIS A CE1 1 ATOM 2371 N NE2 . HIS A 1 297 ? 54.946 78.422 62.069 1.00 63.81 ? 296 HIS A NE2 1 ATOM 2372 N N . CYS A 1 298 ? 50.135 77.558 66.844 1.00 59.03 ? 297 CYS A N 1 ATOM 2373 C CA A CYS A 1 298 ? 49.017 77.804 67.760 0.50 57.36 ? 297 CYS A CA 1 ATOM 2374 C CA B CYS A 1 298 ? 49.022 77.794 67.765 0.50 58.90 ? 297 CYS A CA 1 ATOM 2375 C C . CYS A 1 298 ? 49.501 78.525 69.009 1.00 57.19 ? 297 CYS A C 1 ATOM 2376 O O . CYS A 1 298 ? 50.150 77.932 69.862 1.00 56.92 ? 297 CYS A O 1 ATOM 2377 C CB A CYS A 1 298 ? 48.325 76.498 68.157 0.50 57.60 ? 297 CYS A CB 1 ATOM 2378 C CB B CYS A 1 298 ? 48.401 76.459 68.187 0.50 60.91 ? 297 CYS A CB 1 ATOM 2379 S SG A CYS A 1 298 ? 47.567 75.610 66.778 0.50 57.56 ? 297 CYS A SG 1 ATOM 2380 S SG B CYS A 1 298 ? 46.737 76.593 68.887 0.50 64.20 ? 297 CYS A SG 1 ATOM 2381 N N . LEU A 1 299 ? 49.173 79.811 69.100 1.00 54.79 ? 298 LEU A N 1 ATOM 2382 C CA . LEU A 1 299 ? 49.560 80.622 70.237 1.00 55.00 ? 298 LEU A CA 1 ATOM 2383 C C . LEU A 1 299 ? 48.349 80.829 71.142 1.00 53.79 ? 298 LEU A C 1 ATOM 2384 O O . LEU A 1 299 ? 47.306 81.318 70.702 1.00 54.31 ? 298 LEU A O 1 ATOM 2385 C CB . LEU A 1 299 ? 50.121 81.966 69.778 1.00 55.75 ? 298 LEU A CB 1 ATOM 2386 C CG . LEU A 1 299 ? 51.605 81.979 69.393 1.00 57.76 ? 298 LEU A CG 1 ATOM 2387 C CD1 . LEU A 1 299 ? 51.893 81.007 68.260 1.00 58.06 ? 298 LEU A CD1 1 ATOM 2388 C CD2 . LEU A 1 299 ? 52.035 83.387 69.016 1.00 57.86 ? 298 LEU A CD2 1 ATOM 2389 N N . TYR A 1 300 ? 48.489 80.455 72.411 1.00 53.82 ? 299 TYR A N 1 ATOM 2390 C CA . TYR A 1 300 ? 47.361 80.508 73.339 1.00 52.55 ? 299 TYR A CA 1 ATOM 2391 C C . TYR A 1 300 ? 47.804 81.045 74.683 1.00 52.38 ? 299 TYR A C 1 ATOM 2392 O O . TYR A 1 300 ? 48.886 80.720 75.165 1.00 53.71 ? 299 TYR A O 1 ATOM 2393 C CB . TYR A 1 300 ? 46.731 79.124 73.498 1.00 52.53 ? 299 TYR A CB 1 ATOM 2394 C CG . TYR A 1 300 ? 47.680 78.067 74.004 1.00 54.61 ? 299 TYR A CG 1 ATOM 2395 C CD1 . TYR A 1 300 ? 48.558 77.413 73.139 1.00 56.42 ? 299 TYR A CD1 1 ATOM 2396 C CD2 . TYR A 1 300 ? 47.700 77.714 75.348 1.00 56.03 ? 299 TYR A CD2 1 ATOM 2397 C CE1 . TYR A 1 300 ? 49.427 76.436 73.601 1.00 58.77 ? 299 TYR A CE1 1 ATOM 2398 C CE2 . TYR A 1 300 ? 48.564 76.738 75.821 1.00 58.42 ? 299 TYR A CE2 1 ATOM 2399 C CZ . TYR A 1 300 ? 49.425 76.104 74.944 1.00 59.86 ? 299 TYR A CZ 1 ATOM 2400 O OH . TYR A 1 300 ? 50.284 75.138 75.413 1.00 63.13 ? 299 TYR A OH 1 ATOM 2401 N N . GLY A 1 301 ? 46.970 81.889 75.272 1.00 51.82 ? 300 GLY A N 1 ATOM 2402 C CA . GLY A 1 301 ? 47.244 82.426 76.597 1.00 52.24 ? 300 GLY A CA 1 ATOM 2403 C C . GLY A 1 301 ? 46.855 81.479 77.711 1.00 52.04 ? 300 GLY A C 1 ATOM 2404 O O . GLY A 1 301 ? 45.862 80.750 77.609 1.00 50.89 ? 300 GLY A O 1 ATOM 2405 N N . THR A 1 302 ? 47.623 81.513 78.802 1.00 53.73 ? 301 THR A N 1 ATOM 2406 C CA . THR A 1 302 ? 47.267 80.810 80.040 1.00 54.53 ? 301 THR A CA 1 ATOM 2407 C C . THR A 1 302 ? 47.451 81.745 81.225 1.00 56.64 ? 301 THR A C 1 ATOM 2408 O O . THR A 1 302 ? 47.996 82.839 81.076 1.00 57.40 ? 301 THR A O 1 ATOM 2409 C CB . THR A 1 302 ? 48.108 79.537 80.267 1.00 56.04 ? 301 THR A CB 1 ATOM 2410 O OG1 . THR A 1 302 ? 49.484 79.880 80.472 1.00 58.14 ? 301 THR A OG1 1 ATOM 2411 C CG2 . THR A 1 302 ? 47.985 78.596 79.080 1.00 56.22 ? 301 THR A CG2 1 ATOM 2412 N N . GLY A 1 303 ? 46.991 81.307 82.396 1.00 57.08 ? 302 GLY A N 1 ATOM 2413 C CA . GLY A 1 303 ? 47.212 82.027 83.644 1.00 57.50 ? 302 GLY A CA 1 ATOM 2414 C C . GLY A 1 303 ? 46.294 83.215 83.851 1.00 57.64 ? 302 GLY A C 1 ATOM 2415 O O . GLY A 1 303 ? 46.550 84.046 84.724 1.00 60.18 ? 302 GLY A O 1 ATOM 2416 N N . VAL A 1 304 ? 45.228 83.306 83.056 1.00 55.28 ? 303 VAL A N 1 ATOM 2417 C CA . VAL A 1 304 ? 44.230 84.346 83.225 1.00 53.79 ? 303 VAL A CA 1 ATOM 2418 C C . VAL A 1 304 ? 42.914 83.649 83.578 1.00 52.95 ? 303 VAL A C 1 ATOM 2419 O O . VAL A 1 304 ? 42.478 82.751 82.872 1.00 52.74 ? 303 VAL A O 1 ATOM 2420 C CB . VAL A 1 304 ? 44.076 85.205 81.952 1.00 52.36 ? 303 VAL A CB 1 ATOM 2421 C CG1 . VAL A 1 304 ? 43.063 86.321 82.176 1.00 50.40 ? 303 VAL A CG1 1 ATOM 2422 C CG2 . VAL A 1 304 ? 45.423 85.780 81.532 1.00 53.75 ? 303 VAL A CG2 1 ATOM 2423 N N . PRO A 1 305 ? 42.283 84.040 84.690 1.00 53.25 ? 304 PRO A N 1 ATOM 2424 C CA . PRO A 1 305 ? 41.012 83.392 85.037 1.00 52.01 ? 304 PRO A CA 1 ATOM 2425 C C . PRO A 1 305 ? 39.999 83.523 83.901 1.00 48.53 ? 304 PRO A C 1 ATOM 2426 O O . PRO A 1 305 ? 39.768 84.619 83.423 1.00 48.96 ? 304 PRO A O 1 ATOM 2427 C CB . PRO A 1 305 ? 40.530 84.171 86.272 1.00 52.37 ? 304 PRO A CB 1 ATOM 2428 C CG . PRO A 1 305 ? 41.733 84.883 86.785 1.00 53.89 ? 304 PRO A CG 1 ATOM 2429 C CD . PRO A 1 305 ? 42.608 85.149 85.602 1.00 54.21 ? 304 PRO A CD 1 ATOM 2430 N N . THR A 1 306 ? 39.438 82.401 83.470 1.00 46.56 ? 305 THR A N 1 ATOM 2431 C CA . THR A 1 306 ? 38.588 82.348 82.299 1.00 45.64 ? 305 THR A CA 1 ATOM 2432 C C . THR A 1 306 ? 37.246 81.712 82.690 1.00 45.63 ? 305 THR A C 1 ATOM 2433 O O . THR A 1 306 ? 37.221 80.609 83.226 1.00 44.71 ? 305 THR A O 1 ATOM 2434 C CB . THR A 1 306 ? 39.269 81.510 81.192 1.00 46.46 ? 305 THR A CB 1 ATOM 2435 O OG1 . THR A 1 306 ? 40.624 81.952 81.017 1.00 46.50 ? 305 THR A OG1 1 ATOM 2436 C CG2 . THR A 1 306 ? 38.515 81.631 79.868 1.00 44.70 ? 305 THR A CG2 1 ATOM 2437 N N . PRO A 1 307 ? 36.126 82.417 82.457 1.00 46.43 ? 306 PRO A N 1 ATOM 2438 C CA . PRO A 1 307 ? 34.814 81.839 82.770 1.00 46.73 ? 306 PRO A CA 1 ATOM 2439 C C . PRO A 1 307 ? 34.628 80.449 82.174 1.00 47.33 ? 306 PRO A C 1 ATOM 2440 O O . PRO A 1 307 ? 34.880 80.232 80.990 1.00 48.89 ? 306 PRO A O 1 ATOM 2441 C CB . PRO A 1 307 ? 33.834 82.819 82.120 1.00 45.90 ? 306 PRO A CB 1 ATOM 2442 C CG . PRO A 1 307 ? 34.554 84.121 82.166 1.00 46.99 ? 306 PRO A CG 1 ATOM 2443 C CD . PRO A 1 307 ? 35.992 83.764 81.872 1.00 47.17 ? 306 PRO A CD 1 ATOM 2444 N N . ASP A 1 308 ? 34.201 79.533 83.028 1.00 50.29 ? 307 ASP A N 1 ATOM 2445 C CA . ASP A 1 308 ? 34.041 78.118 82.719 1.00 51.22 ? 307 ASP A CA 1 ATOM 2446 C C . ASP A 1 308 ? 32.580 77.660 82.857 1.00 48.51 ? 307 ASP A C 1 ATOM 2447 O O . ASP A 1 308 ? 32.130 76.801 82.104 1.00 47.77 ? 307 ASP A O 1 ATOM 2448 C CB . ASP A 1 308 ? 34.990 77.345 83.632 1.00 56.75 ? 307 ASP A CB 1 ATOM 2449 C CG . ASP A 1 308 ? 34.606 75.926 83.806 1.00 61.62 ? 307 ASP A CG 1 ATOM 2450 O OD1 . ASP A 1 308 ? 34.820 75.137 82.857 1.00 70.71 ? 307 ASP A OD1 1 ATOM 2451 O OD2 . ASP A 1 308 ? 34.098 75.605 84.902 1.00 59.29 ? 307 ASP A OD2 1 ATOM 2452 N N . SER A 1 309 ? 31.836 78.250 83.786 1.00 46.51 ? 308 SER A N 1 ATOM 2453 C CA . SER A 1 309 ? 30.438 77.878 84.024 1.00 44.50 ? 308 SER A CA 1 ATOM 2454 C C . SER A 1 309 ? 29.796 78.905 84.941 1.00 44.28 ? 308 SER A C 1 ATOM 2455 O O . SER A 1 309 ? 30.491 79.722 85.552 1.00 43.38 ? 308 SER A O 1 ATOM 2456 C CB . SER A 1 309 ? 30.316 76.480 84.645 1.00 43.65 ? 308 SER A CB 1 ATOM 2457 O OG . SER A 1 309 ? 31.284 76.270 85.651 1.00 44.32 ? 308 SER A OG 1 ATOM 2458 N N . PHE A 1 310 ? 28.469 78.844 85.028 1.00 43.84 ? 309 PHE A N 1 ATOM 2459 C CA . PHE A 1 310 ? 27.667 79.894 85.626 1.00 45.02 ? 309 PHE A CA 1 ATOM 2460 C C . PHE A 1 310 ? 26.556 79.315 86.471 1.00 45.72 ? 309 PHE A C 1 ATOM 2461 O O . PHE A 1 310 ? 25.936 78.312 86.126 1.00 45.01 ? 309 PHE A O 1 ATOM 2462 C CB . PHE A 1 310 ? 27.082 80.796 84.530 1.00 44.51 ? 309 PHE A CB 1 ATOM 2463 C CG . PHE A 1 310 ? 28.110 81.306 83.562 1.00 44.09 ? 309 PHE A CG 1 ATOM 2464 C CD1 . PHE A 1 310 ? 28.862 82.425 83.854 1.00 44.65 ? 309 PHE A CD1 1 ATOM 2465 C CD2 . PHE A 1 310 ? 28.348 80.637 82.375 1.00 45.16 ? 309 PHE A CD2 1 ATOM 2466 C CE1 . PHE A 1 310 ? 29.821 82.888 82.973 1.00 45.61 ? 309 PHE A CE1 1 ATOM 2467 C CE2 . PHE A 1 310 ? 29.306 81.087 81.485 1.00 45.44 ? 309 PHE A CE2 1 ATOM 2468 C CZ . PHE A 1 310 ? 30.044 82.218 81.783 1.00 45.82 ? 309 PHE A CZ 1 ATOM 2469 N N . TYR A 1 311 ? 26.275 79.988 87.584 1.00 47.16 ? 310 TYR A N 1 ATOM 2470 C CA . TYR A 1 311 ? 25.075 79.731 88.362 1.00 48.40 ? 310 TYR A CA 1 ATOM 2471 C C . TYR A 1 311 ? 24.129 80.926 88.255 1.00 47.30 ? 310 TYR A C 1 ATOM 2472 O O . TYR A 1 311 ? 24.476 82.049 88.561 1.00 48.00 ? 310 TYR A O 1 ATOM 2473 C CB . TYR A 1 311 ? 25.374 79.438 89.833 1.00 50.18 ? 310 TYR A CB 1 ATOM 2474 C CG . TYR A 1 311 ? 24.116 79.125 90.613 1.00 53.13 ? 310 TYR A CG 1 ATOM 2475 C CD1 . TYR A 1 311 ? 23.636 77.820 90.696 1.00 55.08 ? 310 TYR A CD1 1 ATOM 2476 C CD2 . TYR A 1 311 ? 23.385 80.142 91.240 1.00 55.11 ? 310 TYR A CD2 1 ATOM 2477 C CE1 . TYR A 1 311 ? 22.475 77.536 91.388 1.00 57.63 ? 310 TYR A CE1 1 ATOM 2478 C CE2 . TYR A 1 311 ? 22.222 79.873 91.938 1.00 56.99 ? 310 TYR A CE2 1 ATOM 2479 C CZ . TYR A 1 311 ? 21.773 78.568 92.007 1.00 60.86 ? 310 TYR A CZ 1 ATOM 2480 O OH . TYR A 1 311 ? 20.625 78.287 92.707 1.00 68.29 ? 310 TYR A OH 1 ATOM 2481 N N . TYR A 1 312 ? 22.922 80.624 87.801 1.00 47.48 ? 311 TYR A N 1 ATOM 2482 C CA . TYR A 1 312 ? 21.825 81.573 87.752 1.00 49.72 ? 311 TYR A CA 1 ATOM 2483 C C . TYR A 1 312 ? 20.768 81.098 88.729 1.00 53.82 ? 311 TYR A C 1 ATOM 2484 O O . TYR A 1 312 ? 20.352 79.911 88.781 1.00 54.41 ? 311 TYR A O 1 ATOM 2485 C CB . TYR A 1 312 ? 21.193 81.619 86.360 1.00 47.71 ? 311 TYR A CB 1 ATOM 2486 C CG . TYR A 1 312 ? 21.985 82.376 85.314 1.00 45.61 ? 311 TYR A CG 1 ATOM 2487 C CD1 . TYR A 1 312 ? 23.073 81.791 84.695 1.00 44.23 ? 311 TYR A CD1 1 ATOM 2488 C CD2 . TYR A 1 312 ? 21.627 83.665 84.925 1.00 44.97 ? 311 TYR A CD2 1 ATOM 2489 C CE1 . TYR A 1 312 ? 23.802 82.478 83.743 1.00 43.80 ? 311 TYR A CE1 1 ATOM 2490 C CE2 . TYR A 1 312 ? 22.347 84.360 83.963 1.00 44.25 ? 311 TYR A CE2 1 ATOM 2491 C CZ . TYR A 1 312 ? 23.436 83.763 83.377 1.00 44.01 ? 311 TYR A CZ 1 ATOM 2492 O OH . TYR A 1 312 ? 24.161 84.456 82.427 1.00 44.62 ? 311 TYR A OH 1 ATOM 2493 N N . GLU A 1 313 ? 20.247 82.059 89.459 1.00 59.77 ? 312 GLU A N 1 ATOM 2494 C CA . GLU A 1 313 ? 19.112 81.831 90.366 1.00 66.30 ? 312 GLU A CA 1 ATOM 2495 C C . GLU A 1 313 ? 17.818 81.685 89.571 1.00 69.60 ? 312 GLU A C 1 ATOM 2496 O O . GLU A 1 313 ? 16.909 80.985 89.984 1.00 70.25 ? 312 GLU A O 1 ATOM 2497 C CB . GLU A 1 313 ? 18.917 83.012 91.311 1.00 69.95 ? 312 GLU A CB 1 ATOM 2498 C CG . GLU A 1 313 ? 20.079 83.329 92.233 1.00 77.30 ? 312 GLU A CG 1 ATOM 2499 C CD . GLU A 1 313 ? 19.800 84.542 93.105 1.00 82.42 ? 312 GLU A CD 1 ATOM 2500 O OE1 . GLU A 1 313 ? 19.177 85.510 92.608 1.00 83.75 ? 312 GLU A OE1 1 ATOM 2501 O OE2 . GLU A 1 313 ? 20.201 84.527 94.292 1.00 89.18 ? 312 GLU A OE2 1 ATOM 2502 N N . SER A 1 314 ? 17.749 82.374 88.433 1.00 72.09 ? 313 SER A N 1 ATOM 2503 C CA . SER A 1 314 ? 16.705 82.096 87.436 1.00 70.89 ? 313 SER A CA 1 ATOM 2504 C C . SER A 1 314 ? 17.175 82.795 86.220 1.00 67.07 ? 313 SER A C 1 ATOM 2505 O O . SER A 1 314 ? 18.272 83.328 86.222 1.00 63.69 ? 313 SER A O 1 ATOM 2506 C CB . SER A 1 314 ? 15.332 82.605 87.884 1.00 72.13 ? 313 SER A CB 1 ATOM 2507 O OG . SER A 1 314 ? 15.339 84.001 88.097 1.00 75.10 ? 313 SER A OG 1 ATOM 2508 N N . PHE A 1 315 ? 16.364 82.833 85.160 1.00 67.16 ? 314 PHE A N 1 ATOM 2509 C CA . PHE A 1 315 ? 16.598 83.820 84.049 1.00 69.48 ? 314 PHE A CA 1 ATOM 2510 C C . PHE A 1 315 ? 15.466 84.851 84.087 1.00 75.52 ? 314 PHE A C 1 ATOM 2511 O O . PHE A 1 315 ? 14.328 84.415 84.114 1.00 75.68 ? 314 PHE A O 1 ATOM 2512 C CB . PHE A 1 315 ? 16.646 83.204 82.664 1.00 66.78 ? 314 PHE A CB 1 ATOM 2513 C CG . PHE A 1 315 ? 17.625 82.064 82.492 1.00 65.25 ? 314 PHE A CG 1 ATOM 2514 C CD1 . PHE A 1 315 ? 19.003 82.290 82.395 1.00 64.39 ? 314 PHE A CD1 1 ATOM 2515 C CD2 . PHE A 1 315 ? 17.160 80.776 82.305 1.00 62.84 ? 314 PHE A CD2 1 ATOM 2516 C CE1 . PHE A 1 315 ? 19.883 81.243 82.173 1.00 60.68 ? 314 PHE A CE1 1 ATOM 2517 C CE2 . PHE A 1 315 ? 18.031 79.735 82.083 1.00 62.64 ? 314 PHE A CE2 1 ATOM 2518 C CZ . PHE A 1 315 ? 19.394 79.969 82.014 1.00 62.83 ? 314 PHE A CZ 1 ATOM 2519 N N . PRO A 1 316 ? 15.731 86.170 84.125 1.00 81.80 ? 315 PRO A N 1 ATOM 2520 C CA . PRO A 1 316 ? 17.064 86.774 84.011 1.00 85.19 ? 315 PRO A CA 1 ATOM 2521 C C . PRO A 1 316 ? 17.694 87.229 85.347 1.00 88.89 ? 315 PRO A C 1 ATOM 2522 O O . PRO A 1 316 ? 17.092 87.947 86.115 1.00 99.37 ? 315 PRO A O 1 ATOM 2523 C CB . PRO A 1 316 ? 16.774 88.009 83.162 1.00 84.54 ? 315 PRO A CB 1 ATOM 2524 C CG . PRO A 1 316 ? 15.402 88.429 83.598 1.00 83.67 ? 315 PRO A CG 1 ATOM 2525 C CD . PRO A 1 316 ? 14.672 87.191 84.061 1.00 82.12 ? 315 PRO A CD 1 ATOM 2526 N N . ASP A 1 317 ? 18.949 86.857 85.588 1.00 88.25 ? 316 ASP A N 1 ATOM 2527 C CA . ASP A 1 317 ? 19.616 87.115 86.860 1.00 87.35 ? 316 ASP A CA 1 ATOM 2528 C C . ASP A 1 317 ? 20.591 88.253 86.661 1.00 87.95 ? 316 ASP A C 1 ATOM 2529 O O . ASP A 1 317 ? 21.497 88.137 85.832 1.00 82.32 ? 316 ASP A O 1 ATOM 2530 C CB . ASP A 1 317 ? 20.394 85.863 87.283 1.00 87.59 ? 316 ASP A CB 1 ATOM 2531 C CG . ASP A 1 317 ? 20.688 85.807 88.774 1.00 87.35 ? 316 ASP A CG 1 ATOM 2532 O OD1 . ASP A 1 317 ? 20.478 86.818 89.479 1.00 96.56 ? 316 ASP A OD1 1 ATOM 2533 O OD2 . ASP A 1 317 ? 21.146 84.736 89.237 1.00 82.89 ? 316 ASP A OD2 1 ATOM 2534 N N . ARG A 1 318 ? 20.427 89.340 87.410 1.00 97.11 ? 317 ARG A N 1 ATOM 2535 C CA . ARG A 1 318 ? 21.331 90.527 87.298 1.00 105.79 ? 317 ARG A CA 1 ATOM 2536 C C . ARG A 1 318 ? 22.848 90.154 87.307 1.00 103.40 ? 317 ARG A C 1 ATOM 2537 O O . ARG A 1 318 ? 23.658 90.556 86.438 1.00 100.02 ? 317 ARG A O 1 ATOM 2538 C CB . ARG A 1 318 ? 21.066 91.500 88.457 1.00 112.41 ? 317 ARG A CB 1 ATOM 2539 C CG . ARG A 1 318 ? 19.731 92.217 88.363 1.00 118.42 ? 317 ARG A CG 1 ATOM 2540 C CD . ARG A 1 318 ? 19.649 93.354 89.367 1.00 125.66 ? 317 ARG A CD 1 ATOM 2541 N NE . ARG A 1 318 ? 18.268 93.740 89.651 1.00 130.97 ? 317 ARG A NE 1 ATOM 2542 C CZ . ARG A 1 318 ? 17.888 94.520 90.664 1.00 133.04 ? 317 ARG A CZ 1 ATOM 2543 N NH1 . ARG A 1 318 ? 18.782 95.018 91.516 1.00 134.40 ? 317 ARG A NH1 1 ATOM 2544 N NH2 . ARG A 1 318 ? 16.601 94.805 90.830 1.00 132.17 ? 317 ARG A NH2 1 ATOM 2545 N N . ASP A 1 319 ? 23.218 89.424 88.343 1.00 96.71 ? 318 ASP A N 1 ATOM 2546 C CA . ASP A 1 319 ? 24.559 88.939 88.506 1.00 91.14 ? 318 ASP A CA 1 ATOM 2547 C C . ASP A 1 319 ? 24.404 87.436 88.490 1.00 78.85 ? 318 ASP A C 1 ATOM 2548 O O . ASP A 1 319 ? 23.919 86.910 89.452 1.00 82.37 ? 318 ASP A O 1 ATOM 2549 C CB . ASP A 1 319 ? 25.065 89.437 89.883 1.00 95.61 ? 318 ASP A CB 1 ATOM 2550 C CG . ASP A 1 319 ? 26.463 88.925 90.251 1.00 98.53 ? 318 ASP A CG 1 ATOM 2551 O OD1 . ASP A 1 319 ? 27.434 89.379 89.619 1.00 102.03 ? 318 ASP A OD1 1 ATOM 2552 O OD2 . ASP A 1 319 ? 26.600 88.113 91.199 1.00 92.83 ? 318 ASP A OD2 1 ATOM 2553 N N . PRO A 1 320 ? 24.895 86.697 87.445 1.00 65.45 ? 319 PRO A N 1 ATOM 2554 C CA . PRO A 1 320 ? 25.187 85.249 87.704 1.00 59.90 ? 319 PRO A CA 1 ATOM 2555 C C . PRO A 1 320 ? 26.517 85.007 88.434 1.00 55.02 ? 319 PRO A C 1 ATOM 2556 O O . PRO A 1 320 ? 27.391 85.870 88.375 1.00 55.23 ? 319 PRO A O 1 ATOM 2557 C CB . PRO A 1 320 ? 25.275 84.652 86.305 1.00 59.25 ? 319 PRO A CB 1 ATOM 2558 C CG . PRO A 1 320 ? 25.805 85.773 85.479 1.00 60.24 ? 319 PRO A CG 1 ATOM 2559 C CD . PRO A 1 320 ? 25.174 87.035 86.033 1.00 62.84 ? 319 PRO A CD 1 ATOM 2560 N N . LYS A 1 321 ? 26.589 83.913 89.171 1.00 51.00 ? 320 LYS A N 1 ATOM 2561 C CA . LYS A 1 321 ? 27.806 83.557 89.884 1.00 49.51 ? 320 LYS A CA 1 ATOM 2562 C C . LYS A 1 321 ? 28.719 82.868 88.896 1.00 48.71 ? 320 LYS A C 1 ATOM 2563 O O . LYS A 1 321 ? 28.205 82.143 88.055 1.00 46.10 ? 320 LYS A O 1 ATOM 2564 C CB . LYS A 1 321 ? 27.516 82.686 91.106 1.00 49.65 ? 320 LYS A CB 1 ATOM 2565 C CG . LYS A 1 321 ? 26.296 83.130 91.901 1.00 50.38 ? 320 LYS A CG 1 ATOM 2566 C CD . LYS A 1 321 ? 26.567 84.447 92.604 1.00 51.80 ? 320 LYS A CD 1 ATOM 2567 C CE . LYS A 1 321 ? 25.282 85.095 93.083 1.00 53.23 ? 320 LYS A CE 1 ATOM 2568 N NZ . LYS A 1 321 ? 25.469 86.563 93.236 1.00 55.17 ? 320 LYS A NZ 1 ATOM 2569 N N . ILE A 1 322 ? 30.034 83.064 88.972 1.00 48.75 ? 321 ILE A N 1 ATOM 2570 C CA . ILE A 1 322 ? 30.918 82.576 87.917 1.00 47.30 ? 321 ILE A CA 1 ATOM 2571 C C . ILE A 1 322 ? 31.980 81.643 88.467 1.00 48.06 ? 321 ILE A C 1 ATOM 2572 O O . ILE A 1 322 ? 32.629 81.941 89.481 1.00 49.28 ? 321 ILE A O 1 ATOM 2573 C CB . ILE A 1 322 ? 31.601 83.736 87.165 1.00 47.62 ? 321 ILE A CB 1 ATOM 2574 C CG1 . ILE A 1 322 ? 30.541 84.688 86.612 1.00 47.24 ? 321 ILE A CG1 1 ATOM 2575 C CG2 . ILE A 1 322 ? 32.502 83.196 86.049 1.00 48.05 ? 321 ILE A CG2 1 ATOM 2576 C CD1 . ILE A 1 322 ? 31.097 85.774 85.712 1.00 49.50 ? 321 ILE A CD1 1 ATOM 2577 N N . CYS A 1 323 ? 32.137 80.515 87.784 1.00 46.38 ? 322 CYS A N 1 ATOM 2578 C CA . CYS A 1 323 ? 33.235 79.567 88.023 1.00 46.95 ? 322 CYS A CA 1 ATOM 2579 C C . CYS A 1 323 ? 34.316 79.767 86.963 1.00 47.62 ? 322 CYS A C 1 ATOM 2580 O O . CYS A 1 323 ? 34.005 79.834 85.776 1.00 48.15 ? 322 CYS A O 1 ATOM 2581 C CB . CYS A 1 323 ? 32.731 78.131 87.937 1.00 47.78 ? 322 CYS A CB 1 ATOM 2582 S SG . CYS A 1 323 ? 31.978 77.469 89.439 1.00 48.56 ? 322 CYS A SG 1 ATOM 2583 N N . PHE A 1 324 ? 35.577 79.842 87.388 1.00 48.11 ? 323 PHE A N 1 ATOM 2584 C CA . PHE A 1 324 ? 36.681 80.173 86.488 1.00 47.79 ? 323 PHE A CA 1 ATOM 2585 C C . PHE A 1 324 ? 37.629 79.003 86.322 1.00 49.05 ? 323 PHE A C 1 ATOM 2586 O O . PHE A 1 324 ? 37.942 78.315 87.299 1.00 49.34 ? 323 PHE A O 1 ATOM 2587 C CB . PHE A 1 324 ? 37.494 81.351 87.054 1.00 48.28 ? 323 PHE A CB 1 ATOM 2588 C CG . PHE A 1 324 ? 36.760 82.656 87.037 1.00 47.05 ? 323 PHE A CG 1 ATOM 2589 C CD1 . PHE A 1 324 ? 36.794 83.465 85.907 1.00 46.10 ? 323 PHE A CD1 1 ATOM 2590 C CD2 . PHE A 1 324 ? 36.029 83.072 88.143 1.00 46.31 ? 323 PHE A CD2 1 ATOM 2591 C CE1 . PHE A 1 324 ? 36.112 84.666 85.885 1.00 45.44 ? 323 PHE A CE1 1 ATOM 2592 C CE2 . PHE A 1 324 ? 35.342 84.270 88.125 1.00 46.29 ? 323 PHE A CE2 1 ATOM 2593 C CZ . PHE A 1 324 ? 35.381 85.068 86.994 1.00 45.60 ? 323 PHE A CZ 1 ATOM 2594 N N . GLY A 1 325 ? 38.122 78.808 85.099 1.00 49.22 ? 324 GLY A N 1 ATOM 2595 C CA . GLY A 1 325 ? 39.215 77.885 84.826 1.00 49.39 ? 324 GLY A CA 1 ATOM 2596 C C . GLY A 1 325 ? 40.385 78.616 84.185 1.00 49.82 ? 324 GLY A C 1 ATOM 2597 O O . GLY A 1 325 ? 40.472 79.842 84.232 1.00 49.92 ? 324 GLY A O 1 ATOM 2598 N N . ASP A 1 326 ? 41.295 77.861 83.581 1.00 50.35 ? 325 ASP A N 1 ATOM 2599 C CA . ASP A 1 326 ? 42.495 78.436 82.987 1.00 51.74 ? 325 ASP A CA 1 ATOM 2600 C C . ASP A 1 326 ? 42.222 78.829 81.529 1.00 50.90 ? 325 ASP A C 1 ATOM 2601 O O . ASP A 1 326 ? 41.284 78.327 80.902 1.00 50.45 ? 325 ASP A O 1 ATOM 2602 C CB . ASP A 1 326 ? 43.648 77.421 83.060 1.00 54.04 ? 325 ASP A CB 1 ATOM 2603 C CG . ASP A 1 326 ? 45.039 78.077 83.115 1.00 56.59 ? 325 ASP A CG 1 ATOM 2604 O OD1 . ASP A 1 326 ? 45.166 79.296 82.844 1.00 55.71 ? 325 ASP A OD1 1 ATOM 2605 O OD2 . ASP A 1 326 ? 46.019 77.357 83.435 1.00 59.17 ? 325 ASP A OD2 1 ATOM 2606 N N . GLY A 1 327 ? 43.053 79.722 81.001 1.00 50.86 ? 326 GLY A N 1 ATOM 2607 C CA . GLY A 1 327 ? 42.928 80.233 79.633 1.00 50.34 ? 326 GLY A CA 1 ATOM 2608 C C . GLY A 1 327 ? 43.456 81.661 79.555 1.00 50.22 ? 326 GLY A C 1 ATOM 2609 O O . GLY A 1 327 ? 44.322 82.050 80.349 1.00 51.59 ? 326 GLY A O 1 ATOM 2610 N N . ASP A 1 328 ? 42.914 82.446 78.625 1.00 49.23 ? 327 ASP A N 1 ATOM 2611 C CA . ASP A 1 328 ? 43.388 83.808 78.384 1.00 50.20 ? 327 ASP A CA 1 ATOM 2612 C C . ASP A 1 328 ? 42.395 84.890 78.783 1.00 49.58 ? 327 ASP A C 1 ATOM 2613 O O . ASP A 1 328 ? 42.547 86.054 78.395 1.00 49.68 ? 327 ASP A O 1 ATOM 2614 C CB . ASP A 1 328 ? 43.803 83.977 76.913 1.00 51.54 ? 327 ASP A CB 1 ATOM 2615 C CG . ASP A 1 328 ? 42.622 83.996 75.955 1.00 50.82 ? 327 ASP A CG 1 ATOM 2616 O OD1 . ASP A 1 328 ? 41.464 83.970 76.417 1.00 51.22 ? 327 ASP A OD1 1 ATOM 2617 O OD2 . ASP A 1 328 ? 42.855 84.039 74.724 1.00 51.89 ? 327 ASP A OD2 1 ATOM 2618 N N . GLY A 1 329 ? 41.392 84.501 79.573 1.00 50.03 ? 328 GLY A N 1 ATOM 2619 C CA . GLY A 1 329 ? 40.334 85.410 79.993 1.00 49.29 ? 328 GLY A CA 1 ATOM 2620 C C . GLY A 1 329 ? 39.045 85.205 79.227 1.00 49.60 ? 328 GLY A C 1 ATOM 2621 O O . GLY A 1 329 ? 37.968 85.493 79.731 1.00 52.15 ? 328 GLY A O 1 ATOM 2622 N N . THR A 1 330 ? 39.154 84.699 78.003 1.00 49.17 ? 329 THR A N 1 ATOM 2623 C CA . THR A 1 330 ? 38.023 84.512 77.107 1.00 48.72 ? 329 THR A CA 1 ATOM 2624 C C . THR A 1 330 ? 38.001 83.069 76.591 1.00 48.39 ? 329 THR A C 1 ATOM 2625 O O . THR A 1 330 ? 37.005 82.374 76.731 1.00 49.00 ? 329 THR A O 1 ATOM 2626 C CB . THR A 1 330 ? 38.135 85.474 75.898 1.00 49.82 ? 329 THR A CB 1 ATOM 2627 O OG1 . THR A 1 330 ? 38.122 86.831 76.358 1.00 52.96 ? 329 THR A OG1 1 ATOM 2628 C CG2 . THR A 1 330 ? 36.994 85.265 74.924 1.00 48.60 ? 329 THR A CG2 1 ATOM 2629 N N . VAL A 1 331 ? 39.113 82.635 76.004 1.00 48.14 ? 330 VAL A N 1 ATOM 2630 C CA . VAL A 1 331 ? 39.235 81.297 75.451 1.00 48.76 ? 330 VAL A CA 1 ATOM 2631 C C . VAL A 1 331 ? 39.750 80.324 76.511 1.00 49.15 ? 330 VAL A C 1 ATOM 2632 O O . VAL A 1 331 ? 40.822 80.526 77.102 1.00 47.80 ? 330 VAL A O 1 ATOM 2633 C CB . VAL A 1 331 ? 40.187 81.287 74.238 1.00 50.50 ? 330 VAL A CB 1 ATOM 2634 C CG1 . VAL A 1 331 ? 40.454 79.865 73.767 1.00 51.27 ? 330 VAL A CG1 1 ATOM 2635 C CG2 . VAL A 1 331 ? 39.608 82.132 73.110 1.00 50.60 ? 330 VAL A CG2 1 ATOM 2636 N N . ASN A 1 332 ? 38.971 79.273 76.742 1.00 49.30 ? 331 ASN A N 1 ATOM 2637 C CA . ASN A 1 332 ? 39.320 78.299 77.754 1.00 49.28 ? 331 ASN A CA 1 ATOM 2638 C C . ASN A 1 332 ? 40.531 77.512 77.251 1.00 51.19 ? 331 ASN A C 1 ATOM 2639 O O . ASN A 1 332 ? 40.700 77.263 76.048 1.00 49.52 ? 331 ASN A O 1 ATOM 2640 C CB . ASN A 1 332 ? 38.121 77.413 78.102 1.00 49.07 ? 331 ASN A CB 1 ATOM 2641 C CG . ASN A 1 332 ? 36.846 78.224 78.348 1.00 49.16 ? 331 ASN A CG 1 ATOM 2642 O OD1 . ASN A 1 332 ? 36.154 78.633 77.396 1.00 51.19 ? 331 ASN A OD1 1 ATOM 2643 N ND2 . ASN A 1 332 ? 36.526 78.462 79.618 1.00 47.55 ? 331 ASN A ND2 1 ATOM 2644 N N . LEU A 1 333 ? 41.404 77.155 78.179 1.00 54.15 ? 332 LEU A N 1 ATOM 2645 C CA . LEU A 1 333 ? 42.626 76.417 77.846 1.00 56.12 ? 332 LEU A CA 1 ATOM 2646 C C . LEU A 1 333 ? 42.352 75.149 77.030 1.00 58.51 ? 332 LEU A C 1 ATOM 2647 O O . LEU A 1 333 ? 43.127 74.804 76.164 1.00 61.04 ? 332 LEU A O 1 ATOM 2648 C CB . LEU A 1 333 ? 43.397 76.050 79.119 1.00 57.35 ? 332 LEU A CB 1 ATOM 2649 C CG . LEU A 1 333 ? 44.640 75.162 78.977 1.00 58.05 ? 332 LEU A CG 1 ATOM 2650 C CD1 . LEU A 1 333 ? 45.641 75.750 78.001 1.00 58.54 ? 332 LEU A CD1 1 ATOM 2651 C CD2 . LEU A 1 333 ? 45.279 74.967 80.336 1.00 59.32 ? 332 LEU A CD2 1 ATOM 2652 N N . LYS A 1 334 ? 41.253 74.456 77.297 1.00 60.94 ? 333 LYS A N 1 ATOM 2653 C CA . LYS A 1 334 ? 40.896 73.264 76.532 1.00 64.30 ? 333 LYS A CA 1 ATOM 2654 C C . LYS A 1 334 ? 40.879 73.433 75.006 1.00 62.16 ? 333 LYS A C 1 ATOM 2655 O O . LYS A 1 334 ? 41.127 72.469 74.306 1.00 61.75 ? 333 LYS A O 1 ATOM 2656 C CB . LYS A 1 334 ? 39.492 72.786 76.924 1.00 66.00 ? 333 LYS A CB 1 ATOM 2657 C CG . LYS A 1 334 ? 39.419 71.970 78.197 1.00 71.37 ? 333 LYS A CG 1 ATOM 2658 C CD . LYS A 1 334 ? 37.978 71.585 78.494 1.00 74.69 ? 333 LYS A CD 1 ATOM 2659 C CE . LYS A 1 334 ? 37.766 71.257 79.965 1.00 78.44 ? 333 LYS A CE 1 ATOM 2660 N NZ . LYS A 1 334 ? 38.490 70.023 80.385 1.00 83.05 ? 333 LYS A NZ 1 ATOM 2661 N N . SER A 1 335 ? 40.581 74.629 74.499 1.00 60.17 ? 334 SER A N 1 ATOM 2662 C CA . SER A 1 335 ? 40.628 74.875 73.054 1.00 61.77 ? 334 SER A CA 1 ATOM 2663 C C . SER A 1 335 ? 41.993 74.505 72.437 1.00 65.04 ? 334 SER A C 1 ATOM 2664 O O . SER A 1 335 ? 42.050 73.951 71.343 1.00 65.24 ? 334 SER A O 1 ATOM 2665 C CB . SER A 1 335 ? 40.258 76.321 72.734 1.00 60.65 ? 334 SER A CB 1 ATOM 2666 O OG . SER A 1 335 ? 38.884 76.564 73.015 1.00 61.47 ? 334 SER A OG 1 ATOM 2667 N N . ALA A 1 336 ? 43.079 74.770 73.155 1.00 66.23 ? 335 ALA A N 1 ATOM 2668 C CA . ALA A 1 336 ? 44.426 74.453 72.668 1.00 69.56 ? 335 ALA A CA 1 ATOM 2669 C C . ALA A 1 336 ? 44.741 72.954 72.554 1.00 70.88 ? 335 ALA A C 1 ATOM 2670 O O . ALA A 1 336 ? 45.747 72.584 71.961 1.00 72.01 ? 335 ALA A O 1 ATOM 2671 C CB . ALA A 1 336 ? 45.474 75.127 73.542 1.00 71.66 ? 335 ALA A CB 1 ATOM 2672 N N . LEU A 1 337 ? 43.912 72.090 73.127 1.00 72.29 ? 336 LEU A N 1 ATOM 2673 C CA . LEU A 1 337 ? 44.066 70.647 72.909 1.00 75.86 ? 336 LEU A CA 1 ATOM 2674 C C . LEU A 1 337 ? 43.671 70.249 71.481 1.00 74.71 ? 336 LEU A C 1 ATOM 2675 O O . LEU A 1 337 ? 44.049 69.173 71.009 1.00 74.44 ? 336 LEU A O 1 ATOM 2676 C CB . LEU A 1 337 ? 43.259 69.834 73.937 1.00 77.75 ? 336 LEU A CB 1 ATOM 2677 C CG . LEU A 1 337 ? 43.874 69.755 75.344 1.00 81.33 ? 336 LEU A CG 1 ATOM 2678 C CD1 . LEU A 1 337 ? 42.855 69.264 76.367 1.00 80.67 ? 336 LEU A CD1 1 ATOM 2679 C CD2 . LEU A 1 337 ? 45.126 68.878 75.351 1.00 83.08 ? 336 LEU A CD2 1 ATOM 2680 N N . GLN A 1 338 ? 42.913 71.113 70.804 1.00 71.14 ? 337 GLN A N 1 ATOM 2681 C CA . GLN A 1 338 ? 42.471 70.849 69.442 1.00 69.66 ? 337 GLN A CA 1 ATOM 2682 C C . GLN A 1 338 ? 43.634 70.906 68.453 1.00 69.82 ? 337 GLN A C 1 ATOM 2683 O O . GLN A 1 338 ? 43.677 70.109 67.514 1.00 70.87 ? 337 GLN A O 1 ATOM 2684 C CB . GLN A 1 338 ? 41.369 71.831 69.042 1.00 69.25 ? 337 GLN A CB 1 ATOM 2685 C CG . GLN A 1 338 ? 40.738 71.580 67.678 1.00 71.02 ? 337 GLN A CG 1 ATOM 2686 C CD . GLN A 1 338 ? 40.051 70.235 67.564 1.00 74.60 ? 337 GLN A CD 1 ATOM 2687 O OE1 . GLN A 1 338 ? 39.755 69.579 68.569 1.00 76.34 ? 337 GLN A OE1 1 ATOM 2688 N NE2 . GLN A 1 338 ? 39.779 69.821 66.329 1.00 76.54 ? 337 GLN A NE2 1 ATOM 2689 N N . CYS A 1 339 ? 44.565 71.841 68.655 1.00 68.55 ? 338 CYS A N 1 ATOM 2690 C CA A CYS A 1 339 ? 45.760 71.903 67.807 0.50 71.03 ? 338 CYS A CA 1 ATOM 2691 C CA B CYS A 1 339 ? 45.775 71.907 67.848 0.50 68.82 ? 338 CYS A CA 1 ATOM 2692 C C . CYS A 1 339 ? 46.642 70.675 68.040 1.00 71.18 ? 338 CYS A C 1 ATOM 2693 O O . CYS A 1 339 ? 47.272 70.194 67.106 1.00 73.42 ? 338 CYS A O 1 ATOM 2694 C CB A CYS A 1 339 ? 46.559 73.210 67.951 0.50 72.28 ? 338 CYS A CB 1 ATOM 2695 C CB B CYS A 1 339 ? 46.597 73.127 68.239 0.50 68.00 ? 338 CYS A CB 1 ATOM 2696 S SG A CYS A 1 339 ? 46.830 73.823 69.623 0.50 77.55 ? 338 CYS A SG 1 ATOM 2697 S SG B CYS A 1 339 ? 45.679 74.673 68.237 0.50 64.18 ? 338 CYS A SG 1 ATOM 2698 N N . GLN A 1 340 ? 46.671 70.167 69.269 1.00 70.55 ? 339 GLN A N 1 ATOM 2699 C CA . GLN A 1 340 ? 47.453 68.984 69.589 1.00 72.73 ? 339 GLN A CA 1 ATOM 2700 C C . GLN A 1 340 ? 46.938 67.777 68.808 1.00 69.95 ? 339 GLN A C 1 ATOM 2701 O O . GLN A 1 340 ? 47.730 67.009 68.276 1.00 72.81 ? 339 GLN A O 1 ATOM 2702 C CB . GLN A 1 340 ? 47.447 68.709 71.098 1.00 76.37 ? 339 GLN A CB 1 ATOM 2703 C CG . GLN A 1 340 ? 48.700 67.987 71.592 1.00 82.35 ? 339 GLN A CG 1 ATOM 2704 C CD . GLN A 1 340 ? 48.773 67.869 73.110 1.00 85.88 ? 339 GLN A CD 1 ATOM 2705 O OE1 . GLN A 1 340 ? 48.241 68.704 73.847 1.00 86.11 ? 339 GLN A OE1 1 ATOM 2706 N NE2 . GLN A 1 340 ? 49.448 66.827 73.583 1.00 89.67 ? 339 GLN A NE2 1 ATOM 2707 N N . ALA A 1 341 ? 45.620 67.650 68.683 1.00 65.10 ? 340 ALA A N 1 ATOM 2708 C CA . ALA A 1 341 ? 45.013 66.555 67.932 1.00 64.66 ? 340 ALA A CA 1 ATOM 2709 C C . ALA A 1 341 ? 45.386 66.585 66.447 1.00 65.39 ? 340 ALA A C 1 ATOM 2710 O O . ALA A 1 341 ? 45.506 65.547 65.799 1.00 69.86 ? 340 ALA A O 1 ATOM 2711 C CB . ALA A 1 341 ? 43.496 66.586 68.083 1.00 62.78 ? 340 ALA A CB 1 ATOM 2712 N N . TRP A 1 342 ? 45.574 67.781 65.907 1.00 64.87 ? 341 TRP A N 1 ATOM 2713 C CA . TRP A 1 342 ? 45.904 67.934 64.502 1.00 65.41 ? 341 TRP A CA 1 ATOM 2714 C C . TRP A 1 342 ? 47.317 67.448 64.137 1.00 69.15 ? 341 TRP A C 1 ATOM 2715 O O . TRP A 1 342 ? 47.568 67.090 62.981 1.00 69.23 ? 341 TRP A O 1 ATOM 2716 C CB . TRP A 1 342 ? 45.720 69.394 64.065 1.00 62.75 ? 341 TRP A CB 1 ATOM 2717 C CG . TRP A 1 342 ? 44.282 69.871 64.023 1.00 59.35 ? 341 TRP A CG 1 ATOM 2718 C CD1 . TRP A 1 342 ? 43.166 69.111 63.823 1.00 59.41 ? 341 TRP A CD1 1 ATOM 2719 C CD2 . TRP A 1 342 ? 43.829 71.223 64.119 1.00 56.43 ? 341 TRP A CD2 1 ATOM 2720 N NE1 . TRP A 1 342 ? 42.041 69.903 63.818 1.00 57.78 ? 341 TRP A NE1 1 ATOM 2721 C CE2 . TRP A 1 342 ? 42.423 71.207 63.991 1.00 56.12 ? 341 TRP A CE2 1 ATOM 2722 C CE3 . TRP A 1 342 ? 44.474 72.447 64.308 1.00 55.63 ? 341 TRP A CE3 1 ATOM 2723 C CZ2 . TRP A 1 342 ? 41.650 72.368 64.055 1.00 54.29 ? 341 TRP A CZ2 1 ATOM 2724 C CZ3 . TRP A 1 342 ? 43.707 73.601 64.372 1.00 54.68 ? 341 TRP A CZ3 1 ATOM 2725 C CH2 . TRP A 1 342 ? 42.308 73.552 64.245 1.00 53.64 ? 341 TRP A CH2 1 ATOM 2726 N N . GLN A 1 343 ? 48.228 67.432 65.105 1.00 72.85 ? 342 GLN A N 1 ATOM 2727 C CA . GLN A 1 343 ? 49.604 66.992 64.856 1.00 77.42 ? 342 GLN A CA 1 ATOM 2728 C C . GLN A 1 343 ? 49.695 65.636 64.161 1.00 78.30 ? 342 GLN A C 1 ATOM 2729 O O . GLN A 1 343 ? 50.524 65.452 63.295 1.00 77.65 ? 342 GLN A O 1 ATOM 2730 C CB . GLN A 1 343 ? 50.430 66.957 66.153 1.00 81.25 ? 342 GLN A CB 1 ATOM 2731 C CG . GLN A 1 343 ? 51.063 68.295 66.503 1.00 83.61 ? 342 GLN A CG 1 ATOM 2732 C CD . GLN A 1 343 ? 52.027 68.225 67.669 1.00 88.40 ? 342 GLN A CD 1 ATOM 2733 O OE1 . GLN A 1 343 ? 53.244 68.216 67.477 1.00 93.84 ? 342 GLN A OE1 1 ATOM 2734 N NE2 . GLN A 1 343 ? 51.492 68.173 68.886 1.00 89.45 ? 342 GLN A NE2 1 ATOM 2735 N N . SER A 1 344 ? 48.833 64.701 64.532 1.00 79.04 ? 343 SER A N 1 ATOM 2736 C CA . SER A 1 344 ? 48.886 63.357 63.965 1.00 82.12 ? 343 SER A CA 1 ATOM 2737 C C . SER A 1 344 ? 48.039 63.208 62.700 1.00 82.66 ? 343 SER A C 1 ATOM 2738 O O . SER A 1 344 ? 48.079 62.153 62.063 1.00 83.23 ? 343 SER A O 1 ATOM 2739 C CB . SER A 1 344 ? 48.433 62.322 65.007 1.00 82.69 ? 343 SER A CB 1 ATOM 2740 O OG . SER A 1 344 ? 47.068 62.495 65.350 1.00 80.99 ? 343 SER A OG 1 ATOM 2741 N N . ARG A 1 345 ? 47.268 64.237 62.347 1.00 81.35 ? 344 ARG A N 1 ATOM 2742 C CA . ARG A 1 345 ? 46.348 64.154 61.200 1.00 81.04 ? 344 ARG A CA 1 ATOM 2743 C C . ARG A 1 345 ? 46.812 64.914 59.957 1.00 79.06 ? 344 ARG A C 1 ATOM 2744 O O . ARG A 1 345 ? 46.167 64.843 58.913 1.00 78.10 ? 344 ARG A O 1 ATOM 2745 C CB . ARG A 1 345 ? 44.951 64.636 61.597 1.00 81.50 ? 344 ARG A CB 1 ATOM 2746 C CG . ARG A 1 345 ? 44.330 63.865 62.747 1.00 84.80 ? 344 ARG A CG 1 ATOM 2747 C CD . ARG A 1 345 ? 42.810 63.938 62.715 1.00 87.21 ? 344 ARG A CD 1 ATOM 2748 N NE . ARG A 1 345 ? 42.209 63.549 63.998 1.00 91.13 ? 344 ARG A NE 1 ATOM 2749 C CZ . ARG A 1 345 ? 41.839 64.388 64.974 1.00 90.55 ? 344 ARG A CZ 1 ATOM 2750 N NH1 . ARG A 1 345 ? 41.995 65.704 64.854 1.00 89.29 ? 344 ARG A NH1 1 ATOM 2751 N NH2 . ARG A 1 345 ? 41.304 63.904 66.094 1.00 89.15 ? 344 ARG A NH2 1 ATOM 2752 N N . GLN A 1 346 ? 47.905 65.661 60.067 1.00 77.70 ? 345 GLN A N 1 ATOM 2753 C CA . GLN A 1 346 ? 48.443 66.348 58.892 1.00 76.24 ? 345 GLN A CA 1 ATOM 2754 C C . GLN A 1 346 ? 49.950 66.194 58.867 1.00 78.65 ? 345 GLN A C 1 ATOM 2755 O O . GLN A 1 346 ? 50.563 65.953 59.897 1.00 80.16 ? 345 GLN A O 1 ATOM 2756 C CB . GLN A 1 346 ? 48.041 67.835 58.871 1.00 72.13 ? 345 GLN A CB 1 ATOM 2757 C CG . GLN A 1 346 ? 48.700 68.707 59.934 1.00 69.92 ? 345 GLN A CG 1 ATOM 2758 C CD . GLN A 1 346 ? 48.414 70.190 59.747 1.00 67.36 ? 345 GLN A CD 1 ATOM 2759 O OE1 . GLN A 1 346 ? 47.316 70.579 59.359 1.00 64.82 ? 345 GLN A OE1 1 ATOM 2760 N NE2 . GLN A 1 346 ? 49.408 71.024 60.021 1.00 67.04 ? 345 GLN A NE2 1 ATOM 2761 N N . GLU A 1 347 ? 50.532 66.298 57.680 1.00 81.06 ? 346 GLU A N 1 ATOM 2762 C CA . GLU A 1 347 ? 51.989 66.198 57.523 1.00 84.72 ? 346 GLU A CA 1 ATOM 2763 C C . GLU A 1 347 ? 52.733 67.461 57.878 1.00 82.60 ? 346 GLU A C 1 ATOM 2764 O O . GLU A 1 347 ? 53.843 67.410 58.407 1.00 82.87 ? 346 GLU A O 1 ATOM 2765 C CB . GLU A 1 347 ? 52.359 65.782 56.090 1.00 88.57 ? 346 GLU A CB 1 ATOM 2766 C CG . GLU A 1 347 ? 51.915 64.378 55.737 1.00 92.54 ? 346 GLU A CG 1 ATOM 2767 C CD . GLU A 1 347 ? 52.931 63.316 56.121 1.00 97.33 ? 346 GLU A CD 1 ATOM 2768 O OE1 . GLU A 1 347 ? 53.833 63.081 55.296 1.00 102.66 ? 346 GLU A OE1 1 ATOM 2769 O OE2 . GLU A 1 347 ? 52.828 62.706 57.219 1.00 96.09 ? 346 GLU A OE2 1 ATOM 2770 N N . HIS A 1 348 ? 52.141 68.612 57.575 1.00 80.46 ? 347 HIS A N 1 ATOM 2771 C CA . HIS A 1 348 ? 52.732 69.884 57.958 1.00 78.32 ? 347 HIS A CA 1 ATOM 2772 C C . HIS A 1 348 ? 52.858 69.991 59.476 1.00 75.36 ? 347 HIS A C 1 ATOM 2773 O O . HIS A 1 348 ? 52.039 69.456 60.230 1.00 73.25 ? 347 HIS A O 1 ATOM 2774 C CB . HIS A 1 348 ? 51.911 71.048 57.403 1.00 76.91 ? 347 HIS A CB 1 ATOM 2775 C CG . HIS A 1 348 ? 51.968 71.156 55.914 1.00 76.68 ? 347 HIS A CG 1 ATOM 2776 N ND1 . HIS A 1 348 ? 51.121 70.453 55.086 1.00 77.13 ? 347 HIS A ND1 1 ATOM 2777 C CD2 . HIS A 1 348 ? 52.780 71.875 55.104 1.00 77.32 ? 347 HIS A CD2 1 ATOM 2778 C CE1 . HIS A 1 348 ? 51.406 70.736 53.828 1.00 79.00 ? 347 HIS A CE1 1 ATOM 2779 N NE2 . HIS A 1 348 ? 52.407 71.599 53.811 1.00 79.25 ? 347 HIS A NE2 1 ATOM 2780 N N . GLN A 1 349 ? 53.903 70.681 59.907 1.00 74.68 ? 348 GLN A N 1 ATOM 2781 C CA . GLN A 1 349 ? 54.189 70.825 61.323 1.00 74.46 ? 348 GLN A CA 1 ATOM 2782 C C . GLN A 1 349 ? 53.107 71.642 62.041 1.00 69.80 ? 348 GLN A C 1 ATOM 2783 O O . GLN A 1 349 ? 52.535 72.579 61.462 1.00 68.28 ? 348 GLN A O 1 ATOM 2784 C CB . GLN A 1 349 ? 55.570 71.469 61.497 1.00 77.08 ? 348 GLN A CB 1 ATOM 2785 C CG . GLN A 1 349 ? 56.206 71.254 62.862 1.00 80.78 ? 348 GLN A CG 1 ATOM 2786 C CD . GLN A 1 349 ? 57.711 71.490 62.862 1.00 84.03 ? 348 GLN A CD 1 ATOM 2787 O OE1 . GLN A 1 349 ? 58.404 71.105 63.807 1.00 87.55 ? 348 GLN A OE1 1 ATOM 2788 N NE2 . GLN A 1 349 ? 58.224 72.115 61.803 1.00 82.91 ? 348 GLN A NE2 1 ATOM 2789 N N . VAL A 1 350 ? 52.824 71.255 63.280 1.00 67.76 ? 349 VAL A N 1 ATOM 2790 C CA . VAL A 1 350 ? 51.946 71.999 64.170 1.00 64.78 ? 349 VAL A CA 1 ATOM 2791 C C . VAL A 1 350 ? 52.755 72.362 65.417 1.00 65.05 ? 349 VAL A C 1 ATOM 2792 O O . VAL A 1 350 ? 53.201 71.462 66.136 1.00 68.03 ? 349 VAL A O 1 ATOM 2793 C CB . VAL A 1 350 ? 50.719 71.167 64.583 1.00 63.27 ? 349 VAL A CB 1 ATOM 2794 C CG1 . VAL A 1 350 ? 49.837 71.957 65.542 1.00 61.19 ? 349 VAL A CG1 1 ATOM 2795 C CG2 . VAL A 1 350 ? 49.932 70.707 63.357 1.00 62.42 ? 349 VAL A CG2 1 ATOM 2796 N N . LEU A 1 351 ? 52.974 73.651 65.638 1.00 64.79 ? 350 LEU A N 1 ATOM 2797 C CA . LEU A 1 351 ? 53.783 74.119 66.761 1.00 66.82 ? 350 LEU A CA 1 ATOM 2798 C C . LEU A 1 351 ? 52.849 74.749 67.767 1.00 66.34 ? 350 LEU A C 1 ATOM 2799 O O . LEU A 1 351 ? 52.045 75.606 67.418 1.00 64.41 ? 350 LEU A O 1 ATOM 2800 C CB . LEU A 1 351 ? 54.832 75.117 66.277 1.00 67.79 ? 350 LEU A CB 1 ATOM 2801 C CG . LEU A 1 351 ? 55.881 74.470 65.361 1.00 71.43 ? 350 LEU A CG 1 ATOM 2802 C CD1 . LEU A 1 351 ? 56.393 75.440 64.307 1.00 70.88 ? 350 LEU A CD1 1 ATOM 2803 C CD2 . LEU A 1 351 ? 57.034 73.895 66.176 1.00 74.06 ? 350 LEU A CD2 1 ATOM 2804 N N . LEU A 1 352 ? 52.930 74.300 69.010 1.00 68.41 ? 351 LEU A N 1 ATOM 2805 C CA . LEU A 1 352 ? 52.158 74.901 70.093 1.00 67.63 ? 351 LEU A CA 1 ATOM 2806 C C . LEU A 1 352 ? 53.043 75.881 70.835 1.00 67.01 ? 351 LEU A C 1 ATOM 2807 O O . LEU A 1 352 ? 54.184 75.577 71.131 1.00 67.65 ? 351 LEU A O 1 ATOM 2808 C CB . LEU A 1 352 ? 51.618 73.829 71.036 1.00 70.11 ? 351 LEU A CB 1 ATOM 2809 C CG . LEU A 1 352 ? 50.263 73.246 70.618 1.00 71.36 ? 351 LEU A CG 1 ATOM 2810 C CD1 . LEU A 1 352 ? 50.337 72.570 69.254 1.00 71.73 ? 351 LEU A CD1 1 ATOM 2811 C CD2 . LEU A 1 352 ? 49.761 72.268 71.675 1.00 73.60 ? 351 LEU A CD2 1 ATOM 2812 N N . GLN A 1 353 ? 52.525 77.069 71.115 1.00 65.04 ? 352 GLN A N 1 ATOM 2813 C CA . GLN A 1 353 ? 53.259 78.041 71.918 1.00 64.56 ? 352 GLN A CA 1 ATOM 2814 C C . GLN A 1 353 ? 52.380 78.646 73.006 1.00 64.09 ? 352 GLN A C 1 ATOM 2815 O O . GLN A 1 353 ? 51.482 79.441 72.728 1.00 63.54 ? 352 GLN A O 1 ATOM 2816 C CB . GLN A 1 353 ? 53.834 79.141 71.023 1.00 63.75 ? 352 GLN A CB 1 ATOM 2817 C CG . GLN A 1 353 ? 54.650 80.204 71.745 1.00 64.51 ? 352 GLN A CG 1 ATOM 2818 C CD . GLN A 1 353 ? 55.885 79.644 72.427 1.00 66.59 ? 352 GLN A CD 1 ATOM 2819 O OE1 . GLN A 1 353 ? 56.828 79.208 71.765 1.00 68.35 ? 352 GLN A OE1 1 ATOM 2820 N NE2 . GLN A 1 353 ? 55.891 79.668 73.756 1.00 66.09 ? 352 GLN A NE2 1 ATOM 2821 N N . GLU A 1 354 ? 52.648 78.258 74.245 1.00 65.26 ? 353 GLU A N 1 ATOM 2822 C CA . GLU A 1 354 ? 52.002 78.856 75.404 1.00 65.38 ? 353 GLU A CA 1 ATOM 2823 C C . GLU A 1 354 ? 52.483 80.288 75.638 1.00 65.41 ? 353 GLU A C 1 ATOM 2824 O O . GLU A 1 354 ? 53.675 80.579 75.522 1.00 67.61 ? 353 GLU A O 1 ATOM 2825 C CB . GLU A 1 354 ? 52.292 78.021 76.651 1.00 68.45 ? 353 GLU A CB 1 ATOM 2826 C CG . GLU A 1 354 ? 51.541 78.463 77.903 1.00 69.89 ? 353 GLU A CG 1 ATOM 2827 C CD . GLU A 1 354 ? 51.891 77.637 79.132 1.00 72.24 ? 353 GLU A CD 1 ATOM 2828 O OE1 . GLU A 1 354 ? 52.896 76.896 79.093 1.00 75.62 ? 353 GLU A OE1 1 ATOM 2829 O OE2 . GLU A 1 354 ? 51.166 77.734 80.144 1.00 71.29 ? 353 GLU A OE2 1 ATOM 2830 N N . LEU A 1 355 ? 51.541 81.164 75.988 1.00 62.64 ? 354 LEU A N 1 ATOM 2831 C CA . LEU A 1 355 ? 51.817 82.560 76.339 1.00 63.13 ? 354 LEU A CA 1 ATOM 2832 C C . LEU A 1 355 ? 51.313 82.819 77.760 1.00 62.66 ? 354 LEU A C 1 ATOM 2833 O O . LEU A 1 355 ? 50.181 83.290 77.962 1.00 59.73 ? 354 LEU A O 1 ATOM 2834 C CB . LEU A 1 355 ? 51.130 83.500 75.351 1.00 61.66 ? 354 LEU A CB 1 ATOM 2835 C CG . LEU A 1 355 ? 51.511 83.311 73.883 1.00 61.73 ? 354 LEU A CG 1 ATOM 2836 C CD1 . LEU A 1 355 ? 50.674 84.233 73.012 1.00 60.42 ? 354 LEU A CD1 1 ATOM 2837 C CD2 . LEU A 1 355 ? 52.996 83.550 73.663 1.00 63.46 ? 354 LEU A CD2 1 ATOM 2838 N N . PRO A 1 356 ? 52.152 82.498 78.761 1.00 64.45 ? 355 PRO A N 1 ATOM 2839 C CA . PRO A 1 356 ? 51.665 82.589 80.138 1.00 64.73 ? 355 PRO A CA 1 ATOM 2840 C C . PRO A 1 356 ? 51.440 84.033 80.551 1.00 64.22 ? 355 PRO A C 1 ATOM 2841 O O . PRO A 1 356 ? 52.306 84.874 80.336 1.00 67.32 ? 355 PRO A O 1 ATOM 2842 C CB . PRO A 1 356 ? 52.793 81.962 80.969 1.00 66.11 ? 355 PRO A CB 1 ATOM 2843 C CG . PRO A 1 356 ? 53.738 81.354 79.986 1.00 67.92 ? 355 PRO A CG 1 ATOM 2844 C CD . PRO A 1 356 ? 53.568 82.110 78.710 1.00 66.08 ? 355 PRO A CD 1 ATOM 2845 N N . GLY A 1 357 ? 50.268 84.312 81.103 1.00 61.98 ? 356 GLY A N 1 ATOM 2846 C CA . GLY A 1 357 ? 49.917 85.643 81.565 1.00 63.08 ? 356 GLY A CA 1 ATOM 2847 C C . GLY A 1 357 ? 49.431 86.563 80.468 1.00 64.08 ? 356 GLY A C 1 ATOM 2848 O O . GLY A 1 357 ? 49.263 87.748 80.708 1.00 66.53 ? 356 GLY A O 1 ATOM 2849 N N . SER A 1 358 ? 49.187 86.042 79.266 1.00 65.03 ? 357 SER A N 1 ATOM 2850 C CA . SER A 1 358 ? 48.791 86.899 78.149 1.00 63.48 ? 357 SER A CA 1 ATOM 2851 C C . SER A 1 358 ? 47.273 86.887 77.961 1.00 61.41 ? 357 SER A C 1 ATOM 2852 O O . SER A 1 358 ? 46.684 85.853 77.656 1.00 59.95 ? 357 SER A O 1 ATOM 2853 C CB . SER A 1 358 ? 49.483 86.458 76.864 1.00 64.23 ? 357 SER A CB 1 ATOM 2854 O OG . SER A 1 358 ? 49.436 87.496 75.901 1.00 66.22 ? 357 SER A OG 1 ATOM 2855 N N . GLU A 1 359 ? 46.649 88.041 78.160 1.00 60.34 ? 358 GLU A N 1 ATOM 2856 C CA . GLU A 1 359 ? 45.202 88.179 77.990 1.00 58.34 ? 358 GLU A CA 1 ATOM 2857 C C . GLU A 1 359 ? 44.803 88.186 76.508 1.00 55.11 ? 358 GLU A C 1 ATOM 2858 O O . GLU A 1 359 ? 45.583 88.574 75.613 1.00 54.96 ? 358 GLU A O 1 ATOM 2859 C CB . GLU A 1 359 ? 44.712 89.466 78.685 1.00 59.48 ? 358 GLU A CB 1 ATOM 2860 C CG . GLU A 1 359 ? 43.194 89.598 78.857 1.00 58.99 ? 358 GLU A CG 1 ATOM 2861 C CD . GLU A 1 359 ? 42.477 90.215 77.649 1.00 60.52 ? 358 GLU A CD 1 ATOM 2862 O OE1 . GLU A 1 359 ? 43.051 91.100 76.969 1.00 61.69 ? 358 GLU A OE1 1 ATOM 2863 O OE2 . GLU A 1 359 ? 41.322 89.815 77.366 1.00 59.61 ? 358 GLU A OE2 1 ATOM 2864 N N . HIS A 1 360 ? 43.572 87.745 76.276 1.00 52.64 ? 359 HIS A N 1 ATOM 2865 C CA . HIS A 1 360 ? 43.042 87.512 74.932 1.00 52.05 ? 359 HIS A CA 1 ATOM 2866 C C . HIS A 1 360 ? 43.289 88.630 73.906 1.00 51.81 ? 359 HIS A C 1 ATOM 2867 O O . HIS A 1 360 ? 43.718 88.361 72.792 1.00 51.59 ? 359 HIS A O 1 ATOM 2868 C CB . HIS A 1 360 ? 41.535 87.233 75.039 1.00 50.37 ? 359 HIS A CB 1 ATOM 2869 C CG . HIS A 1 360 ? 40.894 86.803 73.758 1.00 49.81 ? 359 HIS A CG 1 ATOM 2870 N ND1 . HIS A 1 360 ? 41.159 85.588 73.161 1.00 49.92 ? 359 HIS A ND1 1 ATOM 2871 C CD2 . HIS A 1 360 ? 39.974 87.413 72.975 1.00 48.94 ? 359 HIS A CD2 1 ATOM 2872 C CE1 . HIS A 1 360 ? 40.447 85.481 72.054 1.00 47.91 ? 359 HIS A CE1 1 ATOM 2873 N NE2 . HIS A 1 360 ? 39.715 86.572 71.922 1.00 47.41 ? 359 HIS A NE2 1 ATOM 2874 N N . ILE A 1 361 ? 42.985 89.870 74.265 1.00 53.11 ? 360 ILE A N 1 ATOM 2875 C CA . ILE A 1 361 ? 43.197 90.999 73.359 1.00 54.27 ? 360 ILE A CA 1 ATOM 2876 C C . ILE A 1 361 ? 44.603 91.549 73.445 1.00 56.74 ? 360 ILE A C 1 ATOM 2877 O O . ILE A 1 361 ? 45.191 91.906 72.439 1.00 58.08 ? 360 ILE A O 1 ATOM 2878 C CB . ILE A 1 361 ? 42.239 92.180 73.657 1.00 55.57 ? 360 ILE A CB 1 ATOM 2879 C CG1 . ILE A 1 361 ? 40.772 91.751 73.604 1.00 53.76 ? 360 ILE A CG1 1 ATOM 2880 C CG2 . ILE A 1 361 ? 42.466 93.334 72.684 1.00 57.87 ? 360 ILE A CG2 1 ATOM 2881 C CD1 . ILE A 1 361 ? 40.258 91.413 72.231 1.00 54.16 ? 360 ILE A CD1 1 ATOM 2882 N N . GLU A 1 362 ? 45.137 91.631 74.656 1.00 60.27 ? 361 GLU A N 1 ATOM 2883 C CA . GLU A 1 362 ? 46.475 92.196 74.854 1.00 62.77 ? 361 GLU A CA 1 ATOM 2884 C C . GLU A 1 362 ? 47.553 91.423 74.098 1.00 61.41 ? 361 GLU A C 1 ATOM 2885 O O . GLU A 1 362 ? 48.583 91.999 73.743 1.00 63.61 ? 361 GLU A O 1 ATOM 2886 C CB . GLU A 1 362 ? 46.820 92.275 76.344 1.00 65.25 ? 361 GLU A CB 1 ATOM 2887 C CG . GLU A 1 362 ? 46.050 93.359 77.082 1.00 67.79 ? 361 GLU A CG 1 ATOM 2888 C CD . GLU A 1 362 ? 46.270 93.330 78.588 1.00 72.11 ? 361 GLU A CD 1 ATOM 2889 O OE1 . GLU A 1 362 ? 47.362 92.909 79.037 1.00 75.38 ? 361 GLU A OE1 1 ATOM 2890 O OE2 . GLU A 1 362 ? 45.344 93.731 79.324 1.00 72.61 ? 361 GLU A OE2 1 ATOM 2891 N N . MET A 1 363 ? 47.306 90.147 73.808 1.00 60.31 ? 362 MET A N 1 ATOM 2892 C CA . MET A 1 363 ? 48.300 89.351 73.095 1.00 61.23 ? 362 MET A CA 1 ATOM 2893 C C . MET A 1 363 ? 48.665 89.933 71.714 1.00 59.70 ? 362 MET A C 1 ATOM 2894 O O . MET A 1 363 ? 49.769 89.721 71.239 1.00 59.48 ? 362 MET A O 1 ATOM 2895 C CB . MET A 1 363 ? 47.891 87.871 72.986 1.00 62.22 ? 362 MET A CB 1 ATOM 2896 C CG . MET A 1 363 ? 46.859 87.530 71.915 1.00 62.73 ? 362 MET A CG 1 ATOM 2897 S SD . MET A 1 363 ? 46.707 85.746 71.620 1.00 63.71 ? 362 MET A SD 1 ATOM 2898 C CE . MET A 1 363 ? 46.240 85.144 73.248 1.00 64.97 ? 362 MET A CE 1 ATOM 2899 N N . LEU A 1 364 ? 47.746 90.674 71.102 1.00 58.40 ? 363 LEU A N 1 ATOM 2900 C CA . LEU A 1 364 ? 47.980 91.313 69.814 1.00 58.61 ? 363 LEU A CA 1 ATOM 2901 C C . LEU A 1 364 ? 48.993 92.461 69.805 1.00 59.39 ? 363 LEU A C 1 ATOM 2902 O O . LEU A 1 364 ? 49.521 92.821 68.737 1.00 59.45 ? 363 LEU A O 1 ATOM 2903 C CB . LEU A 1 364 ? 46.669 91.860 69.246 1.00 58.09 ? 363 LEU A CB 1 ATOM 2904 C CG . LEU A 1 364 ? 45.766 90.879 68.510 1.00 58.51 ? 363 LEU A CG 1 ATOM 2905 C CD1 . LEU A 1 364 ? 44.528 91.620 68.030 1.00 59.47 ? 363 LEU A CD1 1 ATOM 2906 C CD2 . LEU A 1 364 ? 46.488 90.228 67.336 1.00 58.10 ? 363 LEU A CD2 1 ATOM 2907 N N . ALA A 1 365 ? 49.230 93.062 70.969 1.00 59.04 ? 364 ALA A N 1 ATOM 2908 C CA . ALA A 1 365 ? 50.170 94.169 71.092 1.00 60.29 ? 364 ALA A CA 1 ATOM 2909 C C . ALA A 1 365 ? 51.348 93.785 71.983 1.00 62.24 ? 364 ALA A C 1 ATOM 2910 O O . ALA A 1 365 ? 52.165 94.630 72.324 1.00 63.49 ? 364 ALA A O 1 ATOM 2911 C CB . ALA A 1 365 ? 49.464 95.395 71.647 1.00 59.36 ? 364 ALA A CB 1 ATOM 2912 N N . ASN A 1 366 ? 51.468 92.502 72.310 1.00 62.16 ? 365 ASN A N 1 ATOM 2913 C CA . ASN A 1 366 ? 52.466 92.049 73.250 1.00 64.35 ? 365 ASN A CA 1 ATOM 2914 C C . ASN A 1 366 ? 53.797 91.760 72.542 1.00 64.89 ? 365 ASN A C 1 ATOM 2915 O O . ASN A 1 366 ? 53.820 91.109 71.499 1.00 64.99 ? 365 ASN A O 1 ATOM 2916 C CB . ASN A 1 366 ? 51.967 90.792 73.962 1.00 66.08 ? 365 ASN A CB 1 ATOM 2917 C CG . ASN A 1 366 ? 52.943 90.283 75.006 1.00 70.38 ? 365 ASN A CG 1 ATOM 2918 O OD1 . ASN A 1 366 ? 54.098 89.966 74.698 1.00 72.45 ? 365 ASN A OD1 1 ATOM 2919 N ND2 . ASN A 1 366 ? 52.471 90.167 76.256 1.00 72.79 ? 365 ASN A ND2 1 ATOM 2920 N N . ALA A 1 367 ? 54.890 92.240 73.129 1.00 66.29 ? 366 ALA A N 1 ATOM 2921 C CA . ALA A 1 367 ? 56.221 92.128 72.523 1.00 67.48 ? 366 ALA A CA 1 ATOM 2922 C C . ALA A 1 367 ? 56.650 90.680 72.287 1.00 68.20 ? 366 ALA A C 1 ATOM 2923 O O . ALA A 1 367 ? 57.357 90.397 71.324 1.00 69.93 ? 366 ALA A O 1 ATOM 2924 C CB . ALA A 1 367 ? 57.258 92.855 73.368 1.00 68.32 ? 366 ALA A CB 1 ATOM 2925 N N . THR A 1 368 ? 56.250 89.773 73.169 1.00 68.04 ? 367 THR A N 1 ATOM 2926 C CA . THR A 1 368 ? 56.559 88.357 72.995 1.00 69.60 ? 367 THR A CA 1 ATOM 2927 C C . THR A 1 368 ? 55.824 87.756 71.785 1.00 67.83 ? 367 THR A C 1 ATOM 2928 O O . THR A 1 368 ? 56.387 86.966 71.029 1.00 67.83 ? 367 THR A O 1 ATOM 2929 C CB . THR A 1 368 ? 56.203 87.545 74.261 1.00 71.04 ? 367 THR A CB 1 ATOM 2930 O OG1 . THR A 1 368 ? 56.873 88.109 75.396 1.00 73.28 ? 367 THR A OG1 1 ATOM 2931 C CG2 . THR A 1 368 ? 56.619 86.081 74.114 1.00 72.46 ? 367 THR A CG2 1 ATOM 2932 N N . THR A 1 369 ? 54.564 88.130 71.608 1.00 65.22 ? 368 THR A N 1 ATOM 2933 C CA . THR A 1 369 ? 53.808 87.702 70.450 1.00 64.19 ? 368 THR A CA 1 ATOM 2934 C C . THR A 1 369 ? 54.473 88.197 69.173 1.00 64.83 ? 368 THR A C 1 ATOM 2935 O O . THR A 1 369 ? 54.610 87.456 68.190 1.00 64.59 ? 368 THR A O 1 ATOM 2936 C CB . THR A 1 369 ? 52.375 88.253 70.502 1.00 63.18 ? 368 THR A CB 1 ATOM 2937 O OG1 . THR A 1 369 ? 51.754 87.854 71.731 1.00 64.63 ? 368 THR A OG1 1 ATOM 2938 C CG2 . THR A 1 369 ? 51.550 87.752 69.314 1.00 62.08 ? 368 THR A CG2 1 ATOM 2939 N N . LEU A 1 370 ? 54.854 89.469 69.182 1.00 66.42 ? 369 LEU A N 1 ATOM 2940 C CA . LEU A 1 370 ? 55.446 90.086 67.998 1.00 66.39 ? 369 LEU A CA 1 ATOM 2941 C C . LEU A 1 370 ? 56.822 89.492 67.692 1.00 66.91 ? 369 LEU A C 1 ATOM 2942 O O . LEU A 1 370 ? 57.171 89.316 66.526 1.00 66.61 ? 369 LEU A O 1 ATOM 2943 C CB . LEU A 1 370 ? 55.535 91.603 68.155 1.00 67.78 ? 369 LEU A CB 1 ATOM 2944 C CG . LEU A 1 370 ? 54.200 92.329 68.361 1.00 67.11 ? 369 LEU A CG 1 ATOM 2945 C CD1 . LEU A 1 370 ? 54.454 93.796 68.685 1.00 68.23 ? 369 LEU A CD1 1 ATOM 2946 C CD2 . LEU A 1 370 ? 53.285 92.176 67.151 1.00 64.97 ? 369 LEU A CD2 1 ATOM 2947 N N . ALA A 1 371 ? 57.590 89.170 68.731 1.00 67.48 ? 370 ALA A N 1 ATOM 2948 C CA . ALA A 1 371 ? 58.881 88.499 68.537 1.00 68.21 ? 370 ALA A CA 1 ATOM 2949 C C . ALA A 1 371 ? 58.698 87.125 67.893 1.00 67.29 ? 370 ALA A C 1 ATOM 2950 O O . ALA A 1 371 ? 59.516 86.718 67.060 1.00 70.11 ? 370 ALA A O 1 ATOM 2951 C CB . ALA A 1 371 ? 59.622 88.370 69.858 1.00 68.68 ? 370 ALA A CB 1 ATOM 2952 N N . TYR A 1 372 ? 57.642 86.407 68.278 1.00 64.66 ? 371 TYR A N 1 ATOM 2953 C CA . TYR A 1 372 ? 57.357 85.107 67.680 1.00 63.97 ? 371 TYR A CA 1 ATOM 2954 C C . TYR A 1 372 ? 57.013 85.268 66.195 1.00 64.31 ? 371 TYR A C 1 ATOM 2955 O O . TYR A 1 372 ? 57.528 84.551 65.337 1.00 66.40 ? 371 TYR A O 1 ATOM 2956 C CB . TYR A 1 372 ? 56.210 84.399 68.413 1.00 62.10 ? 371 TYR A CB 1 ATOM 2957 C CG . TYR A 1 372 ? 56.055 82.948 68.015 1.00 61.38 ? 371 TYR A CG 1 ATOM 2958 C CD1 . TYR A 1 372 ? 55.392 82.591 66.842 1.00 59.84 ? 371 TYR A CD1 1 ATOM 2959 C CD2 . TYR A 1 372 ? 56.583 81.932 68.803 1.00 62.15 ? 371 TYR A CD2 1 ATOM 2960 C CE1 . TYR A 1 372 ? 55.254 81.265 66.471 1.00 60.08 ? 371 TYR A CE1 1 ATOM 2961 C CE2 . TYR A 1 372 ? 56.451 80.600 68.436 1.00 62.60 ? 371 TYR A CE2 1 ATOM 2962 C CZ . TYR A 1 372 ? 55.785 80.274 67.271 1.00 61.47 ? 371 TYR A CZ 1 ATOM 2963 O OH . TYR A 1 372 ? 55.652 78.955 66.903 1.00 62.49 ? 371 TYR A OH 1 ATOM 2964 N N . LEU A 1 373 ? 56.139 86.213 65.891 1.00 62.88 ? 372 LEU A N 1 ATOM 2965 C CA . LEU A 1 373 ? 55.787 86.485 64.511 1.00 63.39 ? 372 LEU A CA 1 ATOM 2966 C C . LEU A 1 373 ? 57.007 86.877 63.669 1.00 67.14 ? 372 LEU A C 1 ATOM 2967 O O . LEU A 1 373 ? 57.159 86.440 62.531 1.00 67.55 ? 372 LEU A O 1 ATOM 2968 C CB . LEU A 1 373 ? 54.731 87.590 64.439 1.00 62.79 ? 372 LEU A CB 1 ATOM 2969 C CG . LEU A 1 373 ? 54.193 87.928 63.042 1.00 61.73 ? 372 LEU A CG 1 ATOM 2970 C CD1 . LEU A 1 373 ? 53.509 86.725 62.409 1.00 60.75 ? 372 LEU A CD1 1 ATOM 2971 C CD2 . LEU A 1 373 ? 53.239 89.109 63.114 1.00 60.64 ? 372 LEU A CD2 1 ATOM 2972 N N . LYS A 1 374 ? 57.884 87.704 64.229 1.00 70.45 ? 373 LYS A N 1 ATOM 2973 C CA . LYS A 1 374 ? 59.106 88.107 63.532 1.00 72.37 ? 373 LYS A CA 1 ATOM 2974 C C . LYS A 1 374 ? 59.943 86.894 63.108 1.00 74.49 ? 373 LYS A C 1 ATOM 2975 O O . LYS A 1 374 ? 60.474 86.852 61.994 1.00 74.43 ? 373 LYS A O 1 ATOM 2976 C CB . LYS A 1 374 ? 59.948 89.035 64.412 1.00 74.78 ? 373 LYS A CB 1 ATOM 2977 C CG . LYS A 1 374 ? 60.972 89.835 63.629 1.00 78.20 ? 373 LYS A CG 1 ATOM 2978 C CD . LYS A 1 374 ? 61.882 90.658 64.524 1.00 81.47 ? 373 LYS A CD 1 ATOM 2979 C CE . LYS A 1 374 ? 63.029 91.250 63.712 1.00 84.63 ? 373 LYS A CE 1 ATOM 2980 N NZ . LYS A 1 374 ? 63.893 92.143 64.527 1.00 87.61 ? 373 LYS A NZ 1 ATOM 2981 N N . ARG A 1 375 ? 60.069 85.927 64.015 1.00 76.80 ? 374 ARG A N 1 ATOM 2982 C CA . ARG A 1 375 ? 60.785 84.683 63.755 1.00 80.10 ? 374 ARG A CA 1 ATOM 2983 C C . ARG A 1 375 ? 60.153 83.889 62.601 1.00 76.38 ? 374 ARG A C 1 ATOM 2984 O O . ARG A 1 375 ? 60.861 83.368 61.737 1.00 78.48 ? 374 ARG A O 1 ATOM 2985 C CB . ARG A 1 375 ? 60.851 83.830 65.034 1.00 84.56 ? 374 ARG A CB 1 ATOM 2986 C CG . ARG A 1 375 ? 62.058 82.900 65.109 1.00 91.52 ? 374 ARG A CG 1 ATOM 2987 C CD . ARG A 1 375 ? 62.031 81.981 66.330 1.00 95.61 ? 374 ARG A CD 1 ATOM 2988 N NE . ARG A 1 375 ? 60.862 81.092 66.332 1.00 98.97 ? 374 ARG A NE 1 ATOM 2989 C CZ . ARG A 1 375 ? 60.681 80.064 67.163 1.00 101.01 ? 374 ARG A CZ 1 ATOM 2990 N NH1 . ARG A 1 375 ? 59.577 79.329 67.069 1.00 99.06 ? 374 ARG A NH1 1 ATOM 2991 N NH2 . ARG A 1 375 ? 61.596 79.754 68.077 1.00 104.09 ? 374 ARG A NH2 1 ATOM 2992 N N . VAL A 1 376 ? 58.828 83.802 62.604 1.00 72.46 ? 375 VAL A N 1 ATOM 2993 C CA . VAL A 1 376 ? 58.100 83.111 61.536 1.00 70.79 ? 375 VAL A CA 1 ATOM 2994 C C . VAL A 1 376 ? 58.344 83.786 60.182 1.00 70.58 ? 375 VAL A C 1 ATOM 2995 O O . VAL A 1 376 ? 58.604 83.120 59.185 1.00 70.02 ? 375 VAL A O 1 ATOM 2996 C CB . VAL A 1 376 ? 56.575 83.062 61.808 1.00 68.66 ? 375 VAL A CB 1 ATOM 2997 C CG1 . VAL A 1 376 ? 55.809 82.556 60.586 1.00 67.62 ? 375 VAL A CG1 1 ATOM 2998 C CG2 . VAL A 1 376 ? 56.270 82.188 63.019 1.00 68.69 ? 375 VAL A CG2 1 ATOM 2999 N N . LEU A 1 377 ? 58.272 85.111 60.159 1.00 70.55 ? 376 LEU A N 1 ATOM 3000 C CA . LEU A 1 377 ? 58.329 85.861 58.895 1.00 70.77 ? 376 LEU A CA 1 ATOM 3001 C C . LEU A 1 377 ? 59.737 86.068 58.356 1.00 75.14 ? 376 LEU A C 1 ATOM 3002 O O . LEU A 1 377 ? 59.950 85.953 57.148 1.00 74.90 ? 376 LEU A O 1 ATOM 3003 C CB . LEU A 1 377 ? 57.643 87.221 59.058 1.00 68.34 ? 376 LEU A CB 1 ATOM 3004 C CG . LEU A 1 377 ? 56.161 87.170 59.434 1.00 66.24 ? 376 LEU A CG 1 ATOM 3005 C CD1 . LEU A 1 377 ? 55.621 88.574 59.643 1.00 65.46 ? 376 LEU A CD1 1 ATOM 3006 C CD2 . LEU A 1 377 ? 55.349 86.432 58.381 1.00 65.98 ? 376 LEU A CD2 1 ATOM 3007 N N . LEU A 1 378 ? 60.687 86.408 59.235 1.00 79.26 ? 377 LEU A N 1 ATOM 3008 C CA . LEU A 1 378 ? 62.032 86.805 58.828 1.00 82.70 ? 377 LEU A CA 1 ATOM 3009 C C . LEU A 1 378 ? 63.069 85.700 59.017 1.00 88.49 ? 377 LEU A C 1 ATOM 3010 O O . LEU A 1 378 ? 64.177 85.820 58.504 1.00 89.95 ? 377 LEU A O 1 ATOM 3011 C CB . LEU A 1 378 ? 62.468 88.073 59.573 1.00 81.82 ? 377 LEU A CB 1 ATOM 3012 C CG . LEU A 1 378 ? 62.107 89.411 58.915 1.00 80.90 ? 377 LEU A CG 1 ATOM 3013 C CD1 . LEU A 1 378 ? 60.668 89.439 58.426 1.00 79.14 ? 377 LEU A CD1 1 ATOM 3014 C CD2 . LEU A 1 378 ? 62.364 90.561 59.878 1.00 81.18 ? 377 LEU A CD2 1 ATOM 3015 N N . GLY A 1 379 ? 62.709 84.639 59.721 1.00 94.08 ? 378 GLY A N 1 ATOM 3016 C CA . GLY A 1 379 ? 63.504 83.435 59.712 1.00 101.24 ? 378 GLY A CA 1 ATOM 3017 C C . GLY A 1 379 ? 64.625 83.365 60.719 1.00 110.77 ? 378 GLY A C 1 ATOM 3018 O O . GLY A 1 379 ? 65.288 82.321 60.748 1.00 115.16 ? 378 GLY A O 1 ATOM 3019 N N . PRO A 1 380 ? 64.894 84.438 61.519 1.00 117.72 ? 379 PRO A N 1 ATOM 3020 C CA . PRO A 1 380 ? 66.226 84.625 62.112 1.00 121.77 ? 379 PRO A CA 1 ATOM 3021 C C . PRO A 1 380 ? 66.451 83.744 63.329 1.00 120.61 ? 379 PRO A C 1 ATOM 3022 O O . PRO A 1 380 ? 66.597 82.539 63.176 1.00 117.40 ? 379 PRO A O 1 ATOM 3023 C CB . PRO A 1 380 ? 66.207 86.099 62.524 1.00 122.53 ? 379 PRO A CB 1 ATOM 3024 C CG . PRO A 1 380 ? 64.770 86.377 62.847 1.00 119.53 ? 379 PRO A CG 1 ATOM 3025 C CD . PRO A 1 380 ? 63.921 85.287 62.231 1.00 117.36 ? 379 PRO A CD 1 ATOM 3026 N N . ARG B 1 4 ? 9.332 81.548 25.102 1.00 126.69 ? 3 ARG B N 1 ATOM 3027 C CA . ARG B 1 4 ? 10.332 81.027 26.075 1.00 124.58 ? 3 ARG B CA 1 ATOM 3028 C C . ARG B 1 4 ? 11.606 80.588 25.354 1.00 119.11 ? 3 ARG B C 1 ATOM 3029 O O . ARG B 1 4 ? 11.586 80.283 24.159 1.00 117.81 ? 3 ARG B O 1 ATOM 3030 C CB . ARG B 1 4 ? 9.736 79.861 26.868 1.00 128.17 ? 3 ARG B CB 1 ATOM 3031 C CG . ARG B 1 4 ? 10.612 79.372 28.010 1.00 127.70 ? 3 ARG B CG 1 ATOM 3032 C CD . ARG B 1 4 ? 9.832 78.498 28.976 1.00 131.60 ? 3 ARG B CD 1 ATOM 3033 N NE . ARG B 1 4 ? 10.648 78.103 30.124 1.00 131.01 ? 3 ARG B NE 1 ATOM 3034 C CZ . ARG B 1 4 ? 10.182 77.526 31.232 1.00 133.90 ? 3 ARG B CZ 1 ATOM 3035 N NH1 . ARG B 1 4 ? 8.885 77.258 31.373 1.00 138.26 ? 3 ARG B NH1 1 ATOM 3036 N NH2 . ARG B 1 4 ? 11.022 77.214 32.213 1.00 132.27 ? 3 ARG B NH2 1 ATOM 3037 N N . HIS B 1 5 ? 12.716 80.562 26.085 1.00 114.68 ? 4 HIS B N 1 ATOM 3038 C CA . HIS B 1 5 ? 13.998 80.214 25.502 1.00 109.36 ? 4 HIS B CA 1 ATOM 3039 C C . HIS B 1 5 ? 15.000 79.786 26.602 1.00 105.60 ? 4 HIS B C 1 ATOM 3040 O O . HIS B 1 5 ? 15.006 80.301 27.721 1.00 105.24 ? 4 HIS B O 1 ATOM 3041 C CB . HIS B 1 5 ? 14.546 81.391 24.693 1.00 107.75 ? 4 HIS B CB 1 ATOM 3042 C CG . HIS B 1 5 ? 14.524 82.701 25.424 1.00 108.26 ? 4 HIS B CG 1 ATOM 3043 N ND1 . HIS B 1 5 ? 13.630 83.706 25.124 1.00 110.82 ? 4 HIS B ND1 1 ATOM 3044 C CD2 . HIS B 1 5 ? 15.297 83.174 26.432 1.00 106.15 ? 4 HIS B CD2 1 ATOM 3045 C CE1 . HIS B 1 5 ? 13.850 84.739 25.918 1.00 110.88 ? 4 HIS B CE1 1 ATOM 3046 N NE2 . HIS B 1 5 ? 14.856 84.442 26.721 1.00 107.74 ? 4 HIS B NE2 1 ATOM 3047 N N . PRO B 1 6 ? 15.904 78.866 26.262 1.00 101.54 ? 5 PRO B N 1 ATOM 3048 C CA . PRO B 1 6 ? 16.772 78.335 27.307 1.00 98.90 ? 5 PRO B CA 1 ATOM 3049 C C . PRO B 1 6 ? 17.953 79.258 27.586 1.00 94.04 ? 5 PRO B C 1 ATOM 3050 O O . PRO B 1 6 ? 18.374 79.997 26.703 1.00 92.06 ? 5 PRO B O 1 ATOM 3051 C CB . PRO B 1 6 ? 17.252 77.014 26.710 1.00 98.22 ? 5 PRO B CB 1 ATOM 3052 C CG . PRO B 1 6 ? 17.232 77.238 25.233 1.00 97.50 ? 5 PRO B CG 1 ATOM 3053 C CD . PRO B 1 6 ? 16.168 78.256 24.946 1.00 100.04 ? 5 PRO B CD 1 ATOM 3054 N N . PRO B 1 7 ? 18.496 79.198 28.805 1.00 92.04 ? 6 PRO B N 1 ATOM 3055 C CA . PRO B 1 7 ? 19.696 79.985 29.098 1.00 88.44 ? 6 PRO B CA 1 ATOM 3056 C C . PRO B 1 7 ? 20.913 79.588 28.275 1.00 84.66 ? 6 PRO B C 1 ATOM 3057 O O . PRO B 1 7 ? 21.038 78.419 27.864 1.00 84.37 ? 6 PRO B O 1 ATOM 3058 C CB . PRO B 1 7 ? 19.946 79.720 30.591 1.00 89.06 ? 6 PRO B CB 1 ATOM 3059 C CG . PRO B 1 7 ? 19.225 78.456 30.895 1.00 91.22 ? 6 PRO B CG 1 ATOM 3060 C CD . PRO B 1 7 ? 18.047 78.415 29.972 1.00 93.73 ? 6 PRO B CD 1 ATOM 3061 N N . VAL B 1 8 ? 21.768 80.570 28.008 1.00 82.47 ? 7 VAL B N 1 ATOM 3062 C CA . VAL B 1 8 ? 22.872 80.393 27.086 1.00 79.08 ? 7 VAL B CA 1 ATOM 3063 C C . VAL B 1 8 ? 24.174 80.795 27.744 1.00 76.61 ? 7 VAL B C 1 ATOM 3064 O O . VAL B 1 8 ? 24.251 81.860 28.368 1.00 76.52 ? 7 VAL B O 1 ATOM 3065 C CB . VAL B 1 8 ? 22.659 81.235 25.809 1.00 79.34 ? 7 VAL B CB 1 ATOM 3066 C CG1 . VAL B 1 8 ? 23.922 81.277 24.949 1.00 76.90 ? 7 VAL B CG1 1 ATOM 3067 C CG2 . VAL B 1 8 ? 21.487 80.685 25.013 1.00 81.33 ? 7 VAL B CG2 1 ATOM 3068 N N . VAL B 1 9 ? 25.190 79.947 27.584 1.00 74.43 ? 8 VAL B N 1 ATOM 3069 C CA . VAL B 1 9 ? 26.552 80.249 28.035 1.00 71.71 ? 8 VAL B CA 1 ATOM 3070 C C . VAL B 1 9 ? 27.479 80.283 26.822 1.00 69.58 ? 8 VAL B C 1 ATOM 3071 O O . VAL B 1 9 ? 27.471 79.369 25.997 1.00 69.19 ? 8 VAL B O 1 ATOM 3072 C CB . VAL B 1 9 ? 27.044 79.199 29.047 1.00 71.39 ? 8 VAL B CB 1 ATOM 3073 C CG1 . VAL B 1 9 ? 28.522 79.395 29.363 1.00 69.75 ? 8 VAL B CG1 1 ATOM 3074 C CG2 . VAL B 1 9 ? 26.219 79.272 30.317 1.00 73.38 ? 8 VAL B CG2 1 ATOM 3075 N N . LEU B 1 10 ? 28.254 81.360 26.726 1.00 67.75 ? 9 LEU B N 1 ATOM 3076 C CA . LEU B 1 10 ? 29.174 81.591 25.618 1.00 65.01 ? 9 LEU B CA 1 ATOM 3077 C C . LEU B 1 10 ? 30.611 81.294 26.051 1.00 63.52 ? 9 LEU B C 1 ATOM 3078 O O . LEU B 1 10 ? 31.074 81.812 27.076 1.00 62.63 ? 9 LEU B O 1 ATOM 3079 C CB . LEU B 1 10 ? 29.066 83.045 25.148 1.00 65.14 ? 9 LEU B CB 1 ATOM 3080 C CG . LEU B 1 10 ? 27.659 83.536 24.788 1.00 68.10 ? 9 LEU B CG 1 ATOM 3081 C CD1 . LEU B 1 10 ? 27.650 85.024 24.476 1.00 68.49 ? 9 LEU B CD1 1 ATOM 3082 C CD2 . LEU B 1 10 ? 27.098 82.746 23.616 1.00 68.76 ? 9 LEU B CD2 1 ATOM 3083 N N . VAL B 1 11 ? 31.318 80.479 25.252 1.00 62.94 ? 10 VAL B N 1 ATOM 3084 C CA . VAL B 1 11 ? 32.690 80.084 25.536 1.00 60.25 ? 10 VAL B CA 1 ATOM 3085 C C . VAL B 1 11 ? 33.569 80.542 24.379 1.00 57.75 ? 10 VAL B C 1 ATOM 3086 O O . VAL B 1 11 ? 33.394 80.091 23.250 1.00 57.04 ? 10 VAL B O 1 ATOM 3087 C CB . VAL B 1 11 ? 32.822 78.556 25.705 1.00 59.99 ? 10 VAL B CB 1 ATOM 3088 C CG1 . VAL B 1 11 ? 34.235 78.198 26.150 1.00 57.61 ? 10 VAL B CG1 1 ATOM 3089 C CG2 . VAL B 1 11 ? 31.790 78.032 26.700 1.00 61.70 ? 10 VAL B CG2 1 ATOM 3090 N N . PRO B 1 12 ? 34.517 81.447 24.655 1.00 56.69 ? 11 PRO B N 1 ATOM 3091 C CA . PRO B 1 12 ? 35.323 82.022 23.588 1.00 54.91 ? 11 PRO B CA 1 ATOM 3092 C C . PRO B 1 12 ? 36.537 81.177 23.223 1.00 52.36 ? 11 PRO B C 1 ATOM 3093 O O . PRO B 1 12 ? 36.850 80.208 23.896 1.00 51.06 ? 11 PRO B O 1 ATOM 3094 C CB . PRO B 1 12 ? 35.773 83.347 24.191 1.00 55.15 ? 11 PRO B CB 1 ATOM 3095 C CG . PRO B 1 12 ? 35.933 83.037 25.647 1.00 55.72 ? 11 PRO B CG 1 ATOM 3096 C CD . PRO B 1 12 ? 34.874 82.016 25.970 1.00 57.07 ? 11 PRO B CD 1 ATOM 3097 N N . GLY B 1 13 ? 37.201 81.562 22.145 1.00 51.48 ? 12 GLY B N 1 ATOM 3098 C CA . GLY B 1 13 ? 38.422 80.904 21.728 1.00 50.32 ? 12 GLY B CA 1 ATOM 3099 C C . GLY B 1 13 ? 39.672 81.631 22.213 1.00 50.50 ? 12 GLY B C 1 ATOM 3100 O O . GLY B 1 13 ? 39.617 82.504 23.088 1.00 50.43 ? 12 GLY B O 1 ATOM 3101 N N . ASP B 1 14 ? 40.795 81.251 21.614 1.00 51.26 ? 13 ASP B N 1 ATOM 3102 C CA . ASP B 1 14 ? 42.086 81.868 21.891 1.00 52.02 ? 13 ASP B CA 1 ATOM 3103 C C . ASP B 1 14 ? 42.025 83.353 21.559 1.00 51.73 ? 13 ASP B C 1 ATOM 3104 O O . ASP B 1 14 ? 41.451 83.758 20.553 1.00 51.64 ? 13 ASP B O 1 ATOM 3105 C CB . ASP B 1 14 ? 43.195 81.205 21.074 1.00 53.64 ? 13 ASP B CB 1 ATOM 3106 C CG . ASP B 1 14 ? 44.586 81.457 21.642 1.00 55.58 ? 13 ASP B CG 1 ATOM 3107 O OD1 . ASP B 1 14 ? 44.732 82.205 22.643 1.00 56.09 ? 13 ASP B OD1 1 ATOM 3108 O OD2 . ASP B 1 14 ? 45.548 80.892 21.067 1.00 56.26 ? 13 ASP B OD2 1 ATOM 3109 N N . LEU B 1 15 ? 42.625 84.177 22.416 1.00 51.12 ? 14 LEU B N 1 ATOM 3110 C CA . LEU B 1 15 ? 42.545 85.643 22.315 1.00 50.99 ? 14 LEU B CA 1 ATOM 3111 C C . LEU B 1 15 ? 41.140 86.201 22.495 1.00 50.96 ? 14 LEU B C 1 ATOM 3112 O O . LEU B 1 15 ? 40.916 87.387 22.248 1.00 52.27 ? 14 LEU B O 1 ATOM 3113 C CB . LEU B 1 15 ? 43.112 86.162 20.983 1.00 51.72 ? 14 LEU B CB 1 ATOM 3114 C CG . LEU B 1 15 ? 44.488 85.670 20.531 1.00 52.02 ? 14 LEU B CG 1 ATOM 3115 C CD1 . LEU B 1 15 ? 44.842 86.356 19.212 1.00 53.58 ? 14 LEU B CD1 1 ATOM 3116 C CD2 . LEU B 1 15 ? 45.549 85.945 21.588 1.00 50.74 ? 14 LEU B CD2 1 ATOM 3117 N N . GLY B 1 16 ? 40.221 85.374 22.978 1.00 50.62 ? 15 GLY B N 1 ATOM 3118 C CA . GLY B 1 16 ? 38.801 85.655 22.860 1.00 51.02 ? 15 GLY B CA 1 ATOM 3119 C C . GLY B 1 16 ? 38.132 86.315 24.034 1.00 50.97 ? 15 GLY B C 1 ATOM 3120 O O . GLY B 1 16 ? 36.919 86.449 24.060 1.00 52.42 ? 15 GLY B O 1 ATOM 3121 N N . ASN B 1 17 ? 38.912 86.763 25.008 1.00 49.27 ? 16 ASN B N 1 ATOM 3122 C CA . ASN B 1 17 ? 38.368 87.585 26.073 1.00 50.46 ? 16 ASN B CA 1 ATOM 3123 C C . ASN B 1 17 ? 39.426 88.486 26.669 1.00 49.41 ? 16 ASN B C 1 ATOM 3124 O O . ASN B 1 17 ? 40.631 88.237 26.526 1.00 48.80 ? 16 ASN B O 1 ATOM 3125 C CB . ASN B 1 17 ? 37.625 86.751 27.134 1.00 50.84 ? 16 ASN B CB 1 ATOM 3126 C CG . ASN B 1 17 ? 38.468 85.632 27.717 1.00 49.65 ? 16 ASN B CG 1 ATOM 3127 O OD1 . ASN B 1 17 ? 38.179 84.454 27.503 1.00 48.81 ? 16 ASN B OD1 1 ATOM 3128 N ND2 . ASN B 1 17 ? 39.484 85.992 28.504 1.00 49.21 ? 16 ASN B ND2 1 ATOM 3129 N N . GLN B 1 18 ? 38.968 89.552 27.311 1.00 50.81 ? 17 GLN B N 1 ATOM 3130 C CA . GLN B 1 18 ? 39.885 90.491 27.934 1.00 51.39 ? 17 GLN B CA 1 ATOM 3131 C C . GLN B 1 18 ? 40.711 89.789 29.019 1.00 51.22 ? 17 GLN B C 1 ATOM 3132 O O . GLN B 1 18 ? 40.273 88.800 29.624 1.00 51.52 ? 17 GLN B O 1 ATOM 3133 C CB . GLN B 1 18 ? 39.133 91.653 28.546 1.00 53.71 ? 17 GLN B CB 1 ATOM 3134 C CG . GLN B 1 18 ? 38.487 92.544 27.510 1.00 55.18 ? 17 GLN B CG 1 ATOM 3135 C CD . GLN B 1 18 ? 37.739 93.710 28.119 1.00 57.28 ? 17 GLN B CD 1 ATOM 3136 O OE1 . GLN B 1 18 ? 37.982 94.098 29.267 1.00 58.24 ? 17 GLN B OE1 1 ATOM 3137 N NE2 . GLN B 1 18 ? 36.828 94.281 27.345 1.00 58.22 ? 17 GLN B NE2 1 ATOM 3138 N N . LEU B 1 19 ? 41.916 90.310 29.237 1.00 51.34 ? 18 LEU B N 1 ATOM 3139 C CA . LEU B 1 19 ? 42.760 89.965 30.370 1.00 50.99 ? 18 LEU B CA 1 ATOM 3140 C C . LEU B 1 19 ? 43.246 91.242 31.034 1.00 51.89 ? 18 LEU B C 1 ATOM 3141 O O . LEU B 1 19 ? 43.502 92.239 30.344 1.00 51.41 ? 18 LEU B O 1 ATOM 3142 C CB . LEU B 1 19 ? 43.976 89.144 29.927 1.00 48.86 ? 18 LEU B CB 1 ATOM 3143 C CG . LEU B 1 19 ? 43.704 87.738 29.409 1.00 47.64 ? 18 LEU B CG 1 ATOM 3144 C CD1 . LEU B 1 19 ? 45.003 87.120 28.922 1.00 46.63 ? 18 LEU B CD1 1 ATOM 3145 C CD2 . LEU B 1 19 ? 43.070 86.866 30.480 1.00 48.66 ? 18 LEU B CD2 1 ATOM 3146 N N . GLU B 1 20 ? 43.410 91.191 32.356 1.00 52.88 ? 19 GLU B N 1 ATOM 3147 C CA . GLU B 1 20 ? 43.897 92.325 33.127 1.00 53.93 ? 19 GLU B CA 1 ATOM 3148 C C . GLU B 1 20 ? 45.148 91.933 33.905 1.00 53.54 ? 19 GLU B C 1 ATOM 3149 O O . GLU B 1 20 ? 45.307 90.775 34.302 1.00 54.69 ? 19 GLU B O 1 ATOM 3150 C CB . GLU B 1 20 ? 42.812 92.822 34.076 1.00 57.30 ? 19 GLU B CB 1 ATOM 3151 C CG . GLU B 1 20 ? 41.595 93.413 33.367 1.00 59.08 ? 19 GLU B CG 1 ATOM 3152 C CD . GLU B 1 20 ? 40.495 93.872 34.321 1.00 61.87 ? 19 GLU B CD 1 ATOM 3153 O OE1 . GLU B 1 20 ? 40.536 93.524 35.526 1.00 62.54 ? 19 GLU B OE1 1 ATOM 3154 O OE2 . GLU B 1 20 ? 39.570 94.573 33.854 1.00 63.19 ? 19 GLU B OE2 1 ATOM 3155 N N . ALA B 1 21 ? 46.032 92.891 34.144 1.00 52.46 ? 20 ALA B N 1 ATOM 3156 C CA . ALA B 1 21 ? 47.259 92.624 34.874 1.00 50.43 ? 20 ALA B CA 1 ATOM 3157 C C . ALA B 1 21 ? 47.564 93.686 35.896 1.00 51.03 ? 20 ALA B C 1 ATOM 3158 O O . ALA B 1 21 ? 47.136 94.832 35.766 1.00 52.61 ? 20 ALA B O 1 ATOM 3159 C CB . ALA B 1 21 ? 48.428 92.446 33.923 1.00 49.74 ? 20 ALA B CB 1 ATOM 3160 N N . LYS B 1 22 ? 48.320 93.292 36.914 1.00 50.58 ? 21 LYS B N 1 ATOM 3161 C CA . LYS B 1 22 ? 48.823 94.211 37.946 1.00 51.82 ? 21 LYS B CA 1 ATOM 3162 C C . LYS B 1 22 ? 50.286 93.917 38.160 1.00 50.67 ? 21 LYS B C 1 ATOM 3163 O O . LYS B 1 22 ? 50.681 92.750 38.171 1.00 49.44 ? 21 LYS B O 1 ATOM 3164 C CB . LYS B 1 22 ? 48.056 94.027 39.248 1.00 53.43 ? 21 LYS B CB 1 ATOM 3165 C CG . LYS B 1 22 ? 48.523 94.948 40.356 1.00 55.39 ? 21 LYS B CG 1 ATOM 3166 C CD . LYS B 1 22 ? 47.482 95.034 41.455 1.00 57.58 ? 21 LYS B CD 1 ATOM 3167 C CE . LYS B 1 22 ? 47.959 95.912 42.591 1.00 59.62 ? 21 LYS B CE 1 ATOM 3168 N NZ . LYS B 1 22 ? 46.965 95.867 43.695 1.00 62.39 ? 21 LYS B NZ 1 ATOM 3169 N N . LEU B 1 23 ? 51.094 94.953 38.362 1.00 51.20 ? 22 LEU B N 1 ATOM 3170 C CA . LEU B 1 23 ? 52.545 94.800 38.340 1.00 51.70 ? 22 LEU B CA 1 ATOM 3171 C C . LEU B 1 23 ? 53.201 95.275 39.623 1.00 53.70 ? 22 LEU B C 1 ATOM 3172 O O . LEU B 1 23 ? 52.822 96.310 40.165 1.00 54.56 ? 22 LEU B O 1 ATOM 3173 C CB . LEU B 1 23 ? 53.161 95.607 37.187 1.00 50.71 ? 22 LEU B CB 1 ATOM 3174 C CG . LEU B 1 23 ? 52.557 95.492 35.790 1.00 49.94 ? 22 LEU B CG 1 ATOM 3175 C CD1 . LEU B 1 23 ? 53.294 96.417 34.828 1.00 50.28 ? 22 LEU B CD1 1 ATOM 3176 C CD2 . LEU B 1 23 ? 52.587 94.057 35.286 1.00 48.01 ? 22 LEU B CD2 1 ATOM 3177 N N . ASP B 1 24 ? 54.205 94.521 40.075 1.00 55.02 ? 23 ASP B N 1 ATOM 3178 C CA . ASP B 1 24 ? 55.166 94.974 41.097 1.00 57.55 ? 23 ASP B CA 1 ATOM 3179 C C . ASP B 1 24 ? 56.475 94.223 40.846 1.00 56.46 ? 23 ASP B C 1 ATOM 3180 O O . ASP B 1 24 ? 56.851 93.324 41.600 1.00 56.41 ? 23 ASP B O 1 ATOM 3181 C CB . ASP B 1 24 ? 54.636 94.725 42.514 1.00 60.93 ? 23 ASP B CB 1 ATOM 3182 C CG . ASP B 1 24 ? 55.433 95.477 43.593 1.00 65.04 ? 23 ASP B CG 1 ATOM 3183 O OD1 . ASP B 1 24 ? 56.527 96.012 43.302 1.00 66.58 ? 23 ASP B OD1 1 ATOM 3184 O OD2 . ASP B 1 24 ? 54.955 95.537 44.747 1.00 69.37 ? 23 ASP B OD2 1 ATOM 3185 N N . LYS B 1 25 ? 57.150 94.568 39.751 1.00 57.22 ? 24 LYS B N 1 ATOM 3186 C CA . LYS B 1 25 ? 58.255 93.765 39.222 1.00 56.21 ? 24 LYS B CA 1 ATOM 3187 C C . LYS B 1 25 ? 59.568 94.230 39.876 1.00 57.37 ? 24 LYS B C 1 ATOM 3188 O O . LYS B 1 25 ? 59.771 95.418 40.087 1.00 56.08 ? 24 LYS B O 1 ATOM 3189 C CB . LYS B 1 25 ? 58.352 93.969 37.707 1.00 54.47 ? 24 LYS B CB 1 ATOM 3190 C CG . LYS B 1 25 ? 57.117 93.509 36.947 1.00 54.33 ? 24 LYS B CG 1 ATOM 3191 C CD . LYS B 1 25 ? 56.983 94.171 35.580 1.00 53.75 ? 24 LYS B CD 1 ATOM 3192 C CE . LYS B 1 25 ? 58.008 93.658 34.573 1.00 52.51 ? 24 LYS B CE 1 ATOM 3193 N NZ . LYS B 1 25 ? 57.651 92.335 34.001 1.00 50.41 ? 24 LYS B NZ 1 ATOM 3194 N N . PRO B 1 26 ? 60.482 93.296 40.181 1.00 58.69 ? 25 PRO B N 1 ATOM 3195 C CA . PRO B 1 26 ? 61.799 93.703 40.671 1.00 60.76 ? 25 PRO B CA 1 ATOM 3196 C C . PRO B 1 26 ? 62.671 94.371 39.591 1.00 62.01 ? 25 PRO B C 1 ATOM 3197 O O . PRO B 1 26 ? 63.444 95.283 39.901 1.00 64.69 ? 25 PRO B O 1 ATOM 3198 C CB . PRO B 1 26 ? 62.425 92.389 41.134 1.00 61.09 ? 25 PRO B CB 1 ATOM 3199 C CG . PRO B 1 26 ? 61.745 91.333 40.329 1.00 60.60 ? 25 PRO B CG 1 ATOM 3200 C CD . PRO B 1 26 ? 60.349 91.830 40.085 1.00 59.62 ? 25 PRO B CD 1 ATOM 3201 N N . THR B 1 27 ? 62.534 93.922 38.345 1.00 60.19 ? 26 THR B N 1 ATOM 3202 C CA . THR B 1 27 ? 63.323 94.455 37.239 1.00 60.24 ? 26 THR B CA 1 ATOM 3203 C C . THR B 1 27 ? 62.491 94.504 35.970 1.00 57.85 ? 26 THR B C 1 ATOM 3204 O O . THR B 1 27 ? 61.457 93.835 35.858 1.00 57.87 ? 26 THR B O 1 ATOM 3205 C CB . THR B 1 27 ? 64.578 93.601 36.958 1.00 60.87 ? 26 THR B CB 1 ATOM 3206 O OG1 . THR B 1 27 ? 64.187 92.277 36.572 1.00 59.61 ? 26 THR B OG1 1 ATOM 3207 C CG2 . THR B 1 27 ? 65.486 93.534 38.191 1.00 61.91 ? 26 THR B CG2 1 ATOM 3208 N N . VAL B 1 28 ? 62.943 95.298 35.011 1.00 56.16 ? 27 VAL B N 1 ATOM 3209 C CA . VAL B 1 28 ? 62.281 95.390 33.705 1.00 54.44 ? 27 VAL B CA 1 ATOM 3210 C C . VAL B 1 28 ? 63.289 95.186 32.592 1.00 53.19 ? 27 VAL B C 1 ATOM 3211 O O . VAL B 1 28 ? 64.480 95.381 32.782 1.00 51.75 ? 27 VAL B O 1 ATOM 3212 C CB . VAL B 1 28 ? 61.563 96.742 33.507 1.00 55.27 ? 27 VAL B CB 1 ATOM 3213 C CG1 . VAL B 1 28 ? 60.224 96.739 34.230 1.00 55.60 ? 27 VAL B CG1 1 ATOM 3214 C CG2 . VAL B 1 28 ? 62.433 97.905 33.960 1.00 56.20 ? 27 VAL B CG2 1 ATOM 3215 N N . VAL B 1 29 ? 62.798 94.823 31.411 1.00 52.60 ? 28 VAL B N 1 ATOM 3216 C CA . VAL B 1 29 ? 63.670 94.598 30.251 1.00 52.35 ? 28 VAL B CA 1 ATOM 3217 C C . VAL B 1 29 ? 64.135 95.887 29.542 1.00 54.54 ? 28 VAL B C 1 ATOM 3218 O O . VAL B 1 29 ? 65.198 95.860 28.910 1.00 55.19 ? 28 VAL B O 1 ATOM 3219 C CB . VAL B 1 29 ? 63.013 93.686 29.199 1.00 49.84 ? 28 VAL B CB 1 ATOM 3220 C CG1 . VAL B 1 29 ? 62.634 92.350 29.816 1.00 48.17 ? 28 VAL B CG1 1 ATOM 3221 C CG2 . VAL B 1 29 ? 61.812 94.364 28.553 1.00 49.42 ? 28 VAL B CG2 1 ATOM 3222 N N . HIS B 1 30 ? 63.350 96.956 29.631 1.00 55.90 ? 29 HIS B N 1 ATOM 3223 C CA . HIS B 1 30 ? 63.644 98.219 28.967 1.00 57.26 ? 29 HIS B CA 1 ATOM 3224 C C . HIS B 1 30 ? 63.255 99.356 29.929 1.00 56.80 ? 29 HIS B C 1 ATOM 3225 O O . HIS B 1 30 ? 62.320 99.209 30.749 1.00 56.98 ? 29 HIS B O 1 ATOM 3226 C CB . HIS B 1 30 ? 62.831 98.317 27.673 1.00 59.02 ? 29 HIS B CB 1 ATOM 3227 C CG . HIS B 1 30 ? 63.348 99.316 26.693 1.00 63.87 ? 29 HIS B CG 1 ATOM 3228 N ND1 . HIS B 1 30 ? 64.415 99.057 25.861 1.00 68.10 ? 29 HIS B ND1 1 ATOM 3229 C CD2 . HIS B 1 30 ? 62.934 100.570 26.392 1.00 66.78 ? 29 HIS B CD2 1 ATOM 3230 C CE1 . HIS B 1 30 ? 64.650 100.115 25.102 1.00 69.52 ? 29 HIS B CE1 1 ATOM 3231 N NE2 . HIS B 1 30 ? 63.765 101.048 25.406 1.00 70.09 ? 29 HIS B NE2 1 ATOM 3232 N N . TYR B 1 31 ? 63.946 100.473 29.841 1.00 55.88 ? 30 TYR B N 1 ATOM 3233 C CA . TYR B 1 31 ? 63.601 101.580 30.695 1.00 56.55 ? 30 TYR B CA 1 ATOM 3234 C C . TYR B 1 31 ? 62.255 102.205 30.509 1.00 56.65 ? 30 TYR B C 1 ATOM 3235 O O . TYR B 1 31 ? 61.712 102.781 31.432 1.00 57.85 ? 30 TYR B O 1 ATOM 3236 C CB . TYR B 1 31 ? 64.688 102.656 30.535 1.00 57.90 ? 30 TYR B CB 1 ATOM 3237 C CG . TYR B 1 31 ? 64.854 103.301 29.154 1.00 57.54 ? 30 TYR B CG 1 ATOM 3238 C CD1 . TYR B 1 31 ? 63.998 104.307 28.718 1.00 58.33 ? 30 TYR B CD1 1 ATOM 3239 C CD2 . TYR B 1 31 ? 65.923 102.952 28.321 1.00 57.09 ? 30 TYR B CD2 1 ATOM 3240 C CE1 . TYR B 1 31 ? 64.172 104.917 27.483 1.00 59.20 ? 30 TYR B CE1 1 ATOM 3241 C CE2 . TYR B 1 31 ? 66.102 103.551 27.082 1.00 57.21 ? 30 TYR B CE2 1 ATOM 3242 C CZ . TYR B 1 31 ? 65.224 104.536 26.668 1.00 59.03 ? 30 TYR B CZ 1 ATOM 3243 O OH . TYR B 1 31 ? 65.392 105.160 25.448 1.00 59.92 ? 30 TYR B OH 1 ATOM 3244 N N . LEU B 1 32 ? 61.631 101.980 29.362 1.00 56.48 ? 31 LEU B N 1 ATOM 3245 C CA . LEU B 1 32 ? 60.276 102.479 29.137 1.00 56.83 ? 31 LEU B CA 1 ATOM 3246 C C . LEU B 1 32 ? 59.209 101.586 29.788 1.00 56.69 ? 31 LEU B C 1 ATOM 3247 O O . LEU B 1 32 ? 58.043 101.967 29.776 1.00 57.37 ? 31 LEU B O 1 ATOM 3248 C CB . LEU B 1 32 ? 59.972 102.604 27.641 1.00 55.79 ? 31 LEU B CB 1 ATOM 3249 C CG . LEU B 1 32 ? 60.774 103.647 26.864 1.00 57.28 ? 31 LEU B CG 1 ATOM 3250 C CD1 . LEU B 1 32 ? 60.554 103.469 25.369 1.00 56.36 ? 31 LEU B CD1 1 ATOM 3251 C CD2 . LEU B 1 32 ? 60.421 105.062 27.310 1.00 58.32 ? 31 LEU B CD2 1 ATOM 3252 N N . CYS B 1 33 ? 59.601 100.434 30.334 1.00 56.42 ? 32 CYS B N 1 ATOM 3253 C CA . CYS B 1 33 ? 58.616 99.498 30.906 1.00 56.50 ? 32 CYS B CA 1 ATOM 3254 C C . CYS B 1 33 ? 58.265 99.903 32.333 1.00 57.43 ? 32 CYS B C 1 ATOM 3255 O O . CYS B 1 33 ? 59.154 100.180 33.122 1.00 58.41 ? 32 CYS B O 1 ATOM 3256 C CB . CYS B 1 33 ? 59.175 98.069 30.949 1.00 56.50 ? 32 CYS B CB 1 ATOM 3257 S SG . CYS B 1 33 ? 59.624 97.344 29.358 1.00 60.54 ? 32 CYS B SG 1 ATOM 3258 N N . SER B 1 34 ? 56.977 99.916 32.666 1.00 57.25 ? 33 SER B N 1 ATOM 3259 C CA . SER B 1 34 ? 56.540 100.157 34.040 1.00 57.63 ? 33 SER B CA 1 ATOM 3260 C C . SER B 1 34 ? 56.917 99.008 34.965 1.00 57.11 ? 33 SER B C 1 ATOM 3261 O O . SER B 1 34 ? 56.681 97.851 34.634 1.00 56.59 ? 33 SER B O 1 ATOM 3262 C CB . SER B 1 34 ? 55.004 100.266 34.112 1.00 57.94 ? 33 SER B CB 1 ATOM 3263 O OG . SER B 1 34 ? 54.541 101.601 34.046 1.00 60.33 ? 33 SER B OG 1 ATOM 3264 N N . LYS B 1 35 ? 57.444 99.342 36.137 1.00 59.13 ? 34 LYS B N 1 ATOM 3265 C CA . LYS B 1 35 ? 57.756 98.348 37.177 1.00 60.31 ? 34 LYS B CA 1 ATOM 3266 C C . LYS B 1 35 ? 56.518 98.037 38.034 1.00 60.81 ? 34 LYS B C 1 ATOM 3267 O O . LYS B 1 35 ? 56.356 96.898 38.476 1.00 60.40 ? 34 LYS B O 1 ATOM 3268 C CB . LYS B 1 35 ? 58.893 98.827 38.070 1.00 63.26 ? 34 LYS B CB 1 ATOM 3269 C CG . LYS B 1 35 ? 60.126 99.268 37.297 1.00 66.20 ? 34 LYS B CG 1 ATOM 3270 C CD . LYS B 1 35 ? 61.311 99.538 38.210 1.00 69.24 ? 34 LYS B CD 1 ATOM 3271 C CE . LYS B 1 35 ? 61.881 98.246 38.774 1.00 69.63 ? 34 LYS B CE 1 ATOM 3272 N NZ . LYS B 1 35 ? 63.303 98.428 39.165 1.00 72.05 ? 34 LYS B NZ 1 ATOM 3273 N N . LYS B 1 36 ? 55.674 99.031 38.258 1.00 62.70 ? 35 LYS B N 1 ATOM 3274 C CA . LYS B 1 36 ? 54.642 98.915 39.247 1.00 63.15 ? 35 LYS B CA 1 ATOM 3275 C C . LYS B 1 36 ? 53.386 99.639 38.839 1.00 62.21 ? 35 LYS B C 1 ATOM 3276 O O . LYS B 1 36 ? 53.450 100.707 38.271 1.00 63.81 ? 35 LYS B O 1 ATOM 3277 C CB . LYS B 1 36 ? 55.138 99.477 40.578 1.00 65.55 ? 35 LYS B CB 1 ATOM 3278 C CG . LYS B 1 36 ? 54.240 99.150 41.761 1.00 67.81 ? 35 LYS B CG 1 ATOM 3279 C CD . LYS B 1 36 ? 54.803 99.749 43.035 1.00 70.48 ? 35 LYS B CD 1 ATOM 3280 C CE . LYS B 1 36 ? 54.083 99.228 44.266 1.00 72.17 ? 35 LYS B CE 1 ATOM 3281 N NZ . LYS B 1 36 ? 54.752 99.678 45.518 1.00 75.03 ? 35 LYS B NZ 1 ATOM 3282 N N . THR B 1 37 ? 52.240 99.040 39.126 1.00 60.83 ? 36 THR B N 1 ATOM 3283 C CA . THR B 1 37 ? 50.949 99.715 38.970 1.00 60.84 ? 36 THR B CA 1 ATOM 3284 C C . THR B 1 37 ? 50.170 99.595 40.281 1.00 62.57 ? 36 THR B C 1 ATOM 3285 O O . THR B 1 37 ? 50.287 98.611 41.018 1.00 60.95 ? 36 THR B O 1 ATOM 3286 C CB . THR B 1 37 ? 50.100 99.123 37.823 1.00 58.57 ? 36 THR B CB 1 ATOM 3287 O OG1 . THR B 1 37 ? 49.717 97.775 38.132 1.00 56.84 ? 36 THR B OG1 1 ATOM 3288 C CG2 . THR B 1 37 ? 50.873 99.144 36.513 1.00 57.35 ? 36 THR B CG2 1 ATOM 3289 N N . GLU B 1 38 ? 49.386 100.620 40.586 1.00 65.12 ? 37 GLU B N 1 ATOM 3290 C CA . GLU B 1 38 ? 48.555 100.630 41.785 1.00 68.51 ? 37 GLU B CA 1 ATOM 3291 C C . GLU B 1 38 ? 47.301 99.754 41.649 1.00 67.71 ? 37 GLU B C 1 ATOM 3292 O O . GLU B 1 38 ? 46.751 99.289 42.651 1.00 66.43 ? 37 GLU B O 1 ATOM 3293 C CB . GLU B 1 38 ? 48.112 102.061 42.105 1.00 72.85 ? 37 GLU B CB 1 ATOM 3294 C CG . GLU B 1 38 ? 49.244 103.017 42.468 1.00 76.50 ? 37 GLU B CG 1 ATOM 3295 C CD . GLU B 1 38 ? 49.783 102.801 43.879 1.00 78.44 ? 37 GLU B CD 1 ATOM 3296 O OE1 . GLU B 1 38 ? 49.564 103.679 44.741 1.00 82.44 ? 37 GLU B OE1 1 ATOM 3297 O OE2 . GLU B 1 38 ? 50.424 101.756 44.130 1.00 77.16 ? 37 GLU B OE2 1 ATOM 3298 N N . SER B 1 39 ? 46.858 99.536 40.417 1.00 66.84 ? 38 SER B N 1 ATOM 3299 C CA . SER B 1 39 ? 45.690 98.726 40.179 1.00 66.73 ? 38 SER B CA 1 ATOM 3300 C C . SER B 1 39 ? 45.890 97.862 38.938 1.00 61.91 ? 38 SER B C 1 ATOM 3301 O O . SER B 1 39 ? 46.935 97.912 38.270 1.00 58.74 ? 38 SER B O 1 ATOM 3302 C CB . SER B 1 39 ? 44.461 99.641 40.058 1.00 70.37 ? 38 SER B CB 1 ATOM 3303 O OG . SER B 1 39 ? 43.270 98.885 40.201 1.00 74.27 ? 38 SER B OG 1 ATOM 3304 N N . TYR B 1 40 ? 44.882 97.047 38.643 1.00 60.15 ? 39 TYR B N 1 ATOM 3305 C CA . TYR B 1 40 ? 44.882 96.249 37.426 1.00 57.33 ? 39 TYR B CA 1 ATOM 3306 C C . TYR B 1 40 ? 44.621 97.157 36.213 1.00 57.48 ? 39 TYR B C 1 ATOM 3307 O O . TYR B 1 40 ? 43.931 98.180 36.337 1.00 59.64 ? 39 TYR B O 1 ATOM 3308 C CB . TYR B 1 40 ? 43.841 95.127 37.511 1.00 56.57 ? 39 TYR B CB 1 ATOM 3309 C CG . TYR B 1 40 ? 44.251 94.007 38.446 1.00 55.73 ? 39 TYR B CG 1 ATOM 3310 C CD1 . TYR B 1 40 ? 44.105 94.130 39.825 1.00 55.88 ? 39 TYR B CD1 1 ATOM 3311 C CD2 . TYR B 1 40 ? 44.807 92.826 37.951 1.00 54.25 ? 39 TYR B CD2 1 ATOM 3312 C CE1 . TYR B 1 40 ? 44.489 93.115 40.684 1.00 55.18 ? 39 TYR B CE1 1 ATOM 3313 C CE2 . TYR B 1 40 ? 45.192 91.801 38.806 1.00 52.87 ? 39 TYR B CE2 1 ATOM 3314 C CZ . TYR B 1 40 ? 45.030 91.952 40.171 1.00 53.94 ? 39 TYR B CZ 1 ATOM 3315 O OH . TYR B 1 40 ? 45.417 90.949 41.022 1.00 52.62 ? 39 TYR B OH 1 ATOM 3316 N N . PHE B 1 41 ? 45.204 96.810 35.070 1.00 54.99 ? 40 PHE B N 1 ATOM 3317 C CA . PHE B 1 41 ? 44.940 97.503 33.811 1.00 54.89 ? 40 PHE B CA 1 ATOM 3318 C C . PHE B 1 41 ? 44.690 96.432 32.752 1.00 54.29 ? 40 PHE B C 1 ATOM 3319 O O . PHE B 1 41 ? 45.050 95.272 32.929 1.00 54.15 ? 40 PHE B O 1 ATOM 3320 C CB . PHE B 1 41 ? 46.122 98.378 33.410 1.00 54.47 ? 40 PHE B CB 1 ATOM 3321 C CG . PHE B 1 41 ? 47.370 97.602 33.121 1.00 53.48 ? 40 PHE B CG 1 ATOM 3322 C CD1 . PHE B 1 41 ? 48.202 97.202 34.159 1.00 53.27 ? 40 PHE B CD1 1 ATOM 3323 C CD2 . PHE B 1 41 ? 47.705 97.248 31.813 1.00 52.30 ? 40 PHE B CD2 1 ATOM 3324 C CE1 . PHE B 1 41 ? 49.345 96.470 33.898 1.00 51.94 ? 40 PHE B CE1 1 ATOM 3325 C CE2 . PHE B 1 41 ? 48.851 96.522 31.549 1.00 50.70 ? 40 PHE B CE2 1 ATOM 3326 C CZ . PHE B 1 41 ? 49.670 96.134 32.593 1.00 50.54 ? 40 PHE B CZ 1 ATOM 3327 N N . THR B 1 42 ? 44.076 96.825 31.646 1.00 54.31 ? 41 THR B N 1 ATOM 3328 C CA . THR B 1 42 ? 43.801 95.891 30.566 1.00 53.02 ? 41 THR B CA 1 ATOM 3329 C C . THR B 1 42 ? 45.070 95.567 29.787 1.00 52.53 ? 41 THR B C 1 ATOM 3330 O O . THR B 1 42 ? 45.687 96.454 29.187 1.00 54.16 ? 41 THR B O 1 ATOM 3331 C CB . THR B 1 42 ? 42.741 96.427 29.593 1.00 53.11 ? 41 THR B CB 1 ATOM 3332 O OG1 . THR B 1 42 ? 41.508 96.560 30.293 1.00 54.10 ? 41 THR B OG1 1 ATOM 3333 C CG2 . THR B 1 42 ? 42.533 95.465 28.417 1.00 52.33 ? 41 THR B CG2 1 ATOM 3334 N N . ILE B 1 43 ? 45.444 94.298 29.794 1.00 51.68 ? 42 ILE B N 1 ATOM 3335 C CA . ILE B 1 43 ? 46.627 93.838 29.066 1.00 50.62 ? 42 ILE B CA 1 ATOM 3336 C C . ILE B 1 43 ? 46.275 93.180 27.720 1.00 50.65 ? 42 ILE B C 1 ATOM 3337 O O . ILE B 1 43 ? 47.122 93.050 26.846 1.00 49.85 ? 42 ILE B O 1 ATOM 3338 C CB . ILE B 1 43 ? 47.502 92.934 29.971 1.00 49.78 ? 42 ILE B CB 1 ATOM 3339 C CG1 . ILE B 1 43 ? 48.943 92.906 29.467 1.00 49.13 ? 42 ILE B CG1 1 ATOM 3340 C CG2 . ILE B 1 43 ? 46.925 91.530 30.090 1.00 49.28 ? 42 ILE B CG2 1 ATOM 3341 C CD1 . ILE B 1 43 ? 49.879 92.133 30.369 1.00 48.92 ? 42 ILE B CD1 1 ATOM 3342 N N . TRP B 1 44 ? 45.029 92.743 27.566 1.00 51.96 ? 43 TRP B N 1 ATOM 3343 C CA . TRP B 1 44 ? 44.487 92.327 26.271 1.00 52.47 ? 43 TRP B CA 1 ATOM 3344 C C . TRP B 1 44 ? 43.009 92.723 26.236 1.00 54.51 ? 43 TRP B C 1 ATOM 3345 O O . TRP B 1 44 ? 42.274 92.357 27.158 1.00 54.07 ? 43 TRP B O 1 ATOM 3346 C CB . TRP B 1 44 ? 44.633 90.820 26.070 1.00 52.26 ? 43 TRP B CB 1 ATOM 3347 C CG . TRP B 1 44 ? 44.136 90.356 24.732 1.00 52.41 ? 43 TRP B CG 1 ATOM 3348 C CD1 . TRP B 1 44 ? 42.920 89.816 24.454 1.00 53.04 ? 43 TRP B CD1 1 ATOM 3349 C CD2 . TRP B 1 44 ? 44.842 90.415 23.492 1.00 51.90 ? 43 TRP B CD2 1 ATOM 3350 N NE1 . TRP B 1 44 ? 42.823 89.524 23.116 1.00 52.94 ? 43 TRP B NE1 1 ATOM 3351 C CE2 . TRP B 1 44 ? 43.992 89.887 22.501 1.00 52.29 ? 43 TRP B CE2 1 ATOM 3352 C CE3 . TRP B 1 44 ? 46.118 90.861 23.121 1.00 53.17 ? 43 TRP B CE3 1 ATOM 3353 C CZ2 . TRP B 1 44 ? 44.370 89.797 21.156 1.00 52.76 ? 43 TRP B CZ2 1 ATOM 3354 C CZ3 . TRP B 1 44 ? 46.498 90.772 21.781 1.00 52.19 ? 43 TRP B CZ3 1 ATOM 3355 C CH2 . TRP B 1 44 ? 45.625 90.245 20.816 1.00 51.98 ? 43 TRP B CH2 1 ATOM 3356 N N . LEU B 1 45 ? 42.529 93.450 25.211 1.00 57.97 ? 44 LEU B N 1 ATOM 3357 C CA . LEU B 1 45 ? 43.299 93.971 24.083 1.00 59.21 ? 44 LEU B CA 1 ATOM 3358 C C . LEU B 1 45 ? 43.486 95.473 24.250 1.00 61.90 ? 44 LEU B C 1 ATOM 3359 O O . LEU B 1 45 ? 42.497 96.203 24.399 1.00 63.20 ? 44 LEU B O 1 ATOM 3360 C CB . LEU B 1 45 ? 42.565 93.698 22.765 1.00 60.20 ? 44 LEU B CB 1 ATOM 3361 C CG . LEU B 1 45 ? 43.104 94.357 21.484 1.00 60.60 ? 44 LEU B CG 1 ATOM 3362 C CD1 . LEU B 1 45 ? 44.518 93.891 21.178 1.00 58.98 ? 44 LEU B CD1 1 ATOM 3363 C CD2 . LEU B 1 45 ? 42.182 94.076 20.307 1.00 60.90 ? 44 LEU B CD2 1 ATOM 3364 N N . ASN B 1 46 ? 44.740 95.920 24.249 1.00 64.05 ? 45 ASN B N 1 ATOM 3365 C CA . ASN B 1 46 ? 45.029 97.348 24.301 1.00 67.55 ? 45 ASN B CA 1 ATOM 3366 C C . ASN B 1 46 ? 46.107 97.657 23.281 1.00 69.13 ? 45 ASN B C 1 ATOM 3367 O O . ASN B 1 46 ? 47.264 97.269 23.462 1.00 65.80 ? 45 ASN B O 1 ATOM 3368 C CB . ASN B 1 46 ? 45.471 97.722 25.720 1.00 68.74 ? 45 ASN B CB 1 ATOM 3369 C CG . ASN B 1 46 ? 45.680 99.214 25.912 1.00 70.56 ? 45 ASN B CG 1 ATOM 3370 O OD1 . ASN B 1 46 ? 45.828 99.981 24.957 1.00 69.09 ? 45 ASN B OD1 1 ATOM 3371 N ND2 . ASN B 1 46 ? 45.693 99.631 27.175 1.00 72.34 ? 45 ASN B ND2 1 ATOM 3372 N N . LEU B 1 47 ? 45.698 98.340 22.205 1.00 75.12 ? 46 LEU B N 1 ATOM 3373 C CA . LEU B 1 47 ? 46.554 98.519 21.042 1.00 78.02 ? 46 LEU B CA 1 ATOM 3374 C C . LEU B 1 47 ? 47.791 99.344 21.341 1.00 77.71 ? 46 LEU B C 1 ATOM 3375 O O . LEU B 1 47 ? 48.824 99.172 20.725 1.00 73.77 ? 46 LEU B O 1 ATOM 3376 C CB . LEU B 1 47 ? 45.779 99.185 19.898 1.00 82.58 ? 46 LEU B CB 1 ATOM 3377 C CG . LEU B 1 47 ? 44.714 98.314 19.227 1.00 83.41 ? 46 LEU B CG 1 ATOM 3378 C CD1 . LEU B 1 47 ? 43.820 99.163 18.330 1.00 86.16 ? 46 LEU B CD1 1 ATOM 3379 C CD2 . LEU B 1 47 ? 45.364 97.174 18.451 1.00 81.06 ? 46 LEU B CD2 1 ATOM 3380 N N . GLU B 1 48 ? 47.688 100.239 22.315 1.00 78.47 ? 47 GLU B N 1 ATOM 3381 C CA . GLU B 1 48 ? 48.799 101.113 22.644 1.00 80.29 ? 47 GLU B CA 1 ATOM 3382 C C . GLU B 1 48 ? 49.995 100.362 23.246 1.00 74.93 ? 47 GLU B C 1 ATOM 3383 O O . GLU B 1 48 ? 51.123 100.872 23.205 1.00 76.31 ? 47 GLU B O 1 ATOM 3384 C CB . GLU B 1 48 ? 48.342 102.165 23.667 1.00 88.74 ? 47 GLU B CB 1 ATOM 3385 C CG . GLU B 1 48 ? 47.305 103.161 23.156 1.00 94.07 ? 47 GLU B CG 1 ATOM 3386 C CD . GLU B 1 48 ? 46.781 104.080 24.253 1.00 100.69 ? 47 GLU B CD 1 ATOM 3387 O OE1 . GLU B 1 48 ? 46.442 103.579 25.356 1.00 102.79 ? 47 GLU B OE1 1 ATOM 3388 O OE2 . GLU B 1 48 ? 46.699 105.305 24.010 1.00 102.09 ? 47 GLU B OE2 1 ATOM 3389 N N . LEU B 1 49 ? 49.757 99.156 23.784 1.00 70.19 ? 48 LEU B N 1 ATOM 3390 C CA . LEU B 1 49 ? 50.815 98.378 24.397 1.00 64.86 ? 48 LEU B CA 1 ATOM 3391 C C . LEU B 1 49 ? 51.643 97.608 23.357 1.00 61.31 ? 48 LEU B C 1 ATOM 3392 O O . LEU B 1 49 ? 52.736 97.055 23.691 1.00 56.41 ? 48 LEU B O 1 ATOM 3393 C CB . LEU B 1 49 ? 50.219 97.395 25.420 1.00 62.30 ? 48 LEU B CB 1 ATOM 3394 C CG . LEU B 1 49 ? 49.237 97.957 26.455 1.00 63.38 ? 48 LEU B CG 1 ATOM 3395 C CD1 . LEU B 1 49 ? 48.672 96.842 27.329 1.00 62.28 ? 48 LEU B CD1 1 ATOM 3396 C CD2 . LEU B 1 49 ? 49.899 99.024 27.312 1.00 64.92 ? 48 LEU B CD2 1 ATOM 3397 N N . LEU B 1 50 ? 51.130 97.560 22.127 1.00 63.84 ? 49 LEU B N 1 ATOM 3398 C CA . LEU B 1 50 ? 51.721 96.728 21.088 1.00 65.89 ? 49 LEU B CA 1 ATOM 3399 C C . LEU B 1 50 ? 52.555 97.497 20.050 1.00 66.42 ? 49 LEU B C 1 ATOM 3400 O O . LEU B 1 50 ? 53.039 96.921 19.079 1.00 66.72 ? 49 LEU B O 1 ATOM 3401 C CB . LEU B 1 50 ? 50.597 95.958 20.403 1.00 68.24 ? 49 LEU B CB 1 ATOM 3402 C CG . LEU B 1 50 ? 49.566 95.320 21.351 1.00 70.61 ? 49 LEU B CG 1 ATOM 3403 C CD1 . LEU B 1 50 ? 48.394 94.735 20.573 1.00 72.53 ? 49 LEU B CD1 1 ATOM 3404 C CD2 . LEU B 1 50 ? 50.213 94.270 22.244 1.00 68.05 ? 49 LEU B CD2 1 ATOM 3405 N N . LEU B 1 51 ? 52.763 98.807 20.275 1.00 67.80 ? 50 LEU B N 1 ATOM 3406 C CA . LEU B 1 51 ? 53.691 99.589 19.438 1.00 68.50 ? 50 LEU B CA 1 ATOM 3407 C C . LEU B 1 51 ? 55.134 99.108 19.583 1.00 68.44 ? 50 LEU B C 1 ATOM 3408 O O . LEU B 1 51 ? 55.491 98.500 20.576 1.00 69.25 ? 50 LEU B O 1 ATOM 3409 C CB . LEU B 1 51 ? 53.586 101.068 19.819 1.00 71.32 ? 50 LEU B CB 1 ATOM 3410 C CG . LEU B 1 51 ? 52.187 101.702 19.840 1.00 71.93 ? 50 LEU B CG 1 ATOM 3411 C CD1 . LEU B 1 51 ? 52.267 103.149 20.310 1.00 74.42 ? 50 LEU B CD1 1 ATOM 3412 C CD2 . LEU B 1 51 ? 51.536 101.609 18.468 1.00 72.34 ? 50 LEU B CD2 1 ATOM 3413 N N . PRO B 1 52 ? 56.018 99.402 18.631 1.00 69.97 ? 51 PRO B N 1 ATOM 3414 C CA . PRO B 1 52 ? 57.333 98.665 18.544 1.00 69.81 ? 51 PRO B CA 1 ATOM 3415 C C . PRO B 1 52 ? 58.476 98.271 19.589 1.00 69.08 ? 51 PRO B C 1 ATOM 3416 O O . PRO B 1 52 ? 59.102 97.193 19.343 1.00 73.00 ? 51 PRO B O 1 ATOM 3417 C CB . PRO B 1 52 ? 58.000 99.402 17.374 1.00 71.35 ? 51 PRO B CB 1 ATOM 3418 C CG . PRO B 1 52 ? 56.862 99.730 16.457 1.00 71.86 ? 51 PRO B CG 1 ATOM 3419 C CD . PRO B 1 52 ? 55.689 100.072 17.345 1.00 71.51 ? 51 PRO B CD 1 ATOM 3420 N N . VAL B 1 53 ? 58.859 99.128 20.528 1.00 65.38 ? 52 VAL B N 1 ATOM 3421 C CA . VAL B 1 53 ? 59.758 98.843 21.582 1.00 64.24 ? 52 VAL B CA 1 ATOM 3422 C C . VAL B 1 53 ? 58.915 98.518 22.797 1.00 60.46 ? 52 VAL B C 1 ATOM 3423 O O . VAL B 1 53 ? 59.279 97.656 23.651 1.00 61.11 ? 52 VAL B O 1 ATOM 3424 C CB . VAL B 1 53 ? 60.650 100.108 21.815 1.00 66.21 ? 52 VAL B CB 1 ATOM 3425 C CG1 . VAL B 1 53 ? 61.654 99.915 22.944 1.00 66.17 ? 52 VAL B CG1 1 ATOM 3426 C CG2 . VAL B 1 53 ? 61.344 100.522 20.520 1.00 65.64 ? 52 VAL B CG2 1 ATOM 3427 N N . ILE B 1 54 ? 57.819 99.281 22.972 1.00 59.06 ? 53 ILE B N 1 ATOM 3428 C CA . ILE B 1 54 ? 56.949 98.999 24.131 1.00 57.09 ? 53 ILE B CA 1 ATOM 3429 C C . ILE B 1 54 ? 56.374 97.597 24.075 1.00 54.33 ? 53 ILE B C 1 ATOM 3430 O O . ILE B 1 54 ? 56.085 97.030 25.087 1.00 52.10 ? 53 ILE B O 1 ATOM 3431 C CB . ILE B 1 54 ? 56.011 100.080 24.695 1.00 59.10 ? 53 ILE B CB 1 ATOM 3432 C CG1 . ILE B 1 54 ? 54.784 100.317 23.840 1.00 60.24 ? 53 ILE B CG1 1 ATOM 3433 C CG2 . ILE B 1 54 ? 56.778 101.367 24.965 1.00 61.86 ? 53 ILE B CG2 1 ATOM 3434 C CD1 . ILE B 1 54 ? 53.743 101.135 24.584 1.00 62.59 ? 53 ILE B CD1 1 ATOM 3435 N N . ILE B 1 55 ? 56.258 97.005 22.892 1.00 52.96 ? 54 ILE B N 1 ATOM 3436 C CA . ILE B 1 55 ? 55.847 95.597 22.748 1.00 51.12 ? 54 ILE B CA 1 ATOM 3437 C C . ILE B 1 55 ? 56.715 94.631 23.584 1.00 49.29 ? 54 ILE B C 1 ATOM 3438 O O . ILE B 1 55 ? 56.235 93.598 24.038 1.00 48.35 ? 54 ILE B O 1 ATOM 3439 C CB . ILE B 1 55 ? 55.963 95.186 21.252 1.00 51.31 ? 54 ILE B CB 1 ATOM 3440 C CG1 . ILE B 1 55 ? 55.359 93.812 20.984 1.00 50.72 ? 54 ILE B CG1 1 ATOM 3441 C CG2 . ILE B 1 55 ? 57.412 95.178 20.769 1.00 50.52 ? 54 ILE B CG2 1 ATOM 3442 C CD1 . ILE B 1 55 ? 53.856 93.819 20.991 1.00 53.12 ? 54 ILE B CD1 1 ATOM 3443 N N . ASP B 1 56 ? 57.990 94.967 23.780 1.00 49.13 ? 55 ASP B N 1 ATOM 3444 C CA . ASP B 1 56 ? 58.855 94.116 24.620 1.00 49.26 ? 55 ASP B CA 1 ATOM 3445 C C . ASP B 1 56 ? 58.384 94.107 26.090 1.00 49.99 ? 55 ASP B C 1 ATOM 3446 O O . ASP B 1 56 ? 58.477 93.073 26.773 1.00 49.53 ? 55 ASP B O 1 ATOM 3447 C CB . ASP B 1 56 ? 60.327 94.540 24.575 1.00 51.56 ? 55 ASP B CB 1 ATOM 3448 C CG . ASP B 1 56 ? 61.002 94.229 23.244 1.00 53.44 ? 55 ASP B CG 1 ATOM 3449 O OD1 . ASP B 1 56 ? 60.650 93.233 22.590 1.00 53.19 ? 55 ASP B OD1 1 ATOM 3450 O OD2 . ASP B 1 56 ? 61.911 94.990 22.856 1.00 58.22 ? 55 ASP B OD2 1 ATOM 3451 N N . CYS B 1 57 ? 57.889 95.252 26.560 1.00 49.59 ? 56 CYS B N 1 ATOM 3452 C CA . CYS B 1 57 ? 57.288 95.347 27.896 1.00 49.85 ? 56 CYS B CA 1 ATOM 3453 C C . CYS B 1 57 ? 56.055 94.425 27.988 1.00 47.66 ? 56 CYS B C 1 ATOM 3454 O O . CYS B 1 57 ? 55.862 93.701 28.980 1.00 46.93 ? 56 CYS B O 1 ATOM 3455 C CB . CYS B 1 57 ? 56.877 96.795 28.224 1.00 52.88 ? 56 CYS B CB 1 ATOM 3456 S SG . CYS B 1 57 ? 58.199 98.021 28.011 1.00 56.30 ? 56 CYS B SG 1 ATOM 3457 N N . TRP B 1 58 ? 55.191 94.497 26.973 1.00 46.21 ? 57 TRP B N 1 ATOM 3458 C CA . TRP B 1 58 ? 53.997 93.695 26.931 1.00 44.50 ? 57 TRP B CA 1 ATOM 3459 C C . TRP B 1 58 ? 54.316 92.199 26.943 1.00 43.07 ? 57 TRP B C 1 ATOM 3460 O O . TRP B 1 58 ? 53.754 91.432 27.726 1.00 42.53 ? 57 TRP B O 1 ATOM 3461 C CB . TRP B 1 58 ? 53.170 94.053 25.697 1.00 43.76 ? 57 TRP B CB 1 ATOM 3462 C CG . TRP B 1 58 ? 51.909 93.272 25.548 1.00 43.72 ? 57 TRP B CG 1 ATOM 3463 C CD1 . TRP B 1 58 ? 50.740 93.474 26.208 1.00 45.08 ? 57 TRP B CD1 1 ATOM 3464 C CD2 . TRP B 1 58 ? 51.683 92.174 24.661 1.00 42.55 ? 57 TRP B CD2 1 ATOM 3465 N NE1 . TRP B 1 58 ? 49.797 92.566 25.798 1.00 44.43 ? 57 TRP B NE1 1 ATOM 3466 C CE2 . TRP B 1 58 ? 50.351 91.758 24.844 1.00 42.66 ? 57 TRP B CE2 1 ATOM 3467 C CE3 . TRP B 1 58 ? 52.478 91.507 23.721 1.00 41.72 ? 57 TRP B CE3 1 ATOM 3468 C CZ2 . TRP B 1 58 ? 49.791 90.704 24.127 1.00 42.95 ? 57 TRP B CZ2 1 ATOM 3469 C CZ3 . TRP B 1 58 ? 51.924 90.454 23.014 1.00 41.70 ? 57 TRP B CZ3 1 ATOM 3470 C CH2 . TRP B 1 58 ? 50.593 90.064 23.220 1.00 41.95 ? 57 TRP B CH2 1 ATOM 3471 N N . ILE B 1 59 ? 55.234 91.797 26.073 1.00 42.07 ? 58 ILE B N 1 ATOM 3472 C CA . ILE B 1 59 ? 55.702 90.410 26.015 1.00 41.50 ? 58 ILE B CA 1 ATOM 3473 C C . ILE B 1 59 ? 56.198 89.952 27.398 1.00 41.81 ? 58 ILE B C 1 ATOM 3474 O O . ILE B 1 59 ? 55.887 88.862 27.864 1.00 39.83 ? 58 ILE B O 1 ATOM 3475 C CB . ILE B 1 59 ? 56.917 90.258 25.059 1.00 40.87 ? 58 ILE B CB 1 ATOM 3476 C CG1 . ILE B 1 59 ? 56.568 90.590 23.595 1.00 42.14 ? 58 ILE B CG1 1 ATOM 3477 C CG2 . ILE B 1 59 ? 57.532 88.867 25.158 1.00 39.05 ? 58 ILE B CG2 1 ATOM 3478 C CD1 . ILE B 1 59 ? 55.628 89.627 22.935 1.00 43.36 ? 58 ILE B CD1 1 ATOM 3479 N N . ASP B 1 60 ? 56.990 90.802 28.043 1.00 43.50 ? 59 ASP B N 1 ATOM 3480 C CA . ASP B 1 60 ? 57.562 90.440 29.343 1.00 44.32 ? 59 ASP B CA 1 ATOM 3481 C C . ASP B 1 60 ? 56.494 90.217 30.413 1.00 45.81 ? 59 ASP B C 1 ATOM 3482 O O . ASP B 1 60 ? 56.728 89.448 31.357 1.00 46.99 ? 59 ASP B O 1 ATOM 3483 C CB . ASP B 1 60 ? 58.573 91.454 29.864 1.00 45.16 ? 59 ASP B CB 1 ATOM 3484 C CG . ASP B 1 60 ? 59.424 90.877 30.987 1.00 45.91 ? 59 ASP B CG 1 ATOM 3485 O OD1 . ASP B 1 60 ? 59.964 89.767 30.787 1.00 46.61 ? 59 ASP B OD1 1 ATOM 3486 O OD2 . ASP B 1 60 ? 59.550 91.507 32.063 1.00 47.24 ? 59 ASP B OD2 1 ATOM 3487 N N . ASN B 1 61 ? 55.342 90.876 30.280 1.00 44.78 ? 60 ASN B N 1 ATOM 3488 C CA . ASN B 1 61 ? 54.252 90.742 31.246 1.00 44.83 ? 60 ASN B CA 1 ATOM 3489 C C . ASN B 1 61 ? 53.247 89.645 30.906 1.00 45.59 ? 60 ASN B C 1 ATOM 3490 O O . ASN B 1 61 ? 52.687 89.010 31.813 1.00 46.01 ? 60 ASN B O 1 ATOM 3491 C CB . ASN B 1 61 ? 53.502 92.061 31.414 1.00 45.28 ? 60 ASN B CB 1 ATOM 3492 C CG . ASN B 1 61 ? 54.301 93.100 32.170 1.00 45.61 ? 60 ASN B CG 1 ATOM 3493 O OD1 . ASN B 1 61 ? 55.129 92.775 33.011 1.00 45.52 ? 60 ASN B OD1 1 ATOM 3494 N ND2 . ASN B 1 61 ? 54.059 94.361 31.859 1.00 46.31 ? 60 ASN B ND2 1 ATOM 3495 N N . ILE B 1 62 ? 52.980 89.450 29.618 1.00 44.13 ? 61 ILE B N 1 ATOM 3496 C CA . ILE B 1 62 ? 51.944 88.500 29.222 1.00 43.01 ? 61 ILE B CA 1 ATOM 3497 C C . ILE B 1 62 ? 52.470 87.089 28.936 1.00 42.76 ? 61 ILE B C 1 ATOM 3498 O O . ILE B 1 62 ? 51.685 86.142 28.796 1.00 41.42 ? 61 ILE B O 1 ATOM 3499 C CB . ILE B 1 62 ? 51.135 89.020 28.015 1.00 42.92 ? 61 ILE B CB 1 ATOM 3500 C CG1 . ILE B 1 62 ? 49.756 88.356 27.995 1.00 42.69 ? 61 ILE B CG1 1 ATOM 3501 C CG2 . ILE B 1 62 ? 51.891 88.822 26.695 1.00 42.26 ? 61 ILE B CG2 1 ATOM 3502 C CD1 . ILE B 1 62 ? 48.848 88.898 26.923 1.00 44.22 ? 61 ILE B CD1 1 ATOM 3503 N N . ARG B 1 63 ? 53.787 86.949 28.807 1.00 43.60 ? 62 ARG B N 1 ATOM 3504 C CA . ARG B 1 63 ? 54.371 85.613 28.656 1.00 42.90 ? 62 ARG B CA 1 ATOM 3505 C C . ARG B 1 63 ? 54.099 84.749 29.898 1.00 43.63 ? 62 ARG B C 1 ATOM 3506 O O . ARG B 1 63 ? 53.945 85.284 30.998 1.00 43.65 ? 62 ARG B O 1 ATOM 3507 C CB . ARG B 1 63 ? 55.875 85.685 28.387 1.00 42.85 ? 62 ARG B CB 1 ATOM 3508 C CG . ARG B 1 63 ? 56.689 86.103 29.589 1.00 43.52 ? 62 ARG B CG 1 ATOM 3509 C CD . ARG B 1 63 ? 58.136 86.346 29.234 1.00 44.47 ? 62 ARG B CD 1 ATOM 3510 N NE . ARG B 1 63 ? 58.792 87.012 30.358 1.00 47.53 ? 62 ARG B NE 1 ATOM 3511 C CZ . ARG B 1 63 ? 59.523 86.418 31.299 1.00 49.70 ? 62 ARG B CZ 1 ATOM 3512 N NH1 . ARG B 1 63 ? 59.741 85.104 31.289 1.00 50.91 ? 62 ARG B NH1 1 ATOM 3513 N NH2 . ARG B 1 63 ? 60.048 87.157 32.268 1.00 50.86 ? 62 ARG B NH2 1 ATOM 3514 N N . LEU B 1 64 ? 53.985 83.438 29.690 1.00 43.29 ? 63 LEU B N 1 ATOM 3515 C CA . LEU B 1 64 ? 54.044 82.461 30.779 1.00 43.89 ? 63 LEU B CA 1 ATOM 3516 C C . LEU B 1 64 ? 55.462 81.914 30.925 1.00 43.96 ? 63 LEU B C 1 ATOM 3517 O O . LEU B 1 64 ? 56.176 81.745 29.936 1.00 45.07 ? 63 LEU B O 1 ATOM 3518 C CB . LEU B 1 64 ? 53.083 81.300 30.532 1.00 43.27 ? 63 LEU B CB 1 ATOM 3519 C CG . LEU B 1 64 ? 51.588 81.616 30.425 1.00 44.37 ? 63 LEU B CG 1 ATOM 3520 C CD1 . LEU B 1 64 ? 50.834 80.347 30.075 1.00 44.27 ? 63 LEU B CD1 1 ATOM 3521 C CD2 . LEU B 1 64 ? 51.028 82.237 31.703 1.00 45.51 ? 63 LEU B CD2 1 ATOM 3522 N N . VAL B 1 65 ? 55.869 81.635 32.156 1.00 44.75 ? 64 VAL B N 1 ATOM 3523 C CA . VAL B 1 65 ? 57.144 80.998 32.438 1.00 47.29 ? 64 VAL B CA 1 ATOM 3524 C C . VAL B 1 65 ? 56.885 79.495 32.651 1.00 48.58 ? 64 VAL B C 1 ATOM 3525 O O . VAL B 1 65 ? 56.026 79.113 33.445 1.00 48.21 ? 64 VAL B O 1 ATOM 3526 C CB . VAL B 1 65 ? 57.803 81.624 33.692 1.00 50.14 ? 64 VAL B CB 1 ATOM 3527 C CG1 . VAL B 1 65 ? 59.061 80.863 34.097 1.00 51.01 ? 64 VAL B CG1 1 ATOM 3528 C CG2 . VAL B 1 65 ? 58.133 83.091 33.443 1.00 50.94 ? 64 VAL B CG2 1 ATOM 3529 N N . TYR B 1 66 ? 57.601 78.653 31.917 1.00 47.92 ? 65 TYR B N 1 ATOM 3530 C CA . TYR B 1 66 ? 57.441 77.211 32.079 1.00 48.60 ? 65 TYR B CA 1 ATOM 3531 C C . TYR B 1 66 ? 58.470 76.684 33.079 1.00 50.44 ? 65 TYR B C 1 ATOM 3532 O O . TYR B 1 66 ? 59.673 76.886 32.927 1.00 50.45 ? 65 TYR B O 1 ATOM 3533 C CB . TYR B 1 66 ? 57.550 76.460 30.750 1.00 47.06 ? 65 TYR B CB 1 ATOM 3534 C CG . TYR B 1 66 ? 57.092 75.024 30.884 1.00 47.80 ? 65 TYR B CG 1 ATOM 3535 C CD1 . TYR B 1 66 ? 55.749 74.697 30.796 1.00 47.73 ? 65 TYR B CD1 1 ATOM 3536 C CD2 . TYR B 1 66 ? 58.000 74.001 31.149 1.00 48.17 ? 65 TYR B CD2 1 ATOM 3537 C CE1 . TYR B 1 66 ? 55.322 73.393 30.937 1.00 47.96 ? 65 TYR B CE1 1 ATOM 3538 C CE2 . TYR B 1 66 ? 57.580 72.690 31.290 1.00 47.81 ? 65 TYR B CE2 1 ATOM 3539 C CZ . TYR B 1 66 ? 56.242 72.395 31.187 1.00 48.39 ? 65 TYR B CZ 1 ATOM 3540 O OH . TYR B 1 66 ? 55.819 71.096 31.342 1.00 50.49 ? 65 TYR B OH 1 ATOM 3541 N N . ASN B 1 67 ? 57.977 76.017 34.120 1.00 52.07 ? 66 ASN B N 1 ATOM 3542 C CA . ASN B 1 67 ? 58.856 75.389 35.106 1.00 55.88 ? 66 ASN B CA 1 ATOM 3543 C C . ASN B 1 67 ? 58.971 73.902 34.801 1.00 56.51 ? 66 ASN B C 1 ATOM 3544 O O . ASN B 1 67 ? 58.005 73.165 34.957 1.00 56.90 ? 66 ASN B O 1 ATOM 3545 C CB . ASN B 1 67 ? 58.300 75.617 36.511 1.00 58.83 ? 66 ASN B CB 1 ATOM 3546 C CG . ASN B 1 67 ? 59.216 75.093 37.600 1.00 62.05 ? 66 ASN B CG 1 ATOM 3547 O OD1 . ASN B 1 67 ? 59.913 74.090 37.420 1.00 60.95 ? 66 ASN B OD1 1 ATOM 3548 N ND2 . ASN B 1 67 ? 59.225 75.781 38.746 1.00 66.93 ? 66 ASN B ND2 1 ATOM 3549 N N . LYS B 1 68 ? 60.155 73.477 34.375 1.00 57.59 ? 67 LYS B N 1 ATOM 3550 C CA . LYS B 1 68 ? 60.392 72.099 33.938 1.00 59.96 ? 67 LYS B CA 1 ATOM 3551 C C . LYS B 1 68 ? 60.279 71.075 35.072 1.00 62.66 ? 67 LYS B C 1 ATOM 3552 O O . LYS B 1 68 ? 59.947 69.916 34.849 1.00 64.24 ? 67 LYS B O 1 ATOM 3553 C CB . LYS B 1 68 ? 61.812 71.939 33.382 1.00 62.55 ? 67 LYS B CB 1 ATOM 3554 C CG . LYS B 1 68 ? 62.162 72.739 32.145 1.00 63.31 ? 67 LYS B CG 1 ATOM 3555 C CD . LYS B 1 68 ? 63.645 72.569 31.833 1.00 66.44 ? 67 LYS B CD 1 ATOM 3556 C CE . LYS B 1 68 ? 64.041 73.218 30.517 1.00 68.15 ? 67 LYS B CE 1 ATOM 3557 N NZ . LYS B 1 68 ? 63.746 74.679 30.505 1.00 68.61 ? 67 LYS B NZ 1 ATOM 3558 N N . THR B 1 69 ? 60.579 71.512 36.289 1.00 64.22 ? 68 THR B N 1 ATOM 3559 C CA . THR B 1 69 ? 60.526 70.623 37.465 1.00 65.71 ? 68 THR B CA 1 ATOM 3560 C C . THR B 1 69 ? 59.085 70.331 37.858 1.00 65.51 ? 68 THR B C 1 ATOM 3561 O O . THR B 1 69 ? 58.720 69.178 38.041 1.00 66.57 ? 68 THR B O 1 ATOM 3562 C CB . THR B 1 69 ? 61.322 71.213 38.647 1.00 68.37 ? 68 THR B CB 1 ATOM 3563 O OG1 . THR B 1 69 ? 62.659 71.510 38.222 1.00 68.14 ? 68 THR B OG1 1 ATOM 3564 C CG2 . THR B 1 69 ? 61.370 70.238 39.815 1.00 69.11 ? 68 THR B CG2 1 ATOM 3565 N N . SER B 1 70 ? 58.265 71.374 37.985 1.00 64.78 ? 69 SER B N 1 ATOM 3566 C CA . SER B 1 70 ? 56.877 71.178 38.332 1.00 63.39 ? 69 SER B CA 1 ATOM 3567 C C . SER B 1 70 ? 55.999 70.814 37.126 1.00 61.24 ? 69 SER B C 1 ATOM 3568 O O . SER B 1 70 ? 54.856 70.445 37.314 1.00 59.79 ? 69 SER B O 1 ATOM 3569 C CB . SER B 1 70 ? 56.315 72.434 39.013 1.00 63.41 ? 69 SER B CB 1 ATOM 3570 O OG . SER B 1 70 ? 56.418 73.571 38.166 1.00 61.36 ? 69 SER B OG 1 ATOM 3571 N N . ARG B 1 71 ? 56.532 70.940 35.902 1.00 58.88 ? 70 ARG B N 1 ATOM 3572 C CA . ARG B 1 71 ? 55.766 70.765 34.681 1.00 57.82 ? 70 ARG B CA 1 ATOM 3573 C C . ARG B 1 71 ? 54.505 71.631 34.692 1.00 57.22 ? 70 ARG B C 1 ATOM 3574 O O . ARG B 1 71 ? 53.399 71.156 34.427 1.00 58.14 ? 70 ARG B O 1 ATOM 3575 C CB . ARG B 1 71 ? 55.401 69.284 34.470 1.00 58.11 ? 70 ARG B CB 1 ATOM 3576 C CG . ARG B 1 71 ? 56.596 68.339 34.423 1.00 58.57 ? 70 ARG B CG 1 ATOM 3577 C CD . ARG B 1 71 ? 57.502 68.613 33.236 1.00 58.12 ? 70 ARG B CD 1 ATOM 3578 N NE . ARG B 1 71 ? 56.831 68.321 31.969 1.00 58.29 ? 70 ARG B NE 1 ATOM 3579 C CZ . ARG B 1 71 ? 56.981 67.208 31.251 1.00 57.02 ? 70 ARG B CZ 1 ATOM 3580 N NH1 . ARG B 1 71 ? 57.799 66.240 31.639 1.00 57.84 ? 70 ARG B NH1 1 ATOM 3581 N NH2 . ARG B 1 71 ? 56.304 67.067 30.121 1.00 56.68 ? 70 ARG B NH2 1 ATOM 3582 N N . ALA B 1 72 ? 54.686 72.904 35.017 1.00 55.70 ? 71 ALA B N 1 ATOM 3583 C CA . ALA B 1 72 ? 53.573 73.827 35.197 1.00 54.57 ? 71 ALA B CA 1 ATOM 3584 C C . ALA B 1 72 ? 54.029 75.234 34.799 1.00 52.76 ? 71 ALA B C 1 ATOM 3585 O O . ALA B 1 72 ? 55.225 75.526 34.843 1.00 52.23 ? 71 ALA B O 1 ATOM 3586 C CB . ALA B 1 72 ? 53.103 73.823 36.643 1.00 54.47 ? 71 ALA B CB 1 ATOM 3587 N N . THR B 1 73 ? 53.089 76.075 34.389 1.00 51.45 ? 72 THR B N 1 ATOM 3588 C CA . THR B 1 73 ? 53.414 77.450 34.053 1.00 51.32 ? 72 THR B CA 1 ATOM 3589 C C . THR B 1 73 ? 53.223 78.344 35.261 1.00 52.21 ? 72 THR B C 1 ATOM 3590 O O . THR B 1 73 ? 52.435 78.041 36.154 1.00 53.50 ? 72 THR B O 1 ATOM 3591 C CB . THR B 1 73 ? 52.558 77.979 32.881 1.00 49.93 ? 72 THR B CB 1 ATOM 3592 O OG1 . THR B 1 73 ? 51.167 77.775 33.154 1.00 49.97 ? 72 THR B OG1 1 ATOM 3593 C CG2 . THR B 1 73 ? 52.925 77.277 31.580 1.00 48.71 ? 72 THR B CG2 1 ATOM 3594 N N . GLN B 1 74 ? 53.933 79.459 35.267 1.00 52.44 ? 73 GLN B N 1 ATOM 3595 C CA . GLN B 1 74 ? 53.750 80.481 36.283 1.00 55.26 ? 73 GLN B CA 1 ATOM 3596 C C . GLN B 1 74 ? 53.872 81.858 35.628 1.00 52.26 ? 73 GLN B C 1 ATOM 3597 O O . GLN B 1 74 ? 54.360 81.966 34.517 1.00 49.54 ? 73 GLN B O 1 ATOM 3598 C CB . GLN B 1 74 ? 54.767 80.286 37.428 1.00 58.08 ? 73 GLN B CB 1 ATOM 3599 C CG . GLN B 1 74 ? 56.190 79.971 36.962 1.00 59.22 ? 73 GLN B CG 1 ATOM 3600 C CD . GLN B 1 74 ? 57.070 79.318 38.022 1.00 60.23 ? 73 GLN B CD 1 ATOM 3601 O OE1 . GLN B 1 74 ? 56.763 78.238 38.528 1.00 60.41 ? 73 GLN B OE1 1 ATOM 3602 N NE2 . GLN B 1 74 ? 58.180 79.971 38.350 1.00 59.80 ? 73 GLN B NE2 1 ATOM 3603 N N . PHE B 1 75 ? 53.359 82.884 36.289 1.00 51.84 ? 74 PHE B N 1 ATOM 3604 C CA . PHE B 1 75 ? 53.491 84.242 35.787 1.00 49.12 ? 74 PHE B CA 1 ATOM 3605 C C . PHE B 1 75 ? 54.903 84.760 36.103 1.00 49.38 ? 74 PHE B C 1 ATOM 3606 O O . PHE B 1 75 ? 55.553 84.251 37.007 1.00 48.67 ? 74 PHE B O 1 ATOM 3607 C CB . PHE B 1 75 ? 52.427 85.167 36.383 1.00 49.95 ? 74 PHE B CB 1 ATOM 3608 C CG . PHE B 1 75 ? 51.004 84.649 36.280 1.00 49.39 ? 74 PHE B CG 1 ATOM 3609 C CD1 . PHE B 1 75 ? 50.570 83.905 35.194 1.00 48.83 ? 74 PHE B CD1 1 ATOM 3610 C CD2 . PHE B 1 75 ? 50.077 84.957 37.275 1.00 51.09 ? 74 PHE B CD2 1 ATOM 3611 C CE1 . PHE B 1 75 ? 49.254 83.456 35.115 1.00 48.83 ? 74 PHE B CE1 1 ATOM 3612 C CE2 . PHE B 1 75 ? 48.764 84.518 37.203 1.00 50.91 ? 74 PHE B CE2 1 ATOM 3613 C CZ . PHE B 1 75 ? 48.352 83.765 36.121 1.00 50.40 ? 74 PHE B CZ 1 ATOM 3614 N N . PRO B 1 76 ? 55.388 85.750 35.348 1.00 49.43 ? 75 PRO B N 1 ATOM 3615 C CA . PRO B 1 76 ? 56.688 86.324 35.697 1.00 50.03 ? 75 PRO B CA 1 ATOM 3616 C C . PRO B 1 76 ? 56.671 86.925 37.107 1.00 52.94 ? 75 PRO B C 1 ATOM 3617 O O . PRO B 1 76 ? 55.601 87.272 37.610 1.00 53.72 ? 75 PRO B O 1 ATOM 3618 C CB . PRO B 1 76 ? 56.884 87.425 34.646 1.00 48.41 ? 75 PRO B CB 1 ATOM 3619 C CG . PRO B 1 76 ? 56.021 87.032 33.503 1.00 47.68 ? 75 PRO B CG 1 ATOM 3620 C CD . PRO B 1 76 ? 54.862 86.270 34.073 1.00 48.00 ? 75 PRO B CD 1 ATOM 3621 N N . ASP B 1 77 ? 57.842 87.051 37.721 1.00 56.48 ? 76 ASP B N 1 ATOM 3622 C CA . ASP B 1 77 ? 57.946 87.620 39.057 1.00 59.37 ? 76 ASP B CA 1 ATOM 3623 C C . ASP B 1 77 ? 57.288 88.984 39.101 1.00 55.49 ? 76 ASP B C 1 ATOM 3624 O O . ASP B 1 77 ? 57.561 89.844 38.254 1.00 55.51 ? 76 ASP B O 1 ATOM 3625 C CB . ASP B 1 77 ? 59.415 87.792 39.491 1.00 67.58 ? 76 ASP B CB 1 ATOM 3626 C CG . ASP B 1 77 ? 60.136 86.466 39.717 1.00 74.10 ? 76 ASP B CG 1 ATOM 3627 O OD1 . ASP B 1 77 ? 59.485 85.468 40.107 1.00 81.62 ? 76 ASP B OD1 1 ATOM 3628 O OD2 . ASP B 1 77 ? 61.371 86.433 39.513 1.00 79.62 ? 76 ASP B OD2 1 ATOM 3629 N N . GLY B 1 78 ? 56.417 89.174 40.093 1.00 53.07 ? 77 GLY B N 1 ATOM 3630 C CA . GLY B 1 78 ? 55.742 90.445 40.312 1.00 51.85 ? 77 GLY B CA 1 ATOM 3631 C C . GLY B 1 78 ? 54.629 90.775 39.316 1.00 49.81 ? 77 GLY B C 1 ATOM 3632 O O . GLY B 1 78 ? 54.197 91.931 39.231 1.00 49.77 ? 77 GLY B O 1 ATOM 3633 N N . VAL B 1 79 ? 54.152 89.785 38.570 1.00 46.75 ? 78 VAL B N 1 ATOM 3634 C CA . VAL B 1 79 ? 53.043 89.998 37.656 1.00 46.19 ? 78 VAL B CA 1 ATOM 3635 C C . VAL B 1 79 ? 51.858 89.157 38.083 1.00 47.25 ? 78 VAL B C 1 ATOM 3636 O O . VAL B 1 79 ? 52.021 87.965 38.376 1.00 47.21 ? 78 VAL B O 1 ATOM 3637 C CB . VAL B 1 79 ? 53.425 89.685 36.199 1.00 44.52 ? 78 VAL B CB 1 ATOM 3638 C CG1 . VAL B 1 79 ? 52.209 89.824 35.285 1.00 44.35 ? 78 VAL B CG1 1 ATOM 3639 C CG2 . VAL B 1 79 ? 54.538 90.616 35.744 1.00 43.87 ? 78 VAL B CG2 1 ATOM 3640 N N . ASP B 1 80 ? 50.680 89.765 38.147 1.00 48.33 ? 79 ASP B N 1 ATOM 3641 C CA . ASP B 1 80 ? 49.440 88.994 38.250 1.00 49.10 ? 79 ASP B CA 1 ATOM 3642 C C . ASP B 1 80 ? 48.541 89.261 37.071 1.00 48.61 ? 79 ASP B C 1 ATOM 3643 O O . ASP B 1 80 ? 48.407 90.393 36.623 1.00 49.62 ? 79 ASP B O 1 ATOM 3644 C CB . ASP B 1 80 ? 48.686 89.289 39.551 1.00 51.57 ? 79 ASP B CB 1 ATOM 3645 C CG . ASP B 1 80 ? 47.514 88.328 39.781 1.00 52.51 ? 79 ASP B CG 1 ATOM 3646 O OD1 . ASP B 1 80 ? 47.709 87.105 39.607 1.00 53.06 ? 79 ASP B OD1 1 ATOM 3647 O OD2 . ASP B 1 80 ? 46.402 88.790 40.129 1.00 53.23 ? 79 ASP B OD2 1 ATOM 3648 N N . VAL B 1 81 ? 47.896 88.210 36.583 1.00 50.39 ? 80 VAL B N 1 ATOM 3649 C CA . VAL B 1 81 ? 46.974 88.312 35.457 1.00 50.66 ? 80 VAL B CA 1 ATOM 3650 C C . VAL B 1 81 ? 45.648 87.692 35.848 1.00 52.92 ? 80 VAL B C 1 ATOM 3651 O O . VAL B 1 81 ? 45.633 86.550 36.309 1.00 53.96 ? 80 VAL B O 1 ATOM 3652 C CB . VAL B 1 81 ? 47.540 87.597 34.216 1.00 48.11 ? 80 VAL B CB 1 ATOM 3653 C CG1 . VAL B 1 81 ? 46.545 87.647 33.066 1.00 48.54 ? 80 VAL B CG1 1 ATOM 3654 C CG2 . VAL B 1 81 ? 48.852 88.236 33.792 1.00 47.79 ? 80 VAL B CG2 1 ATOM 3655 N N . ARG B 1 82 ? 44.547 88.408 35.660 1.00 54.80 ? 81 ARG B N 1 ATOM 3656 C CA . ARG B 1 82 ? 43.231 87.874 35.966 1.00 57.64 ? 81 ARG B CA 1 ATOM 3657 C C . ARG B 1 82 ? 42.273 88.027 34.798 1.00 57.50 ? 81 ARG B C 1 ATOM 3658 O O . ARG B 1 82 ? 42.508 88.808 33.873 1.00 57.04 ? 81 ARG B O 1 ATOM 3659 C CB . ARG B 1 82 ? 42.656 88.553 37.209 1.00 61.60 ? 81 ARG B CB 1 ATOM 3660 C CG . ARG B 1 82 ? 42.082 89.934 36.945 1.00 64.93 ? 81 ARG B CG 1 ATOM 3661 C CD . ARG B 1 82 ? 41.684 90.632 38.228 1.00 68.68 ? 81 ARG B CD 1 ATOM 3662 N NE . ARG B 1 82 ? 41.141 91.957 37.955 1.00 72.41 ? 81 ARG B NE 1 ATOM 3663 C CZ . ARG B 1 82 ? 40.834 92.855 38.892 1.00 77.79 ? 81 ARG B CZ 1 ATOM 3664 N NH1 . ARG B 1 82 ? 41.004 92.576 40.183 1.00 79.59 ? 81 ARG B NH1 1 ATOM 3665 N NH2 . ARG B 1 82 ? 40.355 94.045 38.538 1.00 78.80 ? 81 ARG B NH2 1 ATOM 3666 N N . VAL B 1 83 ? 41.181 87.275 34.858 1.00 57.12 ? 82 VAL B N 1 ATOM 3667 C CA . VAL B 1 83 ? 40.175 87.271 33.817 1.00 55.77 ? 82 VAL B CA 1 ATOM 3668 C C . VAL B 1 83 ? 38.968 88.041 34.332 1.00 57.09 ? 82 VAL B C 1 ATOM 3669 O O . VAL B 1 83 ? 38.326 87.588 35.250 1.00 58.95 ? 82 VAL B O 1 ATOM 3670 C CB . VAL B 1 83 ? 39.751 85.829 33.481 1.00 54.16 ? 82 VAL B CB 1 ATOM 3671 C CG1 . VAL B 1 83 ? 38.656 85.813 32.423 1.00 54.37 ? 82 VAL B CG1 1 ATOM 3672 C CG2 . VAL B 1 83 ? 40.954 85.011 33.038 1.00 52.31 ? 82 VAL B CG2 1 ATOM 3673 N N . PRO B 1 84 ? 38.666 89.210 33.759 1.00 58.44 ? 83 PRO B N 1 ATOM 3674 C CA . PRO B 1 84 ? 37.464 89.933 34.158 1.00 61.36 ? 83 PRO B CA 1 ATOM 3675 C C . PRO B 1 84 ? 36.203 89.353 33.495 1.00 63.39 ? 83 PRO B C 1 ATOM 3676 O O . PRO B 1 84 ? 36.291 88.619 32.506 1.00 62.09 ? 83 PRO B O 1 ATOM 3677 C CB . PRO B 1 84 ? 37.725 91.344 33.631 1.00 61.80 ? 83 PRO B CB 1 ATOM 3678 C CG . PRO B 1 84 ? 38.522 91.117 32.392 1.00 59.61 ? 83 PRO B CG 1 ATOM 3679 C CD . PRO B 1 84 ? 39.373 89.902 32.666 1.00 57.76 ? 83 PRO B CD 1 ATOM 3680 N N . GLY B 1 85 ? 35.047 89.670 34.059 1.00 65.37 ? 84 GLY B N 1 ATOM 3681 C CA . GLY B 1 85 ? 33.775 89.505 33.353 1.00 66.36 ? 84 GLY B CA 1 ATOM 3682 C C . GLY B 1 85 ? 33.170 88.112 33.337 1.00 66.88 ? 84 GLY B C 1 ATOM 3683 O O . GLY B 1 85 ? 32.307 87.826 32.488 1.00 67.77 ? 84 GLY B O 1 ATOM 3684 N N . PHE B 1 86 ? 33.598 87.241 34.256 1.00 66.38 ? 85 PHE B N 1 ATOM 3685 C CA . PHE B 1 86 ? 33.001 85.906 34.334 1.00 67.32 ? 85 PHE B CA 1 ATOM 3686 C C . PHE B 1 86 ? 31.529 86.035 34.728 1.00 69.99 ? 85 PHE B C 1 ATOM 3687 O O . PHE B 1 86 ? 31.193 86.700 35.698 1.00 69.93 ? 85 PHE B O 1 ATOM 3688 C CB . PHE B 1 86 ? 33.734 84.988 35.315 1.00 67.05 ? 85 PHE B CB 1 ATOM 3689 C CG . PHE B 1 86 ? 33.269 83.557 35.242 1.00 67.95 ? 85 PHE B CG 1 ATOM 3690 C CD1 . PHE B 1 86 ? 33.830 82.673 34.327 1.00 66.07 ? 85 PHE B CD1 1 ATOM 3691 C CD2 . PHE B 1 86 ? 32.229 83.107 36.048 1.00 69.93 ? 85 PHE B CD2 1 ATOM 3692 C CE1 . PHE B 1 86 ? 33.384 81.362 34.238 1.00 66.68 ? 85 PHE B CE1 1 ATOM 3693 C CE2 . PHE B 1 86 ? 31.778 81.800 35.960 1.00 70.54 ? 85 PHE B CE2 1 ATOM 3694 C CZ . PHE B 1 86 ? 32.358 80.924 35.056 1.00 68.94 ? 85 PHE B CZ 1 ATOM 3695 N N . GLY B 1 87 ? 30.648 85.410 33.958 1.00 72.36 ? 86 GLY B N 1 ATOM 3696 C CA . GLY B 1 87 ? 29.223 85.501 34.221 1.00 75.70 ? 86 GLY B CA 1 ATOM 3697 C C . GLY B 1 87 ? 28.594 86.670 33.499 1.00 77.50 ? 86 GLY B C 1 ATOM 3698 O O . GLY B 1 87 ? 27.368 86.773 33.469 1.00 79.68 ? 86 GLY B O 1 ATOM 3699 N N . LYS B 1 88 ? 29.400 87.548 32.889 1.00 77.59 ? 87 LYS B N 1 ATOM 3700 C CA . LYS B 1 88 ? 28.935 88.712 32.136 1.00 79.11 ? 87 LYS B CA 1 ATOM 3701 C C . LYS B 1 88 ? 29.308 88.503 30.662 1.00 77.32 ? 87 LYS B C 1 ATOM 3702 O O . LYS B 1 88 ? 29.820 87.438 30.309 1.00 76.09 ? 87 LYS B O 1 ATOM 3703 C CB . LYS B 1 88 ? 29.591 89.997 32.653 1.00 79.57 ? 87 LYS B CB 1 ATOM 3704 C CG . LYS B 1 88 ? 29.525 90.193 34.158 1.00 81.70 ? 87 LYS B CG 1 ATOM 3705 C CD . LYS B 1 88 ? 28.100 90.356 34.654 1.00 85.38 ? 87 LYS B CD 1 ATOM 3706 C CE . LYS B 1 88 ? 28.082 90.602 36.152 1.00 86.82 ? 87 LYS B CE 1 ATOM 3707 N NZ . LYS B 1 88 ? 26.720 90.432 36.722 1.00 90.67 ? 87 LYS B NZ 1 ATOM 3708 N N . THR B 1 89 ? 29.013 89.478 29.806 1.00 77.92 ? 88 THR B N 1 ATOM 3709 C CA . THR B 1 89 ? 29.315 89.322 28.385 1.00 77.65 ? 88 THR B CA 1 ATOM 3710 C C . THR B 1 89 ? 30.268 90.382 27.857 1.00 76.18 ? 88 THR B C 1 ATOM 3711 O O . THR B 1 89 ? 30.832 90.186 26.779 1.00 75.43 ? 88 THR B O 1 ATOM 3712 C CB . THR B 1 89 ? 28.042 89.321 27.518 1.00 80.06 ? 88 THR B CB 1 ATOM 3713 O OG1 . THR B 1 89 ? 27.304 90.524 27.744 1.00 83.13 ? 88 THR B OG1 1 ATOM 3714 C CG2 . THR B 1 89 ? 27.176 88.119 27.849 1.00 81.65 ? 88 THR B CG2 1 ATOM 3715 N N . PHE B 1 90 ? 30.486 91.464 28.592 1.00 76.10 ? 89 PHE B N 1 ATOM 3716 C CA . PHE B 1 90 ? 31.239 92.581 28.043 1.00 74.79 ? 89 PHE B CA 1 ATOM 3717 C C . PHE B 1 90 ? 32.651 92.191 27.572 1.00 72.36 ? 89 PHE B C 1 ATOM 3718 O O . PHE B 1 90 ? 33.153 92.695 26.552 1.00 71.94 ? 89 PHE B O 1 ATOM 3719 C CB . PHE B 1 90 ? 31.286 93.777 29.014 1.00 74.85 ? 89 PHE B CB 1 ATOM 3720 C CG . PHE B 1 90 ? 32.134 93.555 30.239 1.00 73.14 ? 89 PHE B CG 1 ATOM 3721 C CD1 . PHE B 1 90 ? 33.486 93.874 30.233 1.00 70.72 ? 89 PHE B CD1 1 ATOM 3722 C CD2 . PHE B 1 90 ? 31.575 93.053 31.410 1.00 73.68 ? 89 PHE B CD2 1 ATOM 3723 C CE1 . PHE B 1 90 ? 34.267 93.675 31.361 1.00 69.67 ? 89 PHE B CE1 1 ATOM 3724 C CE2 . PHE B 1 90 ? 32.352 92.852 32.541 1.00 72.56 ? 89 PHE B CE2 1 ATOM 3725 C CZ . PHE B 1 90 ? 33.698 93.163 32.517 1.00 70.42 ? 89 PHE B CZ 1 ATOM 3726 N N . SER B 1 91 ? 33.301 91.292 28.303 1.00 70.48 ? 90 SER B N 1 ATOM 3727 C CA . SER B 1 91 ? 34.722 91.007 28.054 1.00 68.27 ? 90 SER B CA 1 ATOM 3728 C C . SER B 1 91 ? 34.939 90.039 26.900 1.00 67.02 ? 90 SER B C 1 ATOM 3729 O O . SER B 1 91 ? 36.087 89.896 26.451 1.00 63.72 ? 90 SER B O 1 ATOM 3730 C CB . SER B 1 91 ? 35.374 90.419 29.316 1.00 67.26 ? 90 SER B CB 1 ATOM 3731 O OG . SER B 1 91 ? 34.892 89.114 29.614 1.00 67.81 ? 90 SER B OG 1 ATOM 3732 N N . LEU B 1 92 ? 33.888 89.366 26.447 1.00 68.87 ? 91 LEU B N 1 ATOM 3733 C CA . LEU B 1 92 ? 33.951 88.652 25.182 1.00 69.37 ? 91 LEU B CA 1 ATOM 3734 C C . LEU B 1 92 ? 33.246 89.344 24.012 1.00 69.35 ? 91 LEU B C 1 ATOM 3735 O O . LEU B 1 92 ? 33.470 88.996 22.860 1.00 68.76 ? 91 LEU B O 1 ATOM 3736 C CB . LEU B 1 92 ? 33.622 87.162 25.309 1.00 71.22 ? 91 LEU B CB 1 ATOM 3737 C CG . LEU B 1 92 ? 32.481 86.677 26.174 1.00 74.52 ? 91 LEU B CG 1 ATOM 3738 C CD1 . LEU B 1 92 ? 31.169 87.040 25.503 1.00 78.61 ? 91 LEU B CD1 1 ATOM 3739 C CD2 . LEU B 1 92 ? 32.604 85.173 26.359 1.00 74.66 ? 91 LEU B CD2 1 ATOM 3740 N N . GLU B 1 93 ? 32.407 90.325 24.282 1.00 71.46 ? 92 GLU B N 1 ATOM 3741 C CA . GLU B 1 93 ? 31.741 91.082 23.180 1.00 73.62 ? 92 GLU B CA 1 ATOM 3742 C C . GLU B 1 93 ? 32.784 91.945 22.473 1.00 73.03 ? 92 GLU B C 1 ATOM 3743 O O . GLU B 1 93 ? 32.825 92.022 21.259 1.00 70.20 ? 92 GLU B O 1 ATOM 3744 C CB . GLU B 1 93 ? 30.608 91.964 23.711 1.00 76.48 ? 92 GLU B CB 1 ATOM 3745 C CG . GLU B 1 93 ? 29.322 91.215 24.019 1.00 77.94 ? 92 GLU B CG 1 ATOM 3746 C CD . GLU B 1 93 ? 28.218 92.139 24.492 1.00 80.47 ? 92 GLU B CD 1 ATOM 3747 O OE1 . GLU B 1 93 ? 27.636 92.842 23.641 1.00 81.56 ? 92 GLU B OE1 1 ATOM 3748 O OE2 . GLU B 1 93 ? 27.932 92.161 25.709 1.00 79.68 ? 92 GLU B OE2 1 ATOM 3749 N N . PHE B 1 94 ? 33.604 92.611 23.276 1.00 73.90 ? 93 PHE B N 1 ATOM 3750 C CA . PHE B 1 94 ? 34.618 93.534 22.802 1.00 74.48 ? 93 PHE B CA 1 ATOM 3751 C C . PHE B 1 94 ? 35.936 93.208 23.500 1.00 72.63 ? 93 PHE B C 1 ATOM 3752 O O . PHE B 1 94 ? 36.009 93.168 24.749 1.00 73.14 ? 93 PHE B O 1 ATOM 3753 C CB . PHE B 1 94 ? 34.201 94.980 23.060 1.00 78.07 ? 93 PHE B CB 1 ATOM 3754 C CG . PHE B 1 94 ? 33.158 95.492 22.100 1.00 81.96 ? 93 PHE B CG 1 ATOM 3755 C CD1 . PHE B 1 94 ? 33.495 95.806 20.783 1.00 82.21 ? 93 PHE B CD1 1 ATOM 3756 C CD2 . PHE B 1 94 ? 31.841 95.680 22.513 1.00 85.96 ? 93 PHE B CD2 1 ATOM 3757 C CE1 . PHE B 1 94 ? 32.539 96.284 19.894 1.00 84.44 ? 93 PHE B CE1 1 ATOM 3758 C CE2 . PHE B 1 94 ? 30.881 96.162 21.630 1.00 88.03 ? 93 PHE B CE2 1 ATOM 3759 C CZ . PHE B 1 94 ? 31.231 96.462 20.318 1.00 87.33 ? 93 PHE B CZ 1 ATOM 3760 N N . LEU B 1 95 ? 36.966 92.927 22.708 1.00 70.70 ? 94 LEU B N 1 ATOM 3761 C CA . LEU B 1 95 ? 38.253 92.559 23.278 1.00 69.16 ? 94 LEU B CA 1 ATOM 3762 C C . LEU B 1 95 ? 38.988 93.792 23.810 1.00 70.72 ? 94 LEU B C 1 ATOM 3763 O O . LEU B 1 95 ? 39.737 93.743 24.791 1.00 66.86 ? 94 LEU B O 1 ATOM 3764 C CB . LEU B 1 95 ? 39.118 91.841 22.248 1.00 67.22 ? 94 LEU B CB 1 ATOM 3765 C CG . LEU B 1 95 ? 38.540 90.533 21.711 1.00 66.54 ? 94 LEU B CG 1 ATOM 3766 C CD1 . LEU B 1 95 ? 39.437 89.955 20.625 1.00 64.34 ? 94 LEU B CD1 1 ATOM 3767 C CD2 . LEU B 1 95 ? 38.346 89.539 22.846 1.00 66.18 ? 94 LEU B CD2 1 ATOM 3768 N N . ASP B 1 96 ? 38.764 94.909 23.120 1.00 75.58 ? 95 ASP B N 1 ATOM 3769 C CA . ASP B 1 96 ? 39.318 96.207 23.485 1.00 78.54 ? 95 ASP B CA 1 ATOM 3770 C C . ASP B 1 96 ? 38.230 96.999 24.194 1.00 81.32 ? 95 ASP B C 1 ATOM 3771 O O . ASP B 1 96 ? 37.193 97.292 23.593 1.00 83.71 ? 95 ASP B O 1 ATOM 3772 C CB . ASP B 1 96 ? 39.775 96.961 22.221 1.00 80.69 ? 95 ASP B CB 1 ATOM 3773 C CG . ASP B 1 96 ? 40.571 98.240 22.531 1.00 83.37 ? 95 ASP B CG 1 ATOM 3774 O OD1 . ASP B 1 96 ? 40.305 98.907 23.561 1.00 85.67 ? 95 ASP B OD1 1 ATOM 3775 O OD2 . ASP B 1 96 ? 41.468 98.590 21.725 1.00 83.24 ? 95 ASP B OD2 1 ATOM 3776 N N . PRO B 1 97 ? 38.463 97.380 25.462 1.00 82.98 ? 96 PRO B N 1 ATOM 3777 C CA . PRO B 1 97 ? 37.425 98.116 26.194 1.00 86.51 ? 96 PRO B CA 1 ATOM 3778 C C . PRO B 1 97 ? 37.097 99.506 25.624 1.00 89.89 ? 96 PRO B C 1 ATOM 3779 O O . PRO B 1 97 ? 36.083 100.077 25.994 1.00 90.70 ? 96 PRO B O 1 ATOM 3780 C CB . PRO B 1 97 ? 37.988 98.222 27.616 1.00 85.06 ? 96 PRO B CB 1 ATOM 3781 C CG . PRO B 1 97 ? 39.459 98.092 27.462 1.00 83.44 ? 96 PRO B CG 1 ATOM 3782 C CD . PRO B 1 97 ? 39.690 97.216 26.264 1.00 82.20 ? 96 PRO B CD 1 ATOM 3783 N N . SER B 1 98 ? 37.920 100.024 24.712 1.00 92.93 ? 97 SER B N 1 ATOM 3784 C CA . SER B 1 98 ? 37.528 101.193 23.914 1.00 96.89 ? 97 SER B CA 1 ATOM 3785 C C . SER B 1 98 ? 36.345 100.900 22.986 1.00 101.01 ? 97 SER B C 1 ATOM 3786 O O . SER B 1 98 ? 35.730 101.816 22.442 1.00 106.38 ? 97 SER B O 1 ATOM 3787 C CB . SER B 1 98 ? 38.709 101.734 23.099 1.00 96.49 ? 97 SER B CB 1 ATOM 3788 O OG . SER B 1 98 ? 38.932 100.956 21.933 1.00 95.94 ? 97 SER B OG 1 ATOM 3789 N N . LYS B 1 99 ? 36.044 99.615 22.787 1.00 101.26 ? 98 LYS B N 1 ATOM 3790 C CA . LYS B 1 99 ? 34.905 99.118 22.002 1.00 101.54 ? 98 LYS B CA 1 ATOM 3791 C C . LYS B 1 99 ? 35.111 99.353 20.517 1.00 101.64 ? 98 LYS B C 1 ATOM 3792 O O . LYS B 1 99 ? 34.155 99.429 19.748 1.00 101.50 ? 98 LYS B O 1 ATOM 3793 C CB . LYS B 1 99 ? 33.562 99.680 22.493 1.00 104.96 ? 98 LYS B CB 1 ATOM 3794 C CG . LYS B 1 99 ? 33.171 99.167 23.869 1.00 106.04 ? 98 LYS B CG 1 ATOM 3795 C CD . LYS B 1 99 ? 31.750 99.552 24.242 1.00 108.46 ? 98 LYS B CD 1 ATOM 3796 C CE . LYS B 1 99 ? 31.406 99.059 25.638 1.00 108.73 ? 98 LYS B CE 1 ATOM 3797 N NZ . LYS B 1 99 ? 30.067 99.530 26.080 1.00 112.33 ? 98 LYS B NZ 1 ATOM 3798 N N . SER B 1 100 ? 36.376 99.455 20.121 1.00 100.46 ? 99 SER B N 1 ATOM 3799 C CA . SER B 1 100 ? 36.724 99.567 18.704 1.00 103.69 ? 99 SER B CA 1 ATOM 3800 C C . SER B 1 100 ? 36.294 98.320 17.919 1.00 104.38 ? 99 SER B C 1 ATOM 3801 O O . SER B 1 100 ? 36.295 97.180 18.438 1.00 105.30 ? 99 SER B O 1 ATOM 3802 C CB . SER B 1 100 ? 38.230 99.816 18.524 1.00 104.82 ? 99 SER B CB 1 ATOM 3803 O OG . SER B 1 100 ? 39.009 98.678 18.872 1.00 107.51 ? 99 SER B OG 1 ATOM 3804 N N . SER B 1 101 ? 35.956 98.531 16.648 1.00 104.66 ? 100 SER B N 1 ATOM 3805 C CA . SER B 1 101 ? 35.479 97.443 15.780 1.00 103.28 ? 100 SER B CA 1 ATOM 3806 C C . SER B 1 101 ? 36.553 96.348 15.599 1.00 99.59 ? 100 SER B C 1 ATOM 3807 O O . SER B 1 101 ? 36.209 95.177 15.397 1.00 97.85 ? 100 SER B O 1 ATOM 3808 C CB . SER B 1 101 ? 35.019 97.982 14.424 1.00 103.72 ? 100 SER B CB 1 ATOM 3809 O OG . SER B 1 101 ? 36.074 98.650 13.762 1.00 102.69 ? 100 SER B OG 1 ATOM 3810 N N . VAL B 1 102 ? 37.820 96.724 15.708 1.00 96.31 ? 101 VAL B N 1 ATOM 3811 C CA . VAL B 1 102 ? 38.913 95.759 15.632 1.00 93.91 ? 101 VAL B CA 1 ATOM 3812 C C . VAL B 1 102 ? 38.787 94.641 16.671 1.00 88.05 ? 101 VAL B C 1 ATOM 3813 O O . VAL B 1 102 ? 39.151 93.494 16.395 1.00 81.25 ? 101 VAL B O 1 ATOM 3814 C CB . VAL B 1 102 ? 40.294 96.452 15.798 1.00 95.98 ? 101 VAL B CB 1 ATOM 3815 C CG1 . VAL B 1 102 ? 41.438 95.450 15.597 1.00 93.12 ? 101 VAL B CG1 1 ATOM 3816 C CG2 . VAL B 1 102 ? 40.427 97.637 14.839 1.00 97.51 ? 101 VAL B CG2 1 ATOM 3817 N N . GLY B 1 103 ? 38.195 94.939 17.824 1.00 85.04 ? 102 GLY B N 1 ATOM 3818 C CA . GLY B 1 103 ? 38.030 93.927 18.841 1.00 81.38 ? 102 GLY B CA 1 ATOM 3819 C C . GLY B 1 103 ? 36.622 93.367 18.968 1.00 78.54 ? 102 GLY B C 1 ATOM 3820 O O . GLY B 1 103 ? 36.331 92.662 19.941 1.00 74.52 ? 102 GLY B O 1 ATOM 3821 N N . SER B 1 104 ? 35.741 93.652 18.020 1.00 77.51 ? 103 SER B N 1 ATOM 3822 C CA . SER B 1 104 ? 34.381 93.155 18.117 1.00 75.75 ? 103 SER B CA 1 ATOM 3823 C C . SER B 1 104 ? 34.371 91.659 17.841 1.00 70.14 ? 103 SER B C 1 ATOM 3824 O O . SER B 1 104 ? 34.733 91.218 16.766 1.00 66.82 ? 103 SER B O 1 ATOM 3825 C CB . SER B 1 104 ? 33.450 93.873 17.137 1.00 77.60 ? 103 SER B CB 1 ATOM 3826 O OG . SER B 1 104 ? 32.106 93.457 17.331 1.00 79.11 ? 103 SER B OG 1 ATOM 3827 N N . TYR B 1 105 ? 33.923 90.873 18.808 1.00 67.24 ? 104 TYR B N 1 ATOM 3828 C CA . TYR B 1 105 ? 34.061 89.426 18.747 1.00 63.60 ? 104 TYR B CA 1 ATOM 3829 C C . TYR B 1 105 ? 32.675 88.776 18.926 1.00 64.28 ? 104 TYR B C 1 ATOM 3830 O O . TYR B 1 105 ? 32.053 88.418 17.948 1.00 63.82 ? 104 TYR B O 1 ATOM 3831 C CB . TYR B 1 105 ? 35.116 88.985 19.778 1.00 61.54 ? 104 TYR B CB 1 ATOM 3832 C CG . TYR B 1 105 ? 35.449 87.514 19.810 1.00 59.12 ? 104 TYR B CG 1 ATOM 3833 C CD1 . TYR B 1 105 ? 35.749 86.817 18.645 1.00 57.21 ? 104 TYR B CD1 1 ATOM 3834 C CD2 . TYR B 1 105 ? 35.499 86.825 21.017 1.00 58.45 ? 104 TYR B CD2 1 ATOM 3835 C CE1 . TYR B 1 105 ? 36.056 85.467 18.684 1.00 55.73 ? 104 TYR B CE1 1 ATOM 3836 C CE2 . TYR B 1 105 ? 35.807 85.478 21.064 1.00 57.11 ? 104 TYR B CE2 1 ATOM 3837 C CZ . TYR B 1 105 ? 36.083 84.805 19.900 1.00 55.03 ? 104 TYR B CZ 1 ATOM 3838 O OH . TYR B 1 105 ? 36.382 83.471 19.971 1.00 53.79 ? 104 TYR B OH 1 ATOM 3839 N N . PHE B 1 106 ? 32.178 88.650 20.151 1.00 65.21 ? 105 PHE B N 1 ATOM 3840 C CA . PHE B 1 106 ? 30.824 88.146 20.373 1.00 67.94 ? 105 PHE B CA 1 ATOM 3841 C C . PHE B 1 106 ? 29.725 89.217 20.295 1.00 70.18 ? 105 PHE B C 1 ATOM 3842 O O . PHE B 1 106 ? 28.534 88.903 20.458 1.00 70.85 ? 105 PHE B O 1 ATOM 3843 C CB . PHE B 1 106 ? 30.718 87.394 21.716 1.00 68.89 ? 105 PHE B CB 1 ATOM 3844 C CG . PHE B 1 106 ? 31.067 85.931 21.631 1.00 68.38 ? 105 PHE B CG 1 ATOM 3845 C CD1 . PHE B 1 106 ? 30.108 84.996 21.271 1.00 69.84 ? 105 PHE B CD1 1 ATOM 3846 C CD2 . PHE B 1 106 ? 32.346 85.490 21.927 1.00 67.90 ? 105 PHE B CD2 1 ATOM 3847 C CE1 . PHE B 1 106 ? 30.420 83.651 21.201 1.00 69.53 ? 105 PHE B CE1 1 ATOM 3848 C CE2 . PHE B 1 106 ? 32.667 84.148 21.855 1.00 67.40 ? 105 PHE B CE2 1 ATOM 3849 C CZ . PHE B 1 106 ? 31.701 83.225 21.496 1.00 68.32 ? 105 PHE B CZ 1 ATOM 3850 N N . HIS B 1 107 ? 30.107 90.477 20.053 1.00 70.86 ? 106 HIS B N 1 ATOM 3851 C CA . HIS B 1 107 ? 29.126 91.554 20.110 1.00 74.37 ? 106 HIS B CA 1 ATOM 3852 C C . HIS B 1 107 ? 27.902 91.390 19.209 1.00 75.94 ? 106 HIS B C 1 ATOM 3853 O O . HIS B 1 107 ? 26.779 91.583 19.650 1.00 78.13 ? 106 HIS B O 1 ATOM 3854 C CB . HIS B 1 107 ? 29.791 92.896 19.810 1.00 75.65 ? 106 HIS B CB 1 ATOM 3855 C CG . HIS B 1 107 ? 28.846 94.053 19.866 1.00 79.74 ? 106 HIS B CG 1 ATOM 3856 N ND1 . HIS B 1 107 ? 28.148 94.387 21.008 1.00 81.26 ? 106 HIS B ND1 1 ATOM 3857 C CD2 . HIS B 1 107 ? 28.469 94.943 18.917 1.00 81.49 ? 106 HIS B CD2 1 ATOM 3858 C CE1 . HIS B 1 107 ? 27.387 95.438 20.762 1.00 84.59 ? 106 HIS B CE1 1 ATOM 3859 N NE2 . HIS B 1 107 ? 27.563 95.794 19.501 1.00 84.96 ? 106 HIS B NE2 1 ATOM 3860 N N . THR B 1 108 ? 28.112 91.007 17.955 1.00 75.09 ? 107 THR B N 1 ATOM 3861 C CA . THR B 1 108 ? 26.993 90.892 17.025 1.00 76.40 ? 107 THR B CA 1 ATOM 3862 C C . THR B 1 108 ? 26.031 89.798 17.493 1.00 77.46 ? 107 THR B C 1 ATOM 3863 O O . THR B 1 108 ? 24.846 89.951 17.431 1.00 80.04 ? 107 THR B O 1 ATOM 3864 C CB . THR B 1 108 ? 27.465 90.582 15.592 1.00 75.45 ? 107 THR B CB 1 ATOM 3865 O OG1 . THR B 1 108 ? 28.518 91.479 15.233 1.00 74.71 ? 107 THR B OG1 1 ATOM 3866 C CG2 . THR B 1 108 ? 26.329 90.735 14.588 1.00 77.35 ? 107 THR B CG2 1 ATOM 3867 N N . MET B 1 109 ? 26.595 88.688 17.961 1.00 76.02 ? 108 MET B N 1 ATOM 3868 C CA . MET B 1 109 ? 25.777 87.568 18.440 1.00 78.07 ? 108 MET B CA 1 ATOM 3869 C C . MET B 1 109 ? 24.947 87.976 19.674 1.00 80.23 ? 108 MET B C 1 ATOM 3870 O O . MET B 1 109 ? 23.756 87.636 19.776 1.00 81.70 ? 108 MET B O 1 ATOM 3871 C CB . MET B 1 109 ? 26.634 86.343 18.759 1.00 77.16 ? 108 MET B CB 1 ATOM 3872 C CG . MET B 1 109 ? 25.816 85.126 19.175 1.00 79.49 ? 108 MET B CG 1 ATOM 3873 S SD . MET B 1 109 ? 26.804 83.665 19.531 1.00 79.04 ? 108 MET B SD 1 ATOM 3874 C CE . MET B 1 109 ? 27.264 83.165 17.876 1.00 77.88 ? 108 MET B CE 1 ATOM 3875 N N . VAL B 1 110 ? 25.588 88.669 20.618 1.00 79.96 ? 109 VAL B N 1 ATOM 3876 C CA . VAL B 1 110 ? 24.897 89.066 21.833 1.00 82.29 ? 109 VAL B CA 1 ATOM 3877 C C . VAL B 1 110 ? 23.803 90.109 21.503 1.00 85.41 ? 109 VAL B C 1 ATOM 3878 O O . VAL B 1 110 ? 22.706 90.043 22.075 1.00 88.43 ? 109 VAL B O 1 ATOM 3879 C CB . VAL B 1 110 ? 25.865 89.617 22.904 1.00 81.21 ? 109 VAL B CB 1 ATOM 3880 C CG1 . VAL B 1 110 ? 25.098 90.191 24.089 1.00 83.41 ? 109 VAL B CG1 1 ATOM 3881 C CG2 . VAL B 1 110 ? 26.803 88.517 23.383 1.00 79.34 ? 109 VAL B CG2 1 ATOM 3882 N N . GLU B 1 111 ? 24.080 91.047 20.604 1.00 86.17 ? 110 GLU B N 1 ATOM 3883 C CA . GLU B 1 111 ? 23.043 91.977 20.132 1.00 89.98 ? 110 GLU B CA 1 ATOM 3884 C C . GLU B 1 111 ? 21.821 91.238 19.593 1.00 91.23 ? 110 GLU B C 1 ATOM 3885 O O . GLU B 1 111 ? 20.692 91.614 19.912 1.00 92.72 ? 110 GLU B O 1 ATOM 3886 C CB . GLU B 1 111 ? 23.595 92.919 19.057 1.00 90.78 ? 110 GLU B CB 1 ATOM 3887 C CG . GLU B 1 111 ? 24.492 94.022 19.599 1.00 91.21 ? 110 GLU B CG 1 ATOM 3888 C CD . GLU B 1 111 ? 23.727 95.076 20.381 1.00 93.87 ? 110 GLU B CD 1 ATOM 3889 O OE1 . GLU B 1 111 ? 22.907 95.788 19.768 1.00 96.95 ? 110 GLU B OE1 1 ATOM 3890 O OE2 . GLU B 1 111 ? 23.947 95.193 21.607 1.00 93.62 ? 110 GLU B OE2 1 ATOM 3891 N N . SER B 1 112 ? 22.060 90.190 18.823 1.00 89.36 ? 111 SER B N 1 ATOM 3892 C CA . SER B 1 112 ? 20.931 89.354 18.334 1.00 90.43 ? 111 SER B CA 1 ATOM 3893 C C . SER B 1 112 ? 20.165 88.657 19.448 1.00 91.32 ? 111 SER B C 1 ATOM 3894 O O . SER B 1 112 ? 18.915 88.700 19.466 1.00 94.02 ? 111 SER B O 1 ATOM 3895 C CB . SER B 1 112 ? 21.426 88.335 17.315 1.00 88.33 ? 111 SER B CB 1 ATOM 3896 O OG . SER B 1 112 ? 21.919 88.999 16.170 1.00 87.17 ? 111 SER B OG 1 ATOM 3897 N N . LEU B 1 113 ? 20.907 88.063 20.365 1.00 89.83 ? 112 LEU B N 1 ATOM 3898 C CA . LEU B 1 113 ? 20.287 87.373 21.520 1.00 90.85 ? 112 LEU B CA 1 ATOM 3899 C C . LEU B 1 113 ? 19.399 88.326 22.330 1.00 93.41 ? 112 LEU B C 1 ATOM 3900 O O . LEU B 1 113 ? 18.265 88.003 22.673 1.00 95.67 ? 112 LEU B O 1 ATOM 3901 C CB . LEU B 1 113 ? 21.344 86.735 22.427 1.00 88.87 ? 112 LEU B CB 1 ATOM 3902 C CG . LEU B 1 113 ? 22.102 85.538 21.842 1.00 87.63 ? 112 LEU B CG 1 ATOM 3903 C CD1 . LEU B 1 113 ? 23.228 85.106 22.767 1.00 85.95 ? 112 LEU B CD1 1 ATOM 3904 C CD2 . LEU B 1 113 ? 21.171 84.366 21.568 1.00 89.53 ? 112 LEU B CD2 1 ATOM 3905 N N . VAL B 1 114 ? 19.923 89.515 22.604 1.00 92.44 ? 113 VAL B N 1 ATOM 3906 C CA . VAL B 1 114 ? 19.179 90.526 23.335 1.00 94.95 ? 113 VAL B CA 1 ATOM 3907 C C . VAL B 1 114 ? 17.927 90.952 22.565 1.00 98.41 ? 113 VAL B C 1 ATOM 3908 O O . VAL B 1 114 ? 16.844 91.116 23.133 1.00 101.50 ? 113 VAL B O 1 ATOM 3909 C CB . VAL B 1 114 ? 20.042 91.748 23.723 1.00 93.58 ? 113 VAL B CB 1 ATOM 3910 C CG1 . VAL B 1 114 ? 19.182 92.876 24.284 1.00 95.10 ? 113 VAL B CG1 1 ATOM 3911 C CG2 . VAL B 1 114 ? 21.094 91.330 24.742 1.00 91.67 ? 113 VAL B CG2 1 ATOM 3912 N N . GLY B 1 115 ? 18.041 91.124 21.250 1.00 98.55 ? 114 GLY B N 1 ATOM 3913 C CA . GLY B 1 115 ? 16.888 91.396 20.400 1.00 102.13 ? 114 GLY B CA 1 ATOM 3914 C C . GLY B 1 115 ? 15.837 90.298 20.450 1.00 104.82 ? 114 GLY B C 1 ATOM 3915 O O . GLY B 1 115 ? 14.649 90.589 20.278 1.00 107.59 ? 114 GLY B O 1 ATOM 3916 N N . TRP B 1 116 ? 16.247 89.052 20.721 1.00 103.56 ? 115 TRP B N 1 ATOM 3917 C CA . TRP B 1 116 ? 15.329 87.936 20.880 1.00 104.81 ? 115 TRP B CA 1 ATOM 3918 C C . TRP B 1 116 ? 14.772 87.785 22.305 1.00 105.70 ? 115 TRP B C 1 ATOM 3919 O O . TRP B 1 116 ? 13.979 86.885 22.571 1.00 107.45 ? 115 TRP B O 1 ATOM 3920 C CB . TRP B 1 116 ? 15.965 86.616 20.446 1.00 102.59 ? 115 TRP B CB 1 ATOM 3921 C CG . TRP B 1 116 ? 16.532 86.643 19.069 1.00 101.65 ? 115 TRP B CG 1 ATOM 3922 C CD1 . TRP B 1 116 ? 16.131 87.428 18.025 1.00 103.53 ? 115 TRP B CD1 1 ATOM 3923 C CD2 . TRP B 1 116 ? 17.596 85.830 18.576 1.00 98.28 ? 115 TRP B CD2 1 ATOM 3924 N NE1 . TRP B 1 116 ? 16.893 87.160 16.914 1.00 101.31 ? 115 TRP B NE1 1 ATOM 3925 C CE2 . TRP B 1 116 ? 17.798 86.180 17.226 1.00 98.35 ? 115 TRP B CE2 1 ATOM 3926 C CE3 . TRP B 1 116 ? 18.403 84.839 19.147 1.00 95.76 ? 115 TRP B CE3 1 ATOM 3927 C CZ2 . TRP B 1 116 ? 18.773 85.578 16.439 1.00 95.85 ? 115 TRP B CZ2 1 ATOM 3928 C CZ3 . TRP B 1 116 ? 19.371 84.241 18.364 1.00 93.38 ? 115 TRP B CZ3 1 ATOM 3929 C CH2 . TRP B 1 116 ? 19.549 84.613 17.025 1.00 93.27 ? 115 TRP B CH2 1 ATOM 3930 N N . GLY B 1 117 ? 15.201 88.659 23.214 1.00 104.16 ? 116 GLY B N 1 ATOM 3931 C CA . GLY B 1 117 ? 14.660 88.678 24.570 1.00 104.80 ? 116 GLY B CA 1 ATOM 3932 C C . GLY B 1 117 ? 15.598 88.260 25.688 1.00 101.62 ? 116 GLY B C 1 ATOM 3933 O O . GLY B 1 117 ? 15.158 88.185 26.849 1.00 102.44 ? 116 GLY B O 1 ATOM 3934 N N . TYR B 1 118 ? 16.874 88.008 25.374 1.00 97.17 ? 117 TYR B N 1 ATOM 3935 C CA . TYR B 1 118 ? 17.865 87.664 26.398 1.00 94.47 ? 117 TYR B CA 1 ATOM 3936 C C . TYR B 1 118 ? 18.332 88.926 27.115 1.00 94.92 ? 117 TYR B C 1 ATOM 3937 O O . TYR B 1 118 ? 18.160 90.046 26.605 1.00 95.49 ? 117 TYR B O 1 ATOM 3938 C CB . TYR B 1 118 ? 19.047 86.898 25.804 1.00 90.25 ? 117 TYR B CB 1 ATOM 3939 C CG . TYR B 1 118 ? 18.745 85.453 25.483 1.00 89.71 ? 117 TYR B CG 1 ATOM 3940 C CD1 . TYR B 1 118 ? 18.127 85.099 24.291 1.00 90.85 ? 117 TYR B CD1 1 ATOM 3941 C CD2 . TYR B 1 118 ? 19.082 84.437 26.370 1.00 88.74 ? 117 TYR B CD2 1 ATOM 3942 C CE1 . TYR B 1 118 ? 17.850 83.774 23.991 1.00 90.96 ? 117 TYR B CE1 1 ATOM 3943 C CE2 . TYR B 1 118 ? 18.809 83.110 26.081 1.00 89.06 ? 117 TYR B CE2 1 ATOM 3944 C CZ . TYR B 1 118 ? 18.194 82.783 24.887 1.00 90.11 ? 117 TYR B CZ 1 ATOM 3945 O OH . TYR B 1 118 ? 17.920 81.466 24.587 1.00 90.81 ? 117 TYR B OH 1 ATOM 3946 N N . THR B 1 119 ? 18.908 88.721 28.292 1.00 94.82 ? 118 THR B N 1 ATOM 3947 C CA . THR B 1 119 ? 19.409 89.791 29.152 1.00 95.18 ? 118 THR B CA 1 ATOM 3948 C C . THR B 1 119 ? 20.846 89.488 29.578 1.00 92.21 ? 118 THR B C 1 ATOM 3949 O O . THR B 1 119 ? 21.110 88.446 30.173 1.00 91.04 ? 118 THR B O 1 ATOM 3950 C CB . THR B 1 119 ? 18.520 89.953 30.394 1.00 98.53 ? 118 THR B CB 1 ATOM 3951 O OG1 . THR B 1 119 ? 17.161 90.153 29.985 1.00 100.99 ? 118 THR B OG1 1 ATOM 3952 C CG2 . THR B 1 119 ? 18.985 91.132 31.247 1.00 99.15 ? 118 THR B CG2 1 ATOM 3953 N N . ARG B 1 120 ? 21.755 90.410 29.260 1.00 91.17 ? 119 ARG B N 1 ATOM 3954 C CA . ARG B 1 120 ? 23.171 90.294 29.592 1.00 88.18 ? 119 ARG B CA 1 ATOM 3955 C C . ARG B 1 120 ? 23.360 90.014 31.056 1.00 89.05 ? 119 ARG B C 1 ATOM 3956 O O . ARG B 1 120 ? 22.854 90.765 31.895 1.00 91.22 ? 119 ARG B O 1 ATOM 3957 C CB . ARG B 1 120 ? 23.940 91.569 29.219 1.00 86.84 ? 119 ARG B CB 1 ATOM 3958 C CG . ARG B 1 120 ? 24.109 91.822 27.726 1.00 85.46 ? 119 ARG B CG 1 ATOM 3959 C CD . ARG B 1 120 ? 24.809 93.152 27.478 1.00 84.91 ? 119 ARG B CD 1 ATOM 3960 N NE . ARG B 1 120 ? 25.275 93.281 26.095 1.00 83.86 ? 119 ARG B NE 1 ATOM 3961 C CZ . ARG B 1 120 ? 24.527 93.684 25.067 1.00 84.79 ? 119 ARG B CZ 1 ATOM 3962 N NH1 . ARG B 1 120 ? 23.255 94.019 25.238 1.00 87.75 ? 119 ARG B NH1 1 ATOM 3963 N NH2 . ARG B 1 120 ? 25.058 93.753 23.850 1.00 82.63 ? 119 ARG B NH2 1 ATOM 3964 N N . GLY B 1 121 ? 24.102 88.955 31.370 1.00 87.05 ? 120 GLY B N 1 ATOM 3965 C CA . GLY B 1 121 ? 24.453 88.700 32.764 1.00 87.88 ? 120 GLY B CA 1 ATOM 3966 C C . GLY B 1 121 ? 23.384 87.938 33.526 1.00 90.34 ? 120 GLY B C 1 ATOM 3967 O O . GLY B 1 121 ? 23.585 87.598 34.681 1.00 90.93 ? 120 GLY B O 1 ATOM 3968 N N . GLU B 1 122 ? 22.245 87.688 32.868 1.00 92.01 ? 121 GLU B N 1 ATOM 3969 C CA . GLU B 1 122 ? 21.176 86.889 33.442 1.00 93.95 ? 121 GLU B CA 1 ATOM 3970 C C . GLU B 1 122 ? 21.067 85.580 32.677 1.00 92.18 ? 121 GLU B C 1 ATOM 3971 O O . GLU B 1 122 ? 21.784 84.619 32.987 1.00 90.65 ? 121 GLU B O 1 ATOM 3972 C CB . GLU B 1 122 ? 19.869 87.675 33.467 1.00 97.82 ? 121 GLU B CB 1 ATOM 3973 C CG . GLU B 1 122 ? 19.927 88.890 34.380 1.00 99.13 ? 121 GLU B CG 1 ATOM 3974 C CD . GLU B 1 122 ? 18.592 89.604 34.509 1.00 102.86 ? 121 GLU B CD 1 ATOM 3975 O OE1 . GLU B 1 122 ? 17.563 89.055 34.067 1.00 104.13 ? 121 GLU B OE1 1 ATOM 3976 O OE2 . GLU B 1 122 ? 18.574 90.721 35.063 1.00 104.02 ? 121 GLU B OE2 1 ATOM 3977 N N . ASP B 1 123 ? 20.239 85.534 31.636 1.00 92.70 ? 122 ASP B N 1 ATOM 3978 C CA . ASP B 1 123 ? 20.024 84.265 30.909 1.00 92.17 ? 122 ASP B CA 1 ATOM 3979 C C . ASP B 1 123 ? 20.968 84.082 29.703 1.00 88.27 ? 122 ASP B C 1 ATOM 3980 O O . ASP B 1 123 ? 20.904 83.069 29.007 1.00 86.81 ? 122 ASP B O 1 ATOM 3981 C CB . ASP B 1 123 ? 18.541 84.048 30.538 1.00 95.29 ? 122 ASP B CB 1 ATOM 3982 C CG . ASP B 1 123 ? 17.949 85.186 29.725 1.00 96.81 ? 122 ASP B CG 1 ATOM 3983 O OD1 . ASP B 1 123 ? 18.631 86.213 29.521 1.00 97.11 ? 122 ASP B OD1 1 ATOM 3984 O OD2 . ASP B 1 123 ? 16.785 85.048 29.292 1.00 98.75 ? 122 ASP B OD2 1 ATOM 3985 N N . VAL B 1 124 ? 21.810 85.086 29.437 1.00 86.23 ? 123 VAL B N 1 ATOM 3986 C CA . VAL B 1 124 ? 22.981 84.903 28.593 1.00 82.75 ? 123 VAL B CA 1 ATOM 3987 C C . VAL B 1 124 ? 24.212 85.356 29.373 1.00 80.09 ? 123 VAL B C 1 ATOM 3988 O O . VAL B 1 124 ? 24.270 86.477 29.868 1.00 81.35 ? 123 VAL B O 1 ATOM 3989 C CB . VAL B 1 124 ? 22.878 85.626 27.219 1.00 82.43 ? 123 VAL B CB 1 ATOM 3990 C CG1 . VAL B 1 124 ? 22.713 87.134 27.367 1.00 83.79 ? 123 VAL B CG1 1 ATOM 3991 C CG2 . VAL B 1 124 ? 24.092 85.309 26.359 1.00 79.20 ? 123 VAL B CG2 1 ATOM 3992 N N . ARG B 1 125 ? 25.154 84.440 29.541 1.00 77.70 ? 124 ARG B N 1 ATOM 3993 C CA . ARG B 1 125 ? 26.385 84.743 30.275 1.00 75.60 ? 124 ARG B CA 1 ATOM 3994 C C . ARG B 1 125 ? 27.620 84.252 29.557 1.00 73.46 ? 124 ARG B C 1 ATOM 3995 O O . ARG B 1 125 ? 27.571 83.233 28.846 1.00 73.44 ? 124 ARG B O 1 ATOM 3996 C CB . ARG B 1 125 ? 26.333 84.120 31.664 1.00 76.40 ? 124 ARG B CB 1 ATOM 3997 C CG . ARG B 1 125 ? 25.142 84.577 32.485 1.00 79.08 ? 124 ARG B CG 1 ATOM 3998 C CD . ARG B 1 125 ? 25.281 84.173 33.940 1.00 79.48 ? 124 ARG B CD 1 ATOM 3999 N NE . ARG B 1 125 ? 24.005 84.272 34.643 1.00 82.88 ? 124 ARG B NE 1 ATOM 4000 C CZ . ARG B 1 125 ? 23.845 84.081 35.949 1.00 83.37 ? 124 ARG B CZ 1 ATOM 4001 N NH1 . ARG B 1 125 ? 24.879 83.782 36.730 1.00 81.58 ? 124 ARG B NH1 1 ATOM 4002 N NH2 . ARG B 1 125 ? 22.636 84.191 36.476 1.00 86.96 ? 124 ARG B NH2 1 ATOM 4003 N N . GLY B 1 126 ? 28.717 84.974 29.740 1.00 72.29 ? 125 GLY B N 1 ATOM 4004 C CA . GLY B 1 126 ? 30.002 84.521 29.218 1.00 69.18 ? 125 GLY B CA 1 ATOM 4005 C C . GLY B 1 126 ? 30.779 83.686 30.220 1.00 68.05 ? 125 GLY B C 1 ATOM 4006 O O . GLY B 1 126 ? 30.674 83.873 31.441 1.00 68.17 ? 125 GLY B O 1 ATOM 4007 N N . ALA B 1 127 ? 31.593 82.780 29.680 1.00 66.74 ? 126 ALA B N 1 ATOM 4008 C CA . ALA B 1 127 ? 32.519 81.978 30.465 1.00 65.28 ? 126 ALA B CA 1 ATOM 4009 C C . ALA B 1 127 ? 33.948 82.216 29.942 1.00 62.30 ? 126 ALA B C 1 ATOM 4010 O O . ALA B 1 127 ? 34.580 81.302 29.413 1.00 60.88 ? 126 ALA B O 1 ATOM 4011 C CB . ALA B 1 127 ? 32.146 80.507 30.381 1.00 66.16 ? 126 ALA B CB 1 ATOM 4012 N N . PRO B 1 128 ? 34.467 83.447 30.107 1.00 60.84 ? 127 PRO B N 1 ATOM 4013 C CA . PRO B 1 128 ? 35.857 83.737 29.747 1.00 57.91 ? 127 PRO B CA 1 ATOM 4014 C C . PRO B 1 128 ? 36.867 82.999 30.638 1.00 56.03 ? 127 PRO B C 1 ATOM 4015 O O . PRO B 1 128 ? 36.563 82.638 31.791 1.00 57.00 ? 127 PRO B O 1 ATOM 4016 C CB . PRO B 1 128 ? 35.956 85.244 29.976 1.00 58.33 ? 127 PRO B CB 1 ATOM 4017 C CG . PRO B 1 128 ? 35.007 85.487 31.097 1.00 60.69 ? 127 PRO B CG 1 ATOM 4018 C CD . PRO B 1 128 ? 33.837 84.607 30.763 1.00 62.43 ? 127 PRO B CD 1 ATOM 4019 N N . TYR B 1 129 ? 38.076 82.815 30.116 1.00 51.72 ? 128 TYR B N 1 ATOM 4020 C CA . TYR B 1 129 ? 39.120 82.104 30.827 1.00 50.59 ? 128 TYR B CA 1 ATOM 4021 C C . TYR B 1 129 ? 40.474 82.602 30.374 1.00 49.52 ? 128 TYR B C 1 ATOM 4022 O O . TYR B 1 129 ? 40.588 83.350 29.398 1.00 48.54 ? 128 TYR B O 1 ATOM 4023 C CB . TYR B 1 129 ? 39.002 80.589 30.583 1.00 50.31 ? 128 TYR B CB 1 ATOM 4024 C CG . TYR B 1 129 ? 38.997 80.182 29.124 1.00 49.90 ? 128 TYR B CG 1 ATOM 4025 C CD1 . TYR B 1 129 ? 37.836 80.264 28.359 1.00 50.77 ? 128 TYR B CD1 1 ATOM 4026 C CD2 . TYR B 1 129 ? 40.159 79.722 28.504 1.00 48.12 ? 128 TYR B CD2 1 ATOM 4027 C CE1 . TYR B 1 129 ? 37.830 79.903 27.017 1.00 50.20 ? 128 TYR B CE1 1 ATOM 4028 C CE2 . TYR B 1 129 ? 40.161 79.354 27.172 1.00 47.11 ? 128 TYR B CE2 1 ATOM 4029 C CZ . TYR B 1 129 ? 38.996 79.445 26.429 1.00 48.26 ? 128 TYR B CZ 1 ATOM 4030 O OH . TYR B 1 129 ? 38.992 79.086 25.103 1.00 45.97 ? 128 TYR B OH 1 ATOM 4031 N N . ASP B 1 130 ? 41.516 82.176 31.082 1.00 49.59 ? 129 ASP B N 1 ATOM 4032 C CA . ASP B 1 130 ? 42.883 82.496 30.699 1.00 48.17 ? 129 ASP B CA 1 ATOM 4033 C C . ASP B 1 130 ? 43.279 81.574 29.557 1.00 46.19 ? 129 ASP B C 1 ATOM 4034 O O . ASP B 1 130 ? 43.739 80.450 29.774 1.00 45.74 ? 129 ASP B O 1 ATOM 4035 C CB . ASP B 1 130 ? 43.828 82.342 31.904 1.00 47.73 ? 129 ASP B CB 1 ATOM 4036 C CG . ASP B 1 130 ? 45.237 82.839 31.616 1.00 48.22 ? 129 ASP B CG 1 ATOM 4037 O OD1 . ASP B 1 130 ? 45.575 83.067 30.428 1.00 48.60 ? 129 ASP B OD1 1 ATOM 4038 O OD2 . ASP B 1 130 ? 46.019 83.019 32.574 1.00 48.51 ? 129 ASP B OD2 1 ATOM 4039 N N . TRP B 1 131 ? 43.093 82.077 28.345 1.00 45.44 ? 130 TRP B N 1 ATOM 4040 C CA . TRP B 1 131 ? 43.256 81.293 27.124 1.00 44.38 ? 130 TRP B CA 1 ATOM 4041 C C . TRP B 1 131 ? 44.720 80.991 26.766 1.00 43.24 ? 130 TRP B C 1 ATOM 4042 O O . TRP B 1 131 ? 44.994 80.282 25.801 1.00 42.78 ? 130 TRP B O 1 ATOM 4043 C CB . TRP B 1 131 ? 42.563 81.984 25.937 1.00 44.21 ? 130 TRP B CB 1 ATOM 4044 C CG . TRP B 1 131 ? 42.622 83.478 25.984 1.00 44.77 ? 130 TRP B CG 1 ATOM 4045 C CD1 . TRP B 1 131 ? 41.618 84.326 26.357 1.00 46.16 ? 130 TRP B CD1 1 ATOM 4046 C CD2 . TRP B 1 131 ? 43.749 84.304 25.681 1.00 45.18 ? 130 TRP B CD2 1 ATOM 4047 N NE1 . TRP B 1 131 ? 42.050 85.625 26.300 1.00 46.12 ? 130 TRP B NE1 1 ATOM 4048 C CE2 . TRP B 1 131 ? 43.352 85.640 25.877 1.00 45.49 ? 130 TRP B CE2 1 ATOM 4049 C CE3 . TRP B 1 131 ? 45.052 84.046 25.240 1.00 44.58 ? 130 TRP B CE3 1 ATOM 4050 C CZ2 . TRP B 1 131 ? 44.208 86.711 25.650 1.00 45.90 ? 130 TRP B CZ2 1 ATOM 4051 C CZ3 . TRP B 1 131 ? 45.902 85.115 25.019 1.00 43.93 ? 130 TRP B CZ3 1 ATOM 4052 C CH2 . TRP B 1 131 ? 45.479 86.429 25.231 1.00 44.90 ? 130 TRP B CH2 1 ATOM 4053 N N . ARG B 1 132 ? 45.667 81.526 27.537 1.00 43.71 ? 131 ARG B N 1 ATOM 4054 C CA . ARG B 1 132 ? 47.080 81.175 27.388 1.00 42.78 ? 131 ARG B CA 1 ATOM 4055 C C . ARG B 1 132 ? 47.346 79.766 27.898 1.00 43.59 ? 131 ARG B C 1 ATOM 4056 O O . ARG B 1 132 ? 48.331 79.136 27.513 1.00 42.61 ? 131 ARG B O 1 ATOM 4057 C CB . ARG B 1 132 ? 47.947 82.169 28.155 1.00 42.60 ? 131 ARG B CB 1 ATOM 4058 C CG . ARG B 1 132 ? 47.783 83.611 27.704 1.00 43.16 ? 131 ARG B CG 1 ATOM 4059 C CD . ARG B 1 132 ? 48.546 84.564 28.605 1.00 43.69 ? 131 ARG B CD 1 ATOM 4060 N NE . ARG B 1 132 ? 48.121 84.426 29.992 1.00 45.38 ? 131 ARG B NE 1 ATOM 4061 C CZ . ARG B 1 132 ? 48.737 84.970 31.042 1.00 45.19 ? 131 ARG B CZ 1 ATOM 4062 N NH1 . ARG B 1 132 ? 49.831 85.711 30.892 1.00 44.10 ? 131 ARG B NH1 1 ATOM 4063 N NH2 . ARG B 1 132 ? 48.248 84.759 32.257 1.00 46.00 ? 131 ARG B NH2 1 ATOM 4064 N N . ARG B 1 133 ? 46.496 79.291 28.807 1.00 46.73 ? 132 ARG B N 1 ATOM 4065 C CA . ARG B 1 133 ? 46.637 77.974 29.388 1.00 48.45 ? 132 ARG B CA 1 ATOM 4066 C C . ARG B 1 133 ? 45.702 76.968 28.749 1.00 49.02 ? 132 ARG B C 1 ATOM 4067 O O . ARG B 1 133 ? 44.705 77.326 28.143 1.00 48.36 ? 132 ARG B O 1 ATOM 4068 C CB . ARG B 1 133 ? 46.442 78.028 30.895 1.00 50.62 ? 132 ARG B CB 1 ATOM 4069 C CG . ARG B 1 133 ? 47.685 78.559 31.574 1.00 50.97 ? 132 ARG B CG 1 ATOM 4070 C CD . ARG B 1 133 ? 47.383 79.095 32.946 1.00 53.55 ? 132 ARG B CD 1 ATOM 4071 N NE . ARG B 1 133 ? 48.588 79.116 33.765 1.00 54.93 ? 132 ARG B NE 1 ATOM 4072 C CZ . ARG B 1 133 ? 48.636 79.579 35.010 1.00 54.87 ? 132 ARG B CZ 1 ATOM 4073 N NH1 . ARG B 1 133 ? 47.543 80.077 35.581 1.00 54.76 ? 132 ARG B NH1 1 ATOM 4074 N NH2 . ARG B 1 133 ? 49.790 79.555 35.674 1.00 55.21 ? 132 ARG B NH2 1 ATOM 4075 N N . ALA B 1 134 ? 46.078 75.703 28.881 1.00 49.59 ? 133 ALA B N 1 ATOM 4076 C CA . ALA B 1 134 ? 45.256 74.591 28.476 1.00 49.49 ? 133 ALA B CA 1 ATOM 4077 C C . ALA B 1 134 ? 44.426 74.150 29.683 1.00 51.66 ? 133 ALA B C 1 ATOM 4078 O O . ALA B 1 134 ? 44.651 74.615 30.803 1.00 52.05 ? 133 ALA B O 1 ATOM 4079 C CB . ALA B 1 134 ? 46.146 73.467 27.988 1.00 49.42 ? 133 ALA B CB 1 ATOM 4080 N N . PRO B 1 135 ? 43.475 73.234 29.476 1.00 53.50 ? 134 PRO B N 1 ATOM 4081 C CA . PRO B 1 135 ? 42.568 72.886 30.574 1.00 54.92 ? 134 PRO B CA 1 ATOM 4082 C C . PRO B 1 135 ? 43.200 72.325 31.842 1.00 55.29 ? 134 PRO B C 1 ATOM 4083 O O . PRO B 1 135 ? 42.628 72.487 32.920 1.00 57.67 ? 134 PRO B O 1 ATOM 4084 C CB . PRO B 1 135 ? 41.655 71.834 29.943 1.00 56.62 ? 134 PRO B CB 1 ATOM 4085 C CG . PRO B 1 135 ? 41.595 72.243 28.511 1.00 56.49 ? 134 PRO B CG 1 ATOM 4086 C CD . PRO B 1 135 ? 42.997 72.684 28.191 1.00 54.10 ? 134 PRO B CD 1 ATOM 4087 N N . ASN B 1 136 ? 44.377 71.717 31.729 1.00 53.73 ? 135 ASN B N 1 ATOM 4088 C CA . ASN B 1 136 ? 45.077 71.174 32.890 1.00 55.36 ? 135 ASN B CA 1 ATOM 4089 C C . ASN B 1 136 ? 45.437 72.222 33.934 1.00 54.17 ? 135 ASN B C 1 ATOM 4090 O O . ASN B 1 136 ? 45.627 71.875 35.096 1.00 57.30 ? 135 ASN B O 1 ATOM 4091 C CB . ASN B 1 136 ? 46.345 70.414 32.475 1.00 55.08 ? 135 ASN B CB 1 ATOM 4092 C CG . ASN B 1 136 ? 47.320 71.274 31.709 1.00 55.45 ? 135 ASN B CG 1 ATOM 4093 O OD1 . ASN B 1 136 ? 46.920 72.079 30.864 1.00 57.01 ? 135 ASN B OD1 1 ATOM 4094 N ND2 . ASN B 1 136 ? 48.606 71.098 31.976 1.00 55.52 ? 135 ASN B ND2 1 ATOM 4095 N N . GLU B 1 137 ? 45.539 73.483 33.532 1.00 53.15 ? 136 GLU B N 1 ATOM 4096 C CA . GLU B 1 137 ? 45.831 74.559 34.461 1.00 54.34 ? 136 GLU B CA 1 ATOM 4097 C C . GLU B 1 137 ? 44.674 75.538 34.636 1.00 53.81 ? 136 GLU B C 1 ATOM 4098 O O . GLU B 1 137 ? 44.889 76.676 35.047 1.00 52.70 ? 136 GLU B O 1 ATOM 4099 C CB . GLU B 1 137 ? 47.133 75.261 34.057 1.00 54.00 ? 136 GLU B CB 1 ATOM 4100 C CG . GLU B 1 137 ? 48.317 74.297 33.972 1.00 54.57 ? 136 GLU B CG 1 ATOM 4101 C CD . GLU B 1 137 ? 49.654 75.005 33.811 1.00 55.86 ? 136 GLU B CD 1 ATOM 4102 O OE1 . GLU B 1 137 ? 50.328 75.229 34.848 1.00 56.34 ? 136 GLU B OE1 1 ATOM 4103 O OE2 . GLU B 1 137 ? 50.033 75.344 32.654 1.00 54.87 ? 136 GLU B OE2 1 ATOM 4104 N N . ASN B 1 138 ? 43.457 75.079 34.358 1.00 55.18 ? 137 ASN B N 1 ATOM 4105 C CA . ASN B 1 138 ? 42.289 75.920 34.538 1.00 55.74 ? 137 ASN B CA 1 ATOM 4106 C C . ASN B 1 138 ? 41.183 75.201 35.299 1.00 58.24 ? 137 ASN B C 1 ATOM 4107 O O . ASN B 1 138 ? 39.977 75.353 35.011 1.00 60.40 ? 137 ASN B O 1 ATOM 4108 C CB . ASN B 1 138 ? 41.786 76.472 33.191 1.00 55.32 ? 137 ASN B CB 1 ATOM 4109 C CG . ASN B 1 138 ? 42.391 77.826 32.847 1.00 55.02 ? 137 ASN B CG 1 ATOM 4110 O OD1 . ASN B 1 138 ? 42.541 78.699 33.713 1.00 55.39 ? 137 ASN B OD1 1 ATOM 4111 N ND2 . ASN B 1 138 ? 42.718 78.022 31.574 1.00 54.19 ? 137 ASN B ND2 1 ATOM 4112 N N . GLY B 1 139 ? 41.591 74.399 36.283 1.00 58.69 ? 138 GLY B N 1 ATOM 4113 C CA . GLY B 1 139 ? 40.644 73.642 37.122 1.00 60.06 ? 138 GLY B CA 1 ATOM 4114 C C . GLY B 1 139 ? 39.547 74.511 37.737 1.00 60.87 ? 138 GLY B C 1 ATOM 4115 O O . GLY B 1 139 ? 38.352 74.185 37.639 1.00 62.73 ? 138 GLY B O 1 ATOM 4116 N N . PRO B 1 140 ? 39.935 75.621 38.380 1.00 59.90 ? 139 PRO B N 1 ATOM 4117 C CA . PRO B 1 140 ? 38.923 76.515 38.966 1.00 61.86 ? 139 PRO B CA 1 ATOM 4118 C C . PRO B 1 140 ? 37.875 77.047 37.977 1.00 61.48 ? 139 PRO B C 1 ATOM 4119 O O . PRO B 1 140 ? 36.712 77.164 38.312 1.00 64.26 ? 139 PRO B O 1 ATOM 4120 C CB . PRO B 1 140 ? 39.763 77.664 39.539 1.00 60.82 ? 139 PRO B CB 1 ATOM 4121 C CG . PRO B 1 140 ? 41.086 77.040 39.826 1.00 60.21 ? 139 PRO B CG 1 ATOM 4122 C CD . PRO B 1 140 ? 41.302 76.059 38.704 1.00 59.27 ? 139 PRO B CD 1 ATOM 4123 N N . TYR B 1 141 ? 38.299 77.355 36.768 1.00 60.25 ? 140 TYR B N 1 ATOM 4124 C CA . TYR B 1 141 ? 37.363 77.728 35.685 1.00 60.72 ? 140 TYR B CA 1 ATOM 4125 C C . TYR B 1 141 ? 36.270 76.696 35.481 1.00 62.90 ? 140 TYR B C 1 ATOM 4126 O O . TYR B 1 141 ? 35.078 77.058 35.399 1.00 63.53 ? 140 TYR B O 1 ATOM 4127 C CB . TYR B 1 141 ? 38.110 77.957 34.363 1.00 56.60 ? 140 TYR B CB 1 ATOM 4128 C CG . TYR B 1 141 ? 37.206 78.118 33.158 1.00 55.85 ? 140 TYR B CG 1 ATOM 4129 C CD1 . TYR B 1 141 ? 36.541 79.315 32.915 1.00 56.56 ? 140 TYR B CD1 1 ATOM 4130 C CD2 . TYR B 1 141 ? 37.024 77.076 32.256 1.00 55.47 ? 140 TYR B CD2 1 ATOM 4131 C CE1 . TYR B 1 141 ? 35.718 79.471 31.808 1.00 56.28 ? 140 TYR B CE1 1 ATOM 4132 C CE2 . TYR B 1 141 ? 36.200 77.219 31.149 1.00 55.22 ? 140 TYR B CE2 1 ATOM 4133 C CZ . TYR B 1 141 ? 35.552 78.418 30.924 1.00 55.79 ? 140 TYR B CZ 1 ATOM 4134 O OH . TYR B 1 141 ? 34.732 78.565 29.821 1.00 56.29 ? 140 TYR B OH 1 ATOM 4135 N N . PHE B 1 142 ? 36.649 75.420 35.411 1.00 63.65 ? 141 PHE B N 1 ATOM 4136 C CA . PHE B 1 142 ? 35.640 74.377 35.173 1.00 66.86 ? 141 PHE B CA 1 ATOM 4137 C C . PHE B 1 142 ? 34.678 74.199 36.347 1.00 71.35 ? 141 PHE B C 1 ATOM 4138 O O . PHE B 1 142 ? 33.493 73.909 36.145 1.00 74.91 ? 141 PHE B O 1 ATOM 4139 C CB . PHE B 1 142 ? 36.311 73.052 34.797 1.00 65.72 ? 141 PHE B CB 1 ATOM 4140 C CG . PHE B 1 142 ? 37.091 73.138 33.525 1.00 62.90 ? 141 PHE B CG 1 ATOM 4141 C CD1 . PHE B 1 142 ? 36.433 73.270 32.313 1.00 62.85 ? 141 PHE B CD1 1 ATOM 4142 C CD2 . PHE B 1 142 ? 38.477 73.146 33.538 1.00 60.77 ? 141 PHE B CD2 1 ATOM 4143 C CE1 . PHE B 1 142 ? 37.141 73.381 31.131 1.00 60.36 ? 141 PHE B CE1 1 ATOM 4144 C CE2 . PHE B 1 142 ? 39.192 73.256 32.358 1.00 59.09 ? 141 PHE B CE2 1 ATOM 4145 C CZ . PHE B 1 142 ? 38.522 73.372 31.152 1.00 58.62 ? 141 PHE B CZ 1 ATOM 4146 N N . LEU B 1 143 ? 35.183 74.357 37.569 1.00 73.62 ? 142 LEU B N 1 ATOM 4147 C CA . LEU B 1 143 ? 34.320 74.371 38.740 1.00 76.51 ? 142 LEU B CA 1 ATOM 4148 C C . LEU B 1 143 ? 33.289 75.522 38.670 1.00 76.18 ? 142 LEU B C 1 ATOM 4149 O O . LEU B 1 143 ? 32.102 75.320 38.908 1.00 77.43 ? 142 LEU B O 1 ATOM 4150 C CB . LEU B 1 143 ? 35.136 74.487 40.029 1.00 80.63 ? 142 LEU B CB 1 ATOM 4151 C CG . LEU B 1 143 ? 35.986 73.271 40.416 1.00 83.68 ? 142 LEU B CG 1 ATOM 4152 C CD1 . LEU B 1 143 ? 37.011 73.647 41.481 1.00 85.11 ? 142 LEU B CD1 1 ATOM 4153 C CD2 . LEU B 1 143 ? 35.113 72.116 40.898 1.00 87.16 ? 142 LEU B CD2 1 ATOM 4154 N N . ALA B 1 144 ? 33.771 76.716 38.343 1.00 74.13 ? 143 ALA B N 1 ATOM 4155 C CA . ALA B 1 144 ? 32.925 77.890 38.232 1.00 73.92 ? 143 ALA B CA 1 ATOM 4156 C C . ALA B 1 144 ? 31.900 77.738 37.102 1.00 72.96 ? 143 ALA B C 1 ATOM 4157 O O . ALA B 1 144 ? 30.748 78.150 37.242 1.00 74.44 ? 143 ALA B O 1 ATOM 4158 C CB . ALA B 1 144 ? 33.762 79.146 38.040 1.00 72.22 ? 143 ALA B CB 1 ATOM 4159 N N . LEU B 1 145 ? 32.323 77.141 35.990 1.00 70.98 ? 144 LEU B N 1 ATOM 4160 C CA . LEU B 1 145 ? 31.419 76.897 34.877 1.00 71.83 ? 144 LEU B CA 1 ATOM 4161 C C . LEU B 1 145 ? 30.298 75.942 35.258 1.00 74.85 ? 144 LEU B C 1 ATOM 4162 O O . LEU B 1 145 ? 29.117 76.188 34.976 1.00 75.06 ? 144 LEU B O 1 ATOM 4163 C CB . LEU B 1 145 ? 32.204 76.330 33.699 1.00 69.50 ? 144 LEU B CB 1 ATOM 4164 C CG . LEU B 1 145 ? 31.407 75.980 32.444 1.00 70.74 ? 144 LEU B CG 1 ATOM 4165 C CD1 . LEU B 1 145 ? 30.734 77.218 31.866 1.00 71.11 ? 144 LEU B CD1 1 ATOM 4166 C CD2 . LEU B 1 145 ? 32.319 75.324 31.416 1.00 68.89 ? 144 LEU B CD2 1 ATOM 4167 N N . ARG B 1 146 ? 30.651 74.854 35.929 1.00 76.22 ? 145 ARG B N 1 ATOM 4168 C CA . ARG B 1 146 ? 29.649 73.918 36.416 1.00 80.14 ? 145 ARG B CA 1 ATOM 4169 C C . ARG B 1 146 ? 28.645 74.604 37.352 1.00 81.11 ? 145 ARG B C 1 ATOM 4170 O O . ARG B 1 146 ? 27.442 74.425 37.211 1.00 81.84 ? 145 ARG B O 1 ATOM 4171 C CB . ARG B 1 146 ? 30.334 72.751 37.147 1.00 82.23 ? 145 ARG B CB 1 ATOM 4172 C CG . ARG B 1 146 ? 29.388 71.723 37.767 1.00 86.92 ? 145 ARG B CG 1 ATOM 4173 C CD . ARG B 1 146 ? 30.091 70.466 38.250 1.00 88.78 ? 145 ARG B CD 1 ATOM 4174 N NE . ARG B 1 146 ? 30.905 70.744 39.417 1.00 91.16 ? 145 ARG B NE 1 ATOM 4175 C CZ . ARG B 1 146 ? 30.427 70.876 40.651 1.00 96.56 ? 145 ARG B CZ 1 ATOM 4176 N NH1 . ARG B 1 146 ? 29.123 70.755 40.899 1.00 100.13 ? 145 ARG B NH1 1 ATOM 4177 N NH2 . ARG B 1 146 ? 31.261 71.138 41.647 1.00 98.74 ? 145 ARG B NH2 1 ATOM 4178 N N . GLU B 1 147 ? 29.148 75.375 38.305 1.00 80.88 ? 146 GLU B N 1 ATOM 4179 C CA . GLU B 1 147 ? 28.281 76.085 39.218 1.00 83.07 ? 146 GLU B CA 1 ATOM 4180 C C . GLU B 1 147 ? 27.367 77.091 38.519 1.00 82.21 ? 146 GLU B C 1 ATOM 4181 O O . GLU B 1 147 ? 26.203 77.228 38.886 1.00 84.60 ? 146 GLU B O 1 ATOM 4182 C CB . GLU B 1 147 ? 29.096 76.849 40.267 1.00 84.13 ? 146 GLU B CB 1 ATOM 4183 C CG . GLU B 1 147 ? 29.774 75.986 41.316 1.00 86.33 ? 146 GLU B CG 1 ATOM 4184 C CD . GLU B 1 147 ? 30.682 76.801 42.218 1.00 87.01 ? 146 GLU B CD 1 ATOM 4185 O OE1 . GLU B 1 147 ? 31.911 76.862 41.978 1.00 84.16 ? 146 GLU B OE1 1 ATOM 4186 O OE2 . GLU B 1 147 ? 30.152 77.402 43.163 1.00 92.23 ? 146 GLU B OE2 1 ATOM 4187 N N . MET B 1 148 ? 27.908 77.811 37.538 1.00 78.92 ? 147 MET B N 1 ATOM 4188 C CA . MET B 1 148 ? 27.132 78.829 36.822 1.00 78.87 ? 147 MET B CA 1 ATOM 4189 C C . MET B 1 148 ? 26.014 78.161 36.022 1.00 80.07 ? 147 MET B C 1 ATOM 4190 O O . MET B 1 148 ? 24.889 78.639 36.017 1.00 81.90 ? 147 MET B O 1 ATOM 4191 C CB . MET B 1 148 ? 28.023 79.645 35.896 1.00 76.26 ? 147 MET B CB 1 ATOM 4192 C CG . MET B 1 148 ? 27.273 80.721 35.133 1.00 77.14 ? 147 MET B CG 1 ATOM 4193 S SD . MET B 1 148 ? 28.383 81.843 34.274 1.00 76.22 ? 147 MET B SD 1 ATOM 4194 C CE . MET B 1 148 ? 29.015 80.791 32.971 1.00 73.12 ? 147 MET B CE 1 ATOM 4195 N N . ILE B 1 149 ? 26.324 77.040 35.381 1.00 79.12 ? 148 ILE B N 1 ATOM 4196 C CA . ILE B 1 149 ? 25.328 76.275 34.661 1.00 80.08 ? 148 ILE B CA 1 ATOM 4197 C C . ILE B 1 149 ? 24.194 75.815 35.583 1.00 84.08 ? 148 ILE B C 1 ATOM 4198 O O . ILE B 1 149 ? 23.026 75.958 35.243 1.00 86.73 ? 148 ILE B O 1 ATOM 4199 C CB . ILE B 1 149 ? 25.965 75.097 33.888 1.00 78.02 ? 148 ILE B CB 1 ATOM 4200 C CG1 . ILE B 1 149 ? 26.776 75.645 32.707 1.00 74.60 ? 148 ILE B CG1 1 ATOM 4201 C CG2 . ILE B 1 149 ? 24.906 74.127 33.381 1.00 79.84 ? 148 ILE B CG2 1 ATOM 4202 C CD1 . ILE B 1 149 ? 27.683 74.635 32.040 1.00 72.61 ? 148 ILE B CD1 1 ATOM 4203 N N . GLU B 1 150 ? 24.550 75.267 36.742 1.00 85.42 ? 149 GLU B N 1 ATOM 4204 C CA . GLU B 1 150 ? 23.540 74.826 37.715 1.00 88.76 ? 149 GLU B CA 1 ATOM 4205 C C . GLU B 1 150 ? 22.638 75.997 38.173 1.00 91.26 ? 149 GLU B C 1 ATOM 4206 O O . GLU B 1 150 ? 21.403 75.863 38.254 1.00 94.57 ? 149 GLU B O 1 ATOM 4207 C CB . GLU B 1 150 ? 24.216 74.141 38.911 1.00 88.80 ? 149 GLU B CB 1 ATOM 4208 C CG . GLU B 1 150 ? 24.856 72.799 38.554 1.00 88.09 ? 149 GLU B CG 1 ATOM 4209 C CD . GLU B 1 150 ? 25.662 72.168 39.685 1.00 88.41 ? 149 GLU B CD 1 ATOM 4210 O OE1 . GLU B 1 150 ? 25.731 72.751 40.790 1.00 89.87 ? 149 GLU B OE1 1 ATOM 4211 O OE2 . GLU B 1 150 ? 26.230 71.072 39.464 1.00 87.14 ? 149 GLU B OE2 1 ATOM 4212 N N . GLU B 1 151 ? 23.266 77.138 38.441 1.00 90.75 ? 150 GLU B N 1 ATOM 4213 C CA . GLU B 1 151 ? 22.532 78.343 38.852 1.00 92.80 ? 150 GLU B CA 1 ATOM 4214 C C . GLU B 1 151 ? 21.556 78.801 37.763 1.00 92.51 ? 150 GLU B C 1 ATOM 4215 O O . GLU B 1 151 ? 20.403 79.155 38.039 1.00 94.93 ? 150 GLU B O 1 ATOM 4216 C CB . GLU B 1 151 ? 23.520 79.469 39.179 1.00 92.97 ? 150 GLU B CB 1 ATOM 4217 C CG . GLU B 1 151 ? 22.897 80.841 39.415 1.00 97.04 ? 150 GLU B CG 1 ATOM 4218 C CD . GLU B 1 151 ? 23.938 81.941 39.539 1.00 97.14 ? 150 GLU B CD 1 ATOM 4219 O OE1 . GLU B 1 151 ? 25.127 81.614 39.760 1.00 95.68 ? 150 GLU B OE1 1 ATOM 4220 O OE2 . GLU B 1 151 ? 23.571 83.135 39.387 1.00 99.18 ? 150 GLU B OE2 1 ATOM 4221 N N . MET B 1 152 ? 22.045 78.824 36.528 1.00 89.07 ? 151 MET B N 1 ATOM 4222 C CA . MET B 1 152 ? 21.230 79.289 35.421 1.00 89.25 ? 151 MET B CA 1 ATOM 4223 C C . MET B 1 152 ? 20.027 78.363 35.202 1.00 91.44 ? 151 MET B C 1 ATOM 4224 O O . MET B 1 152 ? 18.922 78.802 34.922 1.00 92.61 ? 151 MET B O 1 ATOM 4225 C CB . MET B 1 152 ? 22.063 79.416 34.146 1.00 86.36 ? 151 MET B CB 1 ATOM 4226 C CG . MET B 1 152 ? 23.076 80.545 34.226 1.00 84.40 ? 151 MET B CG 1 ATOM 4227 S SD . MET B 1 152 ? 24.189 80.578 32.813 1.00 80.67 ? 151 MET B SD 1 ATOM 4228 C CE . MET B 1 152 ? 23.215 81.541 31.654 1.00 81.96 ? 151 MET B CE 1 ATOM 4229 N N . TYR B 1 153 ? 20.256 77.072 35.338 1.00 90.86 ? 152 TYR B N 1 ATOM 4230 C CA . TYR B 1 153 ? 19.203 76.041 35.249 1.00 93.00 ? 152 TYR B CA 1 ATOM 4231 C C . TYR B 1 153 ? 18.105 76.332 36.237 1.00 97.39 ? 152 TYR B C 1 ATOM 4232 O O . TYR B 1 153 ? 16.890 76.305 35.918 1.00 100.54 ? 152 TYR B O 1 ATOM 4233 C CB . TYR B 1 153 ? 19.787 74.646 35.541 1.00 91.58 ? 152 TYR B CB 1 ATOM 4234 C CG . TYR B 1 153 ? 18.774 73.535 35.770 1.00 93.62 ? 152 TYR B CG 1 ATOM 4235 C CD1 . TYR B 1 153 ? 18.197 73.331 37.026 1.00 96.75 ? 152 TYR B CD1 1 ATOM 4236 C CD2 . TYR B 1 153 ? 18.417 72.668 34.739 1.00 93.69 ? 152 TYR B CD2 1 ATOM 4237 C CE1 . TYR B 1 153 ? 17.277 72.313 37.241 1.00 99.25 ? 152 TYR B CE1 1 ATOM 4238 C CE2 . TYR B 1 153 ? 17.503 71.643 34.946 1.00 96.67 ? 152 TYR B CE2 1 ATOM 4239 C CZ . TYR B 1 153 ? 16.934 71.471 36.197 1.00 99.51 ? 152 TYR B CZ 1 ATOM 4240 O OH . TYR B 1 153 ? 16.027 70.458 36.403 1.00 101.58 ? 152 TYR B OH 1 ATOM 4241 N N . GLN B 1 154 ? 18.516 76.581 37.488 1.00 98.58 ? 153 GLN B N 1 ATOM 4242 C CA . GLN B 1 154 ? 17.563 76.852 38.565 1.00 102.76 ? 153 GLN B CA 1 ATOM 4243 C C . GLN B 1 154 ? 16.818 78.183 38.392 1.00 103.76 ? 153 GLN B C 1 ATOM 4244 O O . GLN B 1 154 ? 15.616 78.243 38.638 1.00 106.45 ? 153 GLN B O 1 ATOM 4245 C CB . GLN B 1 154 ? 18.267 76.849 39.935 1.00 102.97 ? 153 GLN B CB 1 ATOM 4246 C CG . GLN B 1 154 ? 18.705 75.469 40.411 1.00 103.23 ? 153 GLN B CG 1 ATOM 4247 C CD . GLN B 1 154 ? 17.547 74.591 40.907 1.00 107.29 ? 153 GLN B CD 1 ATOM 4248 O OE1 . GLN B 1 154 ? 17.314 73.516 40.361 1.00 107.33 ? 153 GLN B OE1 1 ATOM 4249 N NE2 . GLN B 1 154 ? 16.828 75.036 41.952 1.00 110.56 ? 153 GLN B NE2 1 ATOM 4250 N N . LEU B 1 155 ? 17.551 79.222 38.018 1.00 101.61 ? 154 LEU B N 1 ATOM 4251 C CA . LEU B 1 155 ? 16.960 80.551 37.888 1.00 103.61 ? 154 LEU B CA 1 ATOM 4252 C C . LEU B 1 155 ? 16.014 80.654 36.705 1.00 105.86 ? 154 LEU B C 1 ATOM 4253 O O . LEU B 1 155 ? 14.934 81.221 36.821 1.00 107.86 ? 154 LEU B O 1 ATOM 4254 C CB . LEU B 1 155 ? 18.030 81.645 37.793 1.00 101.47 ? 154 LEU B CB 1 ATOM 4255 C CG . LEU B 1 155 ? 18.594 82.217 39.107 1.00 101.41 ? 154 LEU B CG 1 ATOM 4256 C CD1 . LEU B 1 155 ? 18.739 81.192 40.231 1.00 102.03 ? 154 LEU B CD1 1 ATOM 4257 C CD2 . LEU B 1 155 ? 19.923 82.910 38.822 1.00 98.24 ? 154 LEU B CD2 1 ATOM 4258 N N . TYR B 1 156 ? 16.421 80.113 35.566 1.00 105.75 ? 155 TYR B N 1 ATOM 4259 C CA . TYR B 1 156 ? 15.683 80.350 34.321 1.00 107.67 ? 155 TYR B CA 1 ATOM 4260 C C . TYR B 1 156 ? 14.843 79.142 33.912 1.00 110.02 ? 155 TYR B C 1 ATOM 4261 O O . TYR B 1 156 ? 14.172 79.215 32.894 1.00 112.42 ? 155 TYR B O 1 ATOM 4262 C CB . TYR B 1 156 ? 16.653 80.843 33.240 1.00 104.14 ? 155 TYR B CB 1 ATOM 4263 C CG . TYR B 1 156 ? 17.501 81.964 33.804 1.00 102.92 ? 155 TYR B CG 1 ATOM 4264 C CD1 . TYR B 1 156 ? 16.903 83.128 34.283 1.00 105.18 ? 155 TYR B CD1 1 ATOM 4265 C CD2 . TYR B 1 156 ? 18.885 81.840 33.931 1.00 100.04 ? 155 TYR B CD2 1 ATOM 4266 C CE1 . TYR B 1 156 ? 17.655 84.146 34.837 1.00 104.20 ? 155 TYR B CE1 1 ATOM 4267 C CE2 . TYR B 1 156 ? 19.646 82.860 34.484 1.00 98.69 ? 155 TYR B CE2 1 ATOM 4268 C CZ . TYR B 1 156 ? 19.022 84.007 34.933 1.00 100.90 ? 155 TYR B CZ 1 ATOM 4269 O OH . TYR B 1 156 ? 19.753 85.021 35.489 1.00 100.50 ? 155 TYR B OH 1 ATOM 4270 N N . GLY B 1 157 ? 14.846 78.081 34.722 1.00 110.02 ? 156 GLY B N 1 ATOM 4271 C CA . GLY B 1 157 ? 13.844 77.025 34.596 1.00 111.85 ? 156 GLY B CA 1 ATOM 4272 C C . GLY B 1 157 ? 14.049 75.978 33.507 1.00 110.32 ? 156 GLY B C 1 ATOM 4273 O O . GLY B 1 157 ? 13.110 75.295 33.119 1.00 112.46 ? 156 GLY B O 1 ATOM 4274 N N . GLY B 1 158 ? 15.263 75.843 32.982 1.00 105.98 ? 157 GLY B N 1 ATOM 4275 C CA . GLY B 1 158 ? 15.589 74.691 32.125 1.00 104.69 ? 157 GLY B CA 1 ATOM 4276 C C . GLY B 1 158 ? 17.068 74.518 31.851 1.00 100.63 ? 157 GLY B C 1 ATOM 4277 O O . GLY B 1 158 ? 17.881 75.386 32.196 1.00 98.74 ? 157 GLY B O 1 ATOM 4278 N N . PRO B 1 159 ? 17.428 73.424 31.150 1.00 98.73 ? 158 PRO B N 1 ATOM 4279 C CA . PRO B 1 159 ? 18.810 73.149 30.785 1.00 95.24 ? 158 PRO B CA 1 ATOM 4280 C C . PRO B 1 159 ? 19.397 74.197 29.834 1.00 92.67 ? 158 PRO B C 1 ATOM 4281 O O . PRO B 1 159 ? 18.653 74.869 29.104 1.00 94.22 ? 158 PRO B O 1 ATOM 4282 C CB . PRO B 1 159 ? 18.730 71.775 30.102 1.00 95.66 ? 158 PRO B CB 1 ATOM 4283 C CG . PRO B 1 159 ? 17.325 71.658 29.627 1.00 98.36 ? 158 PRO B CG 1 ATOM 4284 C CD . PRO B 1 159 ? 16.506 72.391 30.643 1.00 101.07 ? 158 PRO B CD 1 ATOM 4285 N N . VAL B 1 160 ? 20.728 74.300 29.847 1.00 88.72 ? 159 VAL B N 1 ATOM 4286 C CA . VAL B 1 160 ? 21.449 75.396 29.200 1.00 86.29 ? 159 VAL B CA 1 ATOM 4287 C C . VAL B 1 160 ? 22.000 74.974 27.830 1.00 83.45 ? 159 VAL B C 1 ATOM 4288 O O . VAL B 1 160 ? 22.334 73.806 27.593 1.00 83.07 ? 159 VAL B O 1 ATOM 4289 C CB . VAL B 1 160 ? 22.581 76.016 30.063 1.00 84.52 ? 159 VAL B CB 1 ATOM 4290 C CG1 . VAL B 1 160 ? 22.189 76.056 31.534 1.00 86.23 ? 159 VAL B CG1 1 ATOM 4291 C CG2 . VAL B 1 160 ? 23.901 75.280 29.867 1.00 82.47 ? 159 VAL B CG2 1 ATOM 4292 N N . VAL B 1 161 ? 22.067 75.954 26.929 1.00 81.73 ? 160 VAL B N 1 ATOM 4293 C CA . VAL B 1 161 ? 22.712 75.760 25.637 1.00 79.69 ? 160 VAL B CA 1 ATOM 4294 C C . VAL B 1 161 ? 24.096 76.382 25.698 1.00 76.59 ? 160 VAL B C 1 ATOM 4295 O O . VAL B 1 161 ? 24.221 77.566 26.028 1.00 76.59 ? 160 VAL B O 1 ATOM 4296 C CB . VAL B 1 161 ? 21.906 76.385 24.482 1.00 80.69 ? 160 VAL B CB 1 ATOM 4297 C CG1 . VAL B 1 161 ? 22.713 76.371 23.192 1.00 78.47 ? 160 VAL B CG1 1 ATOM 4298 C CG2 . VAL B 1 161 ? 20.598 75.633 24.290 1.00 83.84 ? 160 VAL B CG2 1 ATOM 4299 N N . LEU B 1 162 ? 25.116 75.564 25.436 1.00 74.76 ? 161 LEU B N 1 ATOM 4300 C CA . LEU B 1 162 ? 26.501 76.041 25.359 1.00 71.47 ? 161 LEU B CA 1 ATOM 4301 C C . LEU B 1 162 ? 26.797 76.432 23.926 1.00 69.83 ? 161 LEU B C 1 ATOM 4302 O O . LEU B 1 162 ? 26.534 75.653 23.015 1.00 71.37 ? 161 LEU B O 1 ATOM 4303 C CB . LEU B 1 162 ? 27.469 74.940 25.784 1.00 70.49 ? 161 LEU B CB 1 ATOM 4304 C CG . LEU B 1 162 ? 27.331 74.430 27.219 1.00 72.15 ? 161 LEU B CG 1 ATOM 4305 C CD1 . LEU B 1 162 ? 28.182 73.186 27.426 1.00 71.24 ? 161 LEU B CD1 1 ATOM 4306 C CD2 . LEU B 1 162 ? 27.716 75.518 28.210 1.00 72.27 ? 161 LEU B CD2 1 ATOM 4307 N N . VAL B 1 163 ? 27.350 77.623 23.721 1.00 67.78 ? 162 VAL B N 1 ATOM 4308 C CA . VAL B 1 163 ? 27.770 78.062 22.398 1.00 66.64 ? 162 VAL B CA 1 ATOM 4309 C C . VAL B 1 163 ? 29.247 78.394 22.486 1.00 63.83 ? 162 VAL B C 1 ATOM 4310 O O . VAL B 1 163 ? 29.626 79.280 23.247 1.00 65.09 ? 162 VAL B O 1 ATOM 4311 C CB . VAL B 1 163 ? 26.998 79.320 21.950 1.00 67.85 ? 162 VAL B CB 1 ATOM 4312 C CG1 . VAL B 1 163 ? 27.416 79.735 20.545 1.00 66.91 ? 162 VAL B CG1 1 ATOM 4313 C CG2 . VAL B 1 163 ? 25.498 79.073 22.016 1.00 70.57 ? 162 VAL B CG2 1 ATOM 4314 N N . ALA B 1 164 ? 30.080 77.681 21.730 1.00 61.31 ? 163 ALA B N 1 ATOM 4315 C CA . ALA B 1 164 ? 31.533 77.841 21.821 1.00 58.87 ? 163 ALA B CA 1 ATOM 4316 C C . ALA B 1 164 ? 32.143 78.118 20.457 1.00 58.42 ? 163 ALA B C 1 ATOM 4317 O O . ALA B 1 164 ? 31.651 77.633 19.446 1.00 58.36 ? 163 ALA B O 1 ATOM 4318 C CB . ALA B 1 164 ? 32.164 76.598 22.430 1.00 57.88 ? 163 ALA B CB 1 ATOM 4319 N N . HIS B 1 165 ? 33.205 78.908 20.445 1.00 57.94 ? 164 HIS B N 1 ATOM 4320 C CA . HIS B 1 165 ? 33.888 79.264 19.225 1.00 57.44 ? 164 HIS B CA 1 ATOM 4321 C C . HIS B 1 165 ? 35.330 78.842 19.297 1.00 54.75 ? 164 HIS B C 1 ATOM 4322 O O . HIS B 1 165 ? 36.008 79.016 20.320 1.00 54.51 ? 164 HIS B O 1 ATOM 4323 C CB . HIS B 1 165 ? 33.831 80.763 18.968 1.00 58.24 ? 164 HIS B CB 1 ATOM 4324 C CG . HIS B 1 165 ? 34.509 81.167 17.700 1.00 57.91 ? 164 HIS B CG 1 ATOM 4325 N ND1 . HIS B 1 165 ? 35.645 81.945 17.678 1.00 57.06 ? 164 HIS B ND1 1 ATOM 4326 C CD2 . HIS B 1 165 ? 34.231 80.866 16.408 1.00 58.62 ? 164 HIS B CD2 1 ATOM 4327 C CE1 . HIS B 1 165 ? 36.026 82.125 16.426 1.00 56.85 ? 164 HIS B CE1 1 ATOM 4328 N NE2 . HIS B 1 165 ? 35.185 81.482 15.636 1.00 57.81 ? 164 HIS B NE2 1 ATOM 4329 N N . SER B 1 166 ? 35.803 78.256 18.208 1.00 53.43 ? 165 SER B N 1 ATOM 4330 C CA . SER B 1 166 ? 37.218 77.966 18.015 1.00 52.18 ? 165 SER B CA 1 ATOM 4331 C C . SER B 1 166 ? 37.735 77.089 19.175 1.00 51.81 ? 165 SER B C 1 ATOM 4332 O O . SER B 1 166 ? 37.109 76.085 19.513 1.00 52.62 ? 165 SER B O 1 ATOM 4333 C CB . SER B 1 166 ? 37.992 79.299 17.894 1.00 50.42 ? 165 SER B CB 1 ATOM 4334 O OG . SER B 1 166 ? 39.333 79.114 17.474 1.00 47.40 ? 165 SER B OG 1 ATOM 4335 N N . MET B 1 167 ? 38.857 77.458 19.794 1.00 50.26 ? 166 MET B N 1 ATOM 4336 C CA . MET B 1 167 ? 39.417 76.690 20.905 1.00 50.16 ? 166 MET B CA 1 ATOM 4337 C C . MET B 1 167 ? 38.427 76.487 22.056 1.00 51.66 ? 166 MET B C 1 ATOM 4338 O O . MET B 1 167 ? 38.554 75.545 22.848 1.00 53.05 ? 166 MET B O 1 ATOM 4339 C CB . MET B 1 167 ? 40.672 77.375 21.444 1.00 49.21 ? 166 MET B CB 1 ATOM 4340 C CG . MET B 1 167 ? 41.420 76.573 22.490 1.00 48.54 ? 166 MET B CG 1 ATOM 4341 S SD . MET B 1 167 ? 42.930 77.386 23.012 1.00 47.63 ? 166 MET B SD 1 ATOM 4342 C CE . MET B 1 167 ? 42.310 78.626 24.144 1.00 48.53 ? 166 MET B CE 1 ATOM 4343 N N . GLY B 1 168 ? 37.454 77.380 22.194 1.00 52.41 ? 167 GLY B N 1 ATOM 4344 C CA . GLY B 1 168 ? 36.437 77.219 23.238 1.00 53.49 ? 167 GLY B CA 1 ATOM 4345 C C . GLY B 1 168 ? 35.718 75.890 23.113 1.00 55.11 ? 167 GLY B C 1 ATOM 4346 O O . GLY B 1 168 ? 35.194 75.353 24.090 1.00 56.51 ? 167 GLY B O 1 ATOM 4347 N N . ASN B 1 169 ? 35.666 75.349 21.905 1.00 53.77 ? 168 ASN B N 1 ATOM 4348 C CA . ASN B 1 169 ? 35.044 74.041 21.705 1.00 56.34 ? 168 ASN B CA 1 ATOM 4349 C C . ASN B 1 169 ? 35.810 72.905 22.376 1.00 55.84 ? 168 ASN B C 1 ATOM 4350 O O . ASN B 1 169 ? 35.213 71.955 22.884 1.00 55.08 ? 168 ASN B O 1 ATOM 4351 C CB . ASN B 1 169 ? 34.884 73.751 20.213 1.00 57.62 ? 168 ASN B CB 1 ATOM 4352 C CG . ASN B 1 169 ? 33.845 74.638 19.569 1.00 58.93 ? 168 ASN B CG 1 ATOM 4353 O OD1 . ASN B 1 169 ? 32.653 74.455 19.788 1.00 60.57 ? 168 ASN B OD1 1 ATOM 4354 N ND2 . ASN B 1 169 ? 34.290 75.615 18.788 1.00 58.64 ? 168 ASN B ND2 1 ATOM 4355 N N . MET B 1 170 ? 37.138 73.008 22.371 1.00 54.05 ? 169 MET B N 1 ATOM 4356 C CA . MET B 1 170 ? 37.982 72.012 22.981 1.00 55.29 ? 169 MET B CA 1 ATOM 4357 C C . MET B 1 170 ? 37.924 72.124 24.512 1.00 54.86 ? 169 MET B C 1 ATOM 4358 O O . MET B 1 170 ? 37.899 71.111 25.212 1.00 54.62 ? 169 MET B O 1 ATOM 4359 C CB . MET B 1 170 ? 39.429 72.151 22.499 1.00 56.44 ? 169 MET B CB 1 ATOM 4360 C CG . MET B 1 170 ? 39.656 71.715 21.056 1.00 58.42 ? 169 MET B CG 1 ATOM 4361 S SD . MET B 1 170 ? 39.478 69.926 20.868 1.00 63.74 ? 169 MET B SD 1 ATOM 4362 C CE . MET B 1 170 ? 41.103 69.357 21.370 1.00 63.20 ? 169 MET B CE 1 ATOM 4363 N N . TYR B 1 171 ? 37.881 73.354 25.028 1.00 53.70 ? 170 TYR B N 1 ATOM 4364 C CA . TYR B 1 171 ? 37.582 73.585 26.459 1.00 54.18 ? 170 TYR B CA 1 ATOM 4365 C C . TYR B 1 171 ? 36.240 72.962 26.861 1.00 56.62 ? 170 TYR B C 1 ATOM 4366 O O . TYR B 1 171 ? 36.144 72.290 27.881 1.00 57.14 ? 170 TYR B O 1 ATOM 4367 C CB . TYR B 1 171 ? 37.610 75.082 26.794 1.00 52.76 ? 170 TYR B CB 1 ATOM 4368 C CG . TYR B 1 171 ? 38.912 75.509 27.427 1.00 50.46 ? 170 TYR B CG 1 ATOM 4369 C CD1 . TYR B 1 171 ? 40.089 75.584 26.677 1.00 48.56 ? 170 TYR B CD1 1 ATOM 4370 C CD2 . TYR B 1 171 ? 38.976 75.817 28.782 1.00 49.86 ? 170 TYR B CD2 1 ATOM 4371 C CE1 . TYR B 1 171 ? 41.288 75.968 27.266 1.00 47.32 ? 170 TYR B CE1 1 ATOM 4372 C CE2 . TYR B 1 171 ? 40.164 76.193 29.377 1.00 48.30 ? 170 TYR B CE2 1 ATOM 4373 C CZ . TYR B 1 171 ? 41.313 76.267 28.625 1.00 46.98 ? 170 TYR B CZ 1 ATOM 4374 O OH . TYR B 1 171 ? 42.478 76.642 29.240 1.00 46.23 ? 170 TYR B OH 1 ATOM 4375 N N . THR B 1 172 ? 35.214 73.187 26.045 1.00 58.00 ? 171 THR B N 1 ATOM 4376 C CA . THR B 1 172 ? 33.877 72.663 26.333 1.00 59.00 ? 171 THR B CA 1 ATOM 4377 C C . THR B 1 172 ? 33.838 71.134 26.268 1.00 59.62 ? 171 THR B C 1 ATOM 4378 O O . THR B 1 172 ? 33.226 70.483 27.139 1.00 61.22 ? 171 THR B O 1 ATOM 4379 C CB . THR B 1 172 ? 32.834 73.283 25.382 1.00 59.47 ? 171 THR B CB 1 ATOM 4380 O OG1 . THR B 1 172 ? 32.859 74.709 25.525 1.00 59.78 ? 171 THR B OG1 1 ATOM 4381 C CG2 . THR B 1 172 ? 31.436 72.776 25.685 1.00 61.95 ? 171 THR B CG2 1 ATOM 4382 N N . LEU B 1 173 ? 34.492 70.546 25.260 1.00 58.39 ? 172 LEU B N 1 ATOM 4383 C CA . LEU B 1 173 ? 34.565 69.086 25.170 1.00 58.78 ? 172 LEU B CA 1 ATOM 4384 C C . LEU B 1 173 ? 35.274 68.470 26.384 1.00 58.99 ? 172 LEU B C 1 ATOM 4385 O O . LEU B 1 173 ? 34.802 67.475 26.961 1.00 61.69 ? 172 LEU B O 1 ATOM 4386 C CB . LEU B 1 173 ? 35.269 68.649 23.883 1.00 57.25 ? 172 LEU B CB 1 ATOM 4387 C CG . LEU B 1 173 ? 35.415 67.138 23.660 1.00 58.18 ? 172 LEU B CG 1 ATOM 4388 C CD1 . LEU B 1 173 ? 34.073 66.429 23.750 1.00 61.26 ? 172 LEU B CD1 1 ATOM 4389 C CD2 . LEU B 1 173 ? 36.075 66.844 22.323 1.00 57.07 ? 172 LEU B CD2 1 ATOM 4390 N N . TYR B 1 174 ? 36.392 69.067 26.790 1.00 56.55 ? 173 TYR B N 1 ATOM 4391 C CA . TYR B 1 174 ? 37.092 68.632 27.987 1.00 56.76 ? 173 TYR B CA 1 ATOM 4392 C C . TYR B 1 174 ? 36.142 68.618 29.180 1.00 59.68 ? 173 TYR B C 1 ATOM 4393 O O . TYR B 1 174 ? 36.041 67.626 29.912 1.00 59.45 ? 173 TYR B O 1 ATOM 4394 C CB . TYR B 1 174 ? 38.267 69.564 28.280 1.00 55.38 ? 173 TYR B CB 1 ATOM 4395 C CG . TYR B 1 174 ? 39.051 69.256 29.542 1.00 56.62 ? 173 TYR B CG 1 ATOM 4396 C CD1 . TYR B 1 174 ? 40.093 68.331 29.533 1.00 56.95 ? 173 TYR B CD1 1 ATOM 4397 C CD2 . TYR B 1 174 ? 38.771 69.915 30.743 1.00 58.03 ? 173 TYR B CD2 1 ATOM 4398 C CE1 . TYR B 1 174 ? 40.829 68.062 30.679 1.00 57.22 ? 173 TYR B CE1 1 ATOM 4399 C CE2 . TYR B 1 174 ? 39.502 69.652 31.894 1.00 58.12 ? 173 TYR B CE2 1 ATOM 4400 C CZ . TYR B 1 174 ? 40.528 68.723 31.855 1.00 58.53 ? 173 TYR B CZ 1 ATOM 4401 O OH . TYR B 1 174 ? 41.257 68.449 32.991 1.00 59.00 ? 173 TYR B OH 1 ATOM 4402 N N . PHE B 1 175 ? 35.440 69.737 29.368 1.00 60.15 ? 174 PHE B N 1 ATOM 4403 C CA . PHE B 1 175 ? 34.496 69.861 30.458 1.00 62.73 ? 174 PHE B CA 1 ATOM 4404 C C . PHE B 1 175 ? 33.421 68.762 30.429 1.00 64.78 ? 174 PHE B C 1 ATOM 4405 O O . PHE B 1 175 ? 33.204 68.057 31.429 1.00 66.16 ? 174 PHE B O 1 ATOM 4406 C CB . PHE B 1 175 ? 33.851 71.248 30.402 1.00 63.02 ? 174 PHE B CB 1 ATOM 4407 C CG . PHE B 1 175 ? 32.744 71.447 31.385 1.00 65.92 ? 174 PHE B CG 1 ATOM 4408 C CD1 . PHE B 1 175 ? 33.013 71.530 32.741 1.00 66.88 ? 174 PHE B CD1 1 ATOM 4409 C CD2 . PHE B 1 175 ? 31.429 71.574 30.953 1.00 68.35 ? 174 PHE B CD2 1 ATOM 4410 C CE1 . PHE B 1 175 ? 31.993 71.727 33.653 1.00 69.15 ? 174 PHE B CE1 1 ATOM 4411 C CE2 . PHE B 1 175 ? 30.403 71.770 31.860 1.00 70.72 ? 174 PHE B CE2 1 ATOM 4412 C CZ . PHE B 1 175 ? 30.686 71.846 33.215 1.00 71.11 ? 174 PHE B CZ 1 ATOM 4413 N N . LEU B 1 176 ? 32.778 68.601 29.270 1.00 64.92 ? 175 LEU B N 1 ATOM 4414 C CA . LEU B 1 176 ? 31.690 67.637 29.142 1.00 67.49 ? 175 LEU B CA 1 ATOM 4415 C C . LEU B 1 176 ? 32.145 66.186 29.287 1.00 68.28 ? 175 LEU B C 1 ATOM 4416 O O . LEU B 1 176 ? 31.430 65.363 29.868 1.00 70.31 ? 175 LEU B O 1 ATOM 4417 C CB . LEU B 1 176 ? 30.944 67.837 27.817 1.00 67.55 ? 175 LEU B CB 1 ATOM 4418 C CG . LEU B 1 176 ? 30.201 69.175 27.704 1.00 67.60 ? 175 LEU B CG 1 ATOM 4419 C CD1 . LEU B 1 176 ? 29.737 69.409 26.278 1.00 68.02 ? 175 LEU B CD1 1 ATOM 4420 C CD2 . LEU B 1 176 ? 29.027 69.239 28.668 1.00 70.45 ? 175 LEU B CD2 1 ATOM 4421 N N . GLN B 1 177 ? 33.316 65.867 28.753 1.00 68.11 ? 176 GLN B N 1 ATOM 4422 C CA . GLN B 1 177 ? 33.879 64.518 28.910 1.00 69.76 ? 176 GLN B CA 1 ATOM 4423 C C . GLN B 1 177 ? 34.055 64.126 30.386 1.00 72.39 ? 176 GLN B C 1 ATOM 4424 O O . GLN B 1 177 ? 33.976 62.947 30.730 1.00 73.48 ? 176 GLN B O 1 ATOM 4425 C CB . GLN B 1 177 ? 35.230 64.403 28.180 1.00 67.12 ? 176 GLN B CB 1 ATOM 4426 C CG . GLN B 1 177 ? 35.106 64.263 26.668 1.00 66.50 ? 176 GLN B CG 1 ATOM 4427 C CD . GLN B 1 177 ? 36.439 64.060 25.969 1.00 63.68 ? 176 GLN B CD 1 ATOM 4428 O OE1 . GLN B 1 177 ? 37.504 64.271 26.545 1.00 62.23 ? 176 GLN B OE1 1 ATOM 4429 N NE2 . GLN B 1 177 ? 36.381 63.635 24.717 1.00 63.84 ? 176 GLN B NE2 1 ATOM 4430 N N . ARG B 1 178 ? 34.286 65.121 31.236 1.00 74.03 ? 177 ARG B N 1 ATOM 4431 C CA . ARG B 1 178 ? 34.522 64.885 32.636 1.00 77.01 ? 177 ARG B CA 1 ATOM 4432 C C . ARG B 1 178 ? 33.312 65.020 33.560 1.00 77.74 ? 177 ARG B C 1 ATOM 4433 O O . ARG B 1 178 ? 33.455 64.895 34.764 1.00 76.93 ? 177 ARG B O 1 ATOM 4434 C CB . ARG B 1 178 ? 35.665 65.792 33.109 1.00 78.93 ? 177 ARG B CB 1 ATOM 4435 C CG . ARG B 1 178 ? 37.006 65.373 32.527 1.00 81.58 ? 177 ARG B CG 1 ATOM 4436 C CD . ARG B 1 178 ? 38.119 66.358 32.830 1.00 85.43 ? 177 ARG B CD 1 ATOM 4437 N NE . ARG B 1 178 ? 39.420 65.688 32.791 1.00 90.99 ? 177 ARG B NE 1 ATOM 4438 C CZ . ARG B 1 178 ? 40.085 65.234 33.858 1.00 95.02 ? 177 ARG B CZ 1 ATOM 4439 N NH1 . ARG B 1 178 ? 39.603 65.386 35.091 1.00 96.07 ? 177 ARG B NH1 1 ATOM 4440 N NH2 . ARG B 1 178 ? 41.259 64.631 33.691 1.00 96.08 ? 177 ARG B NH2 1 ATOM 4441 N N . GLN B 1 179 ? 32.130 65.303 33.003 1.00 77.40 ? 178 GLN B N 1 ATOM 4442 C CA . GLN B 1 179 ? 30.924 65.328 33.807 1.00 78.23 ? 178 GLN B CA 1 ATOM 4443 C C . GLN B 1 179 ? 30.168 64.023 33.608 1.00 79.68 ? 178 GLN B C 1 ATOM 4444 O O . GLN B 1 179 ? 30.097 63.521 32.508 1.00 77.79 ? 178 GLN B O 1 ATOM 4445 C CB . GLN B 1 179 ? 29.999 66.477 33.395 1.00 78.01 ? 178 GLN B CB 1 ATOM 4446 C CG . GLN B 1 179 ? 30.602 67.864 33.480 1.00 76.07 ? 178 GLN B CG 1 ATOM 4447 C CD . GLN B 1 179 ? 31.440 68.081 34.724 1.00 75.81 ? 178 GLN B CD 1 ATOM 4448 O OE1 . GLN B 1 179 ? 30.950 67.975 35.848 1.00 78.65 ? 178 GLN B OE1 1 ATOM 4449 N NE2 . GLN B 1 179 ? 32.713 68.396 34.525 1.00 73.97 ? 178 GLN B NE2 1 ATOM 4450 N N . PRO B 1 180 ? 29.594 63.468 34.695 1.00 81.58 ? 179 PRO B N 1 ATOM 4451 C CA . PRO B 1 180 ? 28.760 62.278 34.552 1.00 84.16 ? 179 PRO B CA 1 ATOM 4452 C C . PRO B 1 180 ? 27.597 62.478 33.577 1.00 85.26 ? 179 PRO B C 1 ATOM 4453 O O . PRO B 1 180 ? 27.048 63.583 33.453 1.00 86.13 ? 179 PRO B O 1 ATOM 4454 C CB . PRO B 1 180 ? 28.225 62.036 35.970 1.00 86.73 ? 179 PRO B CB 1 ATOM 4455 C CG . PRO B 1 180 ? 29.104 62.821 36.877 1.00 85.15 ? 179 PRO B CG 1 ATOM 4456 C CD . PRO B 1 180 ? 29.600 63.983 36.076 1.00 82.55 ? 179 PRO B CD 1 ATOM 4457 N N . GLN B 1 181 ? 27.214 61.394 32.914 1.00 85.95 ? 180 GLN B N 1 ATOM 4458 C CA . GLN B 1 181 ? 26.129 61.442 31.944 1.00 86.74 ? 180 GLN B CA 1 ATOM 4459 C C . GLN B 1 181 ? 24.831 61.968 32.554 1.00 89.21 ? 180 GLN B C 1 ATOM 4460 O O . GLN B 1 181 ? 24.118 62.732 31.921 1.00 89.73 ? 180 GLN B O 1 ATOM 4461 C CB . GLN B 1 181 ? 25.897 60.053 31.328 1.00 87.98 ? 180 GLN B CB 1 ATOM 4462 C CG . GLN B 1 181 ? 24.903 60.025 30.170 1.00 89.17 ? 180 GLN B CG 1 ATOM 4463 C CD . GLN B 1 181 ? 25.360 60.844 28.970 1.00 86.98 ? 180 GLN B CD 1 ATOM 4464 O OE1 . GLN B 1 181 ? 26.459 60.645 28.448 1.00 85.09 ? 180 GLN B OE1 1 ATOM 4465 N NE2 . GLN B 1 181 ? 24.516 61.773 28.528 1.00 87.23 ? 180 GLN B NE2 1 ATOM 4466 N N . ALA B 1 182 ? 24.529 61.575 33.789 1.00 91.16 ? 181 ALA B N 1 ATOM 4467 C CA . ALA B 1 182 ? 23.312 62.028 34.456 1.00 93.79 ? 181 ALA B CA 1 ATOM 4468 C C . ALA B 1 182 ? 23.305 63.537 34.674 1.00 92.22 ? 181 ALA B C 1 ATOM 4469 O O . ALA B 1 182 ? 22.235 64.175 34.576 1.00 93.41 ? 181 ALA B O 1 ATOM 4470 C CB . ALA B 1 182 ? 23.142 61.305 35.785 1.00 95.96 ? 181 ALA B CB 1 ATOM 4471 N N . TRP B 1 183 ? 24.482 64.122 34.952 1.00 89.21 ? 182 TRP B N 1 ATOM 4472 C CA . TRP B 1 183 ? 24.596 65.560 35.114 1.00 88.02 ? 182 TRP B CA 1 ATOM 4473 C C . TRP B 1 183 ? 24.298 66.254 33.772 1.00 86.34 ? 182 TRP B C 1 ATOM 4474 O O . TRP B 1 183 ? 23.522 67.219 33.718 1.00 85.97 ? 182 TRP B O 1 ATOM 4475 C CB . TRP B 1 183 ? 25.975 65.946 35.659 1.00 85.55 ? 182 TRP B CB 1 ATOM 4476 C CG . TRP B 1 183 ? 26.080 67.405 35.976 1.00 85.44 ? 182 TRP B CG 1 ATOM 4477 C CD1 . TRP B 1 183 ? 25.851 68.004 37.181 1.00 86.84 ? 182 TRP B CD1 1 ATOM 4478 C CD2 . TRP B 1 183 ? 26.419 68.456 35.063 1.00 83.70 ? 182 TRP B CD2 1 ATOM 4479 N NE1 . TRP B 1 183 ? 26.038 69.363 37.078 1.00 85.93 ? 182 TRP B NE1 1 ATOM 4480 C CE2 . TRP B 1 183 ? 26.382 69.667 35.787 1.00 83.33 ? 182 TRP B CE2 1 ATOM 4481 C CE3 . TRP B 1 183 ? 26.758 68.489 33.701 1.00 82.19 ? 182 TRP B CE3 1 ATOM 4482 C CZ2 . TRP B 1 183 ? 26.667 70.901 35.196 1.00 82.39 ? 182 TRP B CZ2 1 ATOM 4483 C CZ3 . TRP B 1 183 ? 27.043 69.718 33.111 1.00 80.02 ? 182 TRP B CZ3 1 ATOM 4484 C CH2 . TRP B 1 183 ? 26.997 70.906 33.858 1.00 80.60 ? 182 TRP B CH2 1 ATOM 4485 N N . LYS B 1 184 ? 24.873 65.734 32.703 1.00 85.35 ? 183 LYS B N 1 ATOM 4486 C CA . LYS B 1 184 ? 24.685 66.348 31.396 1.00 84.31 ? 183 LYS B CA 1 ATOM 4487 C C . LYS B 1 184 ? 23.236 66.241 30.901 1.00 86.96 ? 183 LYS B C 1 ATOM 4488 O O . LYS B 1 184 ? 22.698 67.184 30.328 1.00 86.32 ? 183 LYS B O 1 ATOM 4489 C CB . LYS B 1 184 ? 25.674 65.763 30.386 1.00 82.11 ? 183 LYS B CB 1 ATOM 4490 C CG . LYS B 1 184 ? 27.118 66.118 30.722 1.00 79.40 ? 183 LYS B CG 1 ATOM 4491 C CD . LYS B 1 184 ? 28.111 65.553 29.724 1.00 77.02 ? 183 LYS B CD 1 ATOM 4492 C CE . LYS B 1 184 ? 28.218 64.043 29.834 1.00 78.55 ? 183 LYS B CE 1 ATOM 4493 N NZ . LYS B 1 184 ? 29.405 63.531 29.104 1.00 76.74 ? 183 LYS B NZ 1 ATOM 4494 N N . ASP B 1 185 ? 22.618 65.102 31.178 1.00 89.97 ? 184 ASP B N 1 ATOM 4495 C CA . ASP B 1 185 ? 21.211 64.884 30.832 1.00 93.85 ? 184 ASP B CA 1 ATOM 4496 C C . ASP B 1 185 ? 20.282 65.866 31.525 1.00 95.56 ? 184 ASP B C 1 ATOM 4497 O O . ASP B 1 185 ? 19.285 66.295 30.938 1.00 96.03 ? 184 ASP B O 1 ATOM 4498 C CB . ASP B 1 185 ? 20.776 63.449 31.173 1.00 96.56 ? 184 ASP B CB 1 ATOM 4499 C CG . ASP B 1 185 ? 21.363 62.405 30.225 1.00 96.75 ? 184 ASP B CG 1 ATOM 4500 O OD1 . ASP B 1 185 ? 21.944 62.773 29.174 1.00 96.83 ? 184 ASP B OD1 1 ATOM 4501 O OD2 . ASP B 1 185 ? 21.243 61.201 30.535 1.00 98.59 ? 184 ASP B OD2 1 ATOM 4502 N N . LYS B 1 186 ? 20.606 66.232 32.757 1.00 96.23 ? 185 LYS B N 1 ATOM 4503 C CA . LYS B 1 186 ? 19.807 67.203 33.488 1.00 97.91 ? 185 LYS B CA 1 ATOM 4504 C C . LYS B 1 186 ? 20.062 68.654 33.063 1.00 95.83 ? 185 LYS B C 1 ATOM 4505 O O . LYS B 1 186 ? 19.140 69.430 32.851 1.00 97.48 ? 185 LYS B O 1 ATOM 4506 C CB . LYS B 1 186 ? 20.068 67.077 34.989 1.00 99.33 ? 185 LYS B CB 1 ATOM 4507 C CG . LYS B 1 186 ? 19.327 68.098 35.837 1.00 101.98 ? 185 LYS B CG 1 ATOM 4508 C CD . LYS B 1 186 ? 19.458 67.781 37.315 1.00 105.06 ? 185 LYS B CD 1 ATOM 4509 C CE . LYS B 1 186 ? 18.766 68.834 38.166 1.00 108.00 ? 185 LYS B CE 1 ATOM 4510 N NZ . LYS B 1 186 ? 19.056 68.655 39.613 1.00 109.75 ? 185 LYS B NZ 1 ATOM 4511 N N . TYR B 1 187 ? 21.342 69.021 32.970 1.00 92.22 ? 186 TYR B N 1 ATOM 4512 C CA . TYR B 1 187 ? 21.717 70.443 32.946 1.00 90.84 ? 186 TYR B CA 1 ATOM 4513 C C . TYR B 1 187 ? 22.019 71.010 31.548 1.00 88.89 ? 186 TYR B C 1 ATOM 4514 O O . TYR B 1 187 ? 22.041 72.236 31.389 1.00 88.04 ? 186 TYR B O 1 ATOM 4515 C CB . TYR B 1 187 ? 22.908 70.698 33.878 1.00 89.33 ? 186 TYR B CB 1 ATOM 4516 C CG . TYR B 1 187 ? 22.543 70.646 35.348 1.00 91.47 ? 186 TYR B CG 1 ATOM 4517 C CD1 . TYR B 1 187 ? 21.762 71.644 35.930 1.00 93.79 ? 186 TYR B CD1 1 ATOM 4518 C CD2 . TYR B 1 187 ? 22.976 69.599 36.157 1.00 92.26 ? 186 TYR B CD2 1 ATOM 4519 C CE1 . TYR B 1 187 ? 21.415 71.598 37.277 1.00 95.98 ? 186 TYR B CE1 1 ATOM 4520 C CE2 . TYR B 1 187 ? 22.643 69.547 37.503 1.00 94.63 ? 186 TYR B CE2 1 ATOM 4521 C CZ . TYR B 1 187 ? 21.858 70.545 38.059 1.00 96.29 ? 186 TYR B CZ 1 ATOM 4522 O OH . TYR B 1 187 ? 21.522 70.490 39.392 1.00 97.18 ? 186 TYR B OH 1 ATOM 4523 N N . ILE B 1 188 ? 22.294 70.152 30.564 1.00 87.82 ? 187 ILE B N 1 ATOM 4524 C CA . ILE B 1 188 ? 22.716 70.631 29.234 1.00 86.10 ? 187 ILE B CA 1 ATOM 4525 C C . ILE B 1 188 ? 21.644 70.329 28.212 1.00 87.73 ? 187 ILE B C 1 ATOM 4526 O O . ILE B 1 188 ? 21.276 69.171 28.024 1.00 87.86 ? 187 ILE B O 1 ATOM 4527 C CB . ILE B 1 188 ? 24.042 69.979 28.785 1.00 83.25 ? 187 ILE B CB 1 ATOM 4528 C CG1 . ILE B 1 188 ? 25.155 70.269 29.800 1.00 81.53 ? 187 ILE B CG1 1 ATOM 4529 C CG2 . ILE B 1 188 ? 24.440 70.468 27.396 1.00 80.90 ? 187 ILE B CG2 1 ATOM 4530 C CD1 . ILE B 1 188 ? 25.500 71.737 29.957 1.00 80.10 ? 187 ILE B CD1 1 ATOM 4531 N N . ARG B 1 189 ? 21.161 71.360 27.529 1.00 88.18 ? 188 ARG B N 1 ATOM 4532 C CA . ARG B 1 189 ? 20.164 71.197 26.487 1.00 90.39 ? 188 ARG B CA 1 ATOM 4533 C C . ARG B 1 189 ? 20.842 70.843 25.170 1.00 87.51 ? 188 ARG B C 1 ATOM 4534 O O . ARG B 1 189 ? 20.406 69.942 24.465 1.00 86.87 ? 188 ARG B O 1 ATOM 4535 C CB . ARG B 1 189 ? 19.341 72.473 26.336 1.00 92.98 ? 188 ARG B CB 1 ATOM 4536 C CG . ARG B 1 189 ? 18.195 72.379 25.340 1.00 96.90 ? 188 ARG B CG 1 ATOM 4537 C CD . ARG B 1 189 ? 17.432 73.694 25.325 1.00 100.14 ? 188 ARG B CD 1 ATOM 4538 N NE . ARG B 1 189 ? 16.104 73.623 24.705 1.00 104.99 ? 188 ARG B NE 1 ATOM 4539 C CZ . ARG B 1 189 ? 15.859 73.592 23.397 1.00 106.12 ? 188 ARG B CZ 1 ATOM 4540 N NH1 . ARG B 1 189 ? 16.858 73.604 22.513 1.00 104.24 ? 188 ARG B NH1 1 ATOM 4541 N NH2 . ARG B 1 189 ? 14.599 73.536 22.970 1.00 108.47 ? 188 ARG B NH2 1 ATOM 4542 N N . ALA B 1 190 ? 21.882 71.582 24.815 1.00 83.96 ? 189 ALA B N 1 ATOM 4543 C CA . ALA B 1 190 ? 22.580 71.377 23.560 1.00 82.14 ? 189 ALA B CA 1 ATOM 4544 C C . ALA B 1 190 ? 23.916 72.086 23.608 1.00 78.72 ? 189 ALA B C 1 ATOM 4545 O O . ALA B 1 190 ? 24.131 72.963 24.445 1.00 78.36 ? 189 ALA B O 1 ATOM 4546 C CB . ALA B 1 190 ? 21.745 71.904 22.399 1.00 83.85 ? 189 ALA B CB 1 ATOM 4547 N N . PHE B 1 191 ? 24.796 71.694 22.688 1.00 76.13 ? 190 PHE B N 1 ATOM 4548 C CA . PHE B 1 191 ? 26.126 72.273 22.519 1.00 72.56 ? 190 PHE B CA 1 ATOM 4549 C C . PHE B 1 191 ? 26.211 72.677 21.047 1.00 71.37 ? 190 PHE B C 1 ATOM 4550 O O . PHE B 1 191 ? 26.134 71.827 20.160 1.00 71.16 ? 190 PHE B O 1 ATOM 4551 C CB . PHE B 1 191 ? 27.174 71.217 22.911 1.00 71.09 ? 190 PHE B CB 1 ATOM 4552 C CG . PHE B 1 191 ? 28.614 71.573 22.590 1.00 67.62 ? 190 PHE B CG 1 ATOM 4553 C CD1 . PHE B 1 191 ? 29.017 72.868 22.272 1.00 66.17 ? 190 PHE B CD1 1 ATOM 4554 C CD2 . PHE B 1 191 ? 29.589 70.580 22.656 1.00 66.55 ? 190 PHE B CD2 1 ATOM 4555 C CE1 . PHE B 1 191 ? 30.347 73.149 21.990 1.00 63.36 ? 190 PHE B CE1 1 ATOM 4556 C CE2 . PHE B 1 191 ? 30.921 70.859 22.383 1.00 64.08 ? 190 PHE B CE2 1 ATOM 4557 C CZ . PHE B 1 191 ? 31.300 72.145 22.046 1.00 62.30 ? 190 PHE B CZ 1 ATOM 4558 N N . VAL B 1 192 ? 26.278 73.987 20.816 1.00 70.82 ? 191 VAL B N 1 ATOM 4559 C CA . VAL B 1 192 ? 26.439 74.551 19.479 1.00 70.58 ? 191 VAL B CA 1 ATOM 4560 C C . VAL B 1 192 ? 27.923 74.892 19.315 1.00 67.35 ? 191 VAL B C 1 ATOM 4561 O O . VAL B 1 192 ? 28.471 75.736 20.029 1.00 67.35 ? 191 VAL B O 1 ATOM 4562 C CB . VAL B 1 192 ? 25.599 75.827 19.305 1.00 71.68 ? 191 VAL B CB 1 ATOM 4563 C CG1 . VAL B 1 192 ? 25.869 76.471 17.950 1.00 70.87 ? 191 VAL B CG1 1 ATOM 4564 C CG2 . VAL B 1 192 ? 24.121 75.506 19.474 1.00 74.69 ? 191 VAL B CG2 1 ATOM 4565 N N . SER B 1 193 ? 28.555 74.199 18.375 1.00 65.62 ? 192 SER B N 1 ATOM 4566 C CA . SER B 1 193 ? 29.995 74.215 18.204 1.00 63.02 ? 192 SER B CA 1 ATOM 4567 C C . SER B 1 193 ? 30.335 74.974 16.933 1.00 61.11 ? 192 SER B C 1 ATOM 4568 O O . SER B 1 193 ? 29.958 74.552 15.850 1.00 60.99 ? 192 SER B O 1 ATOM 4569 C CB . SER B 1 193 ? 30.499 72.775 18.107 1.00 63.34 ? 192 SER B CB 1 ATOM 4570 O OG . SER B 1 193 ? 31.902 72.728 17.965 1.00 62.34 ? 192 SER B OG 1 ATOM 4571 N N . LEU B 1 194 ? 31.012 76.107 17.080 1.00 60.30 ? 193 LEU B N 1 ATOM 4572 C CA . LEU B 1 194 ? 31.341 76.967 15.943 1.00 59.54 ? 193 LEU B CA 1 ATOM 4573 C C . LEU B 1 194 ? 32.837 76.964 15.634 1.00 56.65 ? 193 LEU B C 1 ATOM 4574 O O . LEU B 1 194 ? 33.644 77.461 16.426 1.00 55.78 ? 193 LEU B O 1 ATOM 4575 C CB . LEU B 1 194 ? 30.885 78.400 16.222 1.00 61.02 ? 193 LEU B CB 1 ATOM 4576 C CG . LEU B 1 194 ? 29.439 78.570 16.691 1.00 64.70 ? 193 LEU B CG 1 ATOM 4577 C CD1 . LEU B 1 194 ? 29.184 79.999 17.140 1.00 66.09 ? 193 LEU B CD1 1 ATOM 4578 C CD2 . LEU B 1 194 ? 28.463 78.178 15.595 1.00 67.29 ? 193 LEU B CD2 1 ATOM 4579 N N . GLY B 1 195 ? 33.211 76.386 14.496 1.00 57.05 ? 194 GLY B N 1 ATOM 4580 C CA . GLY B 1 195 ? 34.612 76.423 14.065 1.00 55.00 ? 194 GLY B CA 1 ATOM 4581 C C . GLY B 1 195 ? 35.566 75.667 14.983 1.00 53.42 ? 194 GLY B C 1 ATOM 4582 O O . GLY B 1 195 ? 36.648 76.140 15.311 1.00 53.65 ? 194 GLY B O 1 ATOM 4583 N N . ALA B 1 196 ? 35.151 74.483 15.407 1.00 53.31 ? 195 ALA B N 1 ATOM 4584 C CA . ALA B 1 196 ? 35.919 73.679 16.351 1.00 52.87 ? 195 ALA B CA 1 ATOM 4585 C C . ALA B 1 196 ? 37.149 73.024 15.699 1.00 52.39 ? 195 ALA B C 1 ATOM 4586 O O . ALA B 1 196 ? 37.011 72.310 14.687 1.00 55.18 ? 195 ALA B O 1 ATOM 4587 C CB . ALA B 1 196 ? 35.021 72.604 16.932 1.00 54.28 ? 195 ALA B CB 1 ATOM 4588 N N . PRO B 1 197 ? 38.342 73.223 16.294 1.00 50.70 ? 196 PRO B N 1 ATOM 4589 C CA . PRO B 1 197 ? 39.571 72.607 15.819 1.00 50.42 ? 196 PRO B CA 1 ATOM 4590 C C . PRO B 1 197 ? 39.798 71.233 16.441 1.00 50.59 ? 196 PRO B C 1 ATOM 4591 O O . PRO B 1 197 ? 40.819 71.004 17.092 1.00 50.76 ? 196 PRO B O 1 ATOM 4592 C CB . PRO B 1 197 ? 40.635 73.597 16.292 1.00 49.64 ? 196 PRO B CB 1 ATOM 4593 C CG . PRO B 1 197 ? 40.107 74.056 17.607 1.00 49.32 ? 196 PRO B CG 1 ATOM 4594 C CD . PRO B 1 197 ? 38.604 74.089 17.459 1.00 50.89 ? 196 PRO B CD 1 ATOM 4595 N N . TRP B 1 198 ? 38.846 70.326 16.246 1.00 51.81 ? 197 TRP B N 1 ATOM 4596 C CA . TRP B 1 198 ? 39.018 68.950 16.694 1.00 52.86 ? 197 TRP B CA 1 ATOM 4597 C C . TRP B 1 198 ? 40.296 68.425 16.029 1.00 54.20 ? 197 TRP B C 1 ATOM 4598 O O . TRP B 1 198 ? 40.556 68.692 14.843 1.00 57.66 ? 197 TRP B O 1 ATOM 4599 C CB . TRP B 1 198 ? 37.828 68.072 16.287 1.00 54.57 ? 197 TRP B CB 1 ATOM 4600 C CG . TRP B 1 198 ? 36.434 68.614 16.602 1.00 55.86 ? 197 TRP B CG 1 ATOM 4601 C CD1 . TRP B 1 198 ? 35.394 68.758 15.723 1.00 56.73 ? 197 TRP B CD1 1 ATOM 4602 C CD2 . TRP B 1 198 ? 35.939 69.056 17.873 1.00 56.21 ? 197 TRP B CD2 1 ATOM 4603 N NE1 . TRP B 1 198 ? 34.289 69.268 16.365 1.00 57.63 ? 197 TRP B NE1 1 ATOM 4604 C CE2 . TRP B 1 198 ? 34.594 69.457 17.686 1.00 57.45 ? 197 TRP B CE2 1 ATOM 4605 C CE3 . TRP B 1 198 ? 36.500 69.159 19.145 1.00 55.39 ? 197 TRP B CE3 1 ATOM 4606 C CZ2 . TRP B 1 198 ? 33.805 69.954 18.729 1.00 58.18 ? 197 TRP B CZ2 1 ATOM 4607 C CZ3 . TRP B 1 198 ? 35.713 69.651 20.181 1.00 56.53 ? 197 TRP B CZ3 1 ATOM 4608 C CH2 . TRP B 1 198 ? 34.381 70.042 19.964 1.00 57.61 ? 197 TRP B CH2 1 ATOM 4609 N N . GLY B 1 199 ? 41.118 67.706 16.775 1.00 54.54 ? 198 GLY B N 1 ATOM 4610 C CA . GLY B 1 199 ? 42.372 67.183 16.205 1.00 53.46 ? 198 GLY B CA 1 ATOM 4611 C C . GLY B 1 199 ? 43.419 68.215 15.814 1.00 50.61 ? 198 GLY B C 1 ATOM 4612 O O . GLY B 1 199 ? 44.380 67.883 15.113 1.00 51.14 ? 198 GLY B O 1 ATOM 4613 N N . GLY B 1 200 ? 43.260 69.457 16.263 1.00 48.82 ? 199 GLY B N 1 ATOM 4614 C CA . GLY B 1 200 ? 44.302 70.466 16.061 1.00 48.25 ? 199 GLY B CA 1 ATOM 4615 C C . GLY B 1 200 ? 44.246 71.102 14.692 1.00 48.32 ? 199 GLY B C 1 ATOM 4616 O O . GLY B 1 200 ? 43.460 70.687 13.841 1.00 51.43 ? 199 GLY B O 1 ATOM 4617 N N . VAL B 1 201 ? 45.089 72.107 14.467 1.00 47.65 ? 200 VAL B N 1 ATOM 4618 C CA . VAL B 1 201 ? 45.124 72.814 13.184 1.00 49.30 ? 200 VAL B CA 1 ATOM 4619 C C . VAL B 1 201 ? 46.553 72.908 12.652 1.00 47.13 ? 200 VAL B C 1 ATOM 4620 O O . VAL B 1 201 ? 47.483 73.104 13.416 1.00 43.02 ? 200 VAL B O 1 ATOM 4621 C CB . VAL B 1 201 ? 44.511 74.233 13.301 1.00 51.53 ? 200 VAL B CB 1 ATOM 4622 C CG1 . VAL B 1 201 ? 43.093 74.149 13.835 1.00 54.53 ? 200 VAL B CG1 1 ATOM 4623 C CG2 . VAL B 1 201 ? 45.336 75.131 14.213 1.00 52.11 ? 200 VAL B CG2 1 ATOM 4624 N N . ALA B 1 202 ? 46.730 72.816 11.341 1.00 47.94 ? 201 ALA B N 1 ATOM 4625 C CA . ALA B 1 202 ? 48.063 72.799 10.760 1.00 47.61 ? 201 ALA B CA 1 ATOM 4626 C C . ALA B 1 202 ? 48.806 74.106 11.013 1.00 47.30 ? 201 ALA B C 1 ATOM 4627 O O . ALA B 1 202 ? 50.020 74.119 11.177 1.00 46.99 ? 201 ALA B O 1 ATOM 4628 C CB . ALA B 1 202 ? 47.979 72.515 9.267 1.00 48.56 ? 201 ALA B CB 1 ATOM 4629 N N . LYS B 1 203 ? 48.085 75.219 11.049 1.00 47.93 ? 202 LYS B N 1 ATOM 4630 C CA . LYS B 1 203 ? 48.776 76.516 11.142 1.00 48.30 ? 202 LYS B CA 1 ATOM 4631 C C . LYS B 1 203 ? 49.548 76.764 12.433 1.00 45.80 ? 202 LYS B C 1 ATOM 4632 O O . LYS B 1 203 ? 50.389 77.648 12.489 1.00 44.09 ? 202 LYS B O 1 ATOM 4633 C CB . LYS B 1 203 ? 47.820 77.682 10.879 1.00 52.86 ? 202 LYS B CB 1 ATOM 4634 C CG . LYS B 1 203 ? 47.195 78.302 12.121 1.00 56.48 ? 202 LYS B CG 1 ATOM 4635 C CD . LYS B 1 203 ? 46.062 79.251 11.758 1.00 61.98 ? 202 LYS B CD 1 ATOM 4636 C CE . LYS B 1 203 ? 46.537 80.504 11.022 1.00 64.36 ? 202 LYS B CE 1 ATOM 4637 N NZ . LYS B 1 203 ? 45.507 80.994 10.053 1.00 65.72 ? 202 LYS B NZ 1 ATOM 4638 N N . THR B 1 204 ? 49.274 75.970 13.471 1.00 45.13 ? 203 THR B N 1 ATOM 4639 C CA . THR B 1 204 ? 50.037 76.037 14.724 1.00 43.20 ? 203 THR B CA 1 ATOM 4640 C C . THR B 1 204 ? 51.528 75.793 14.504 1.00 41.78 ? 203 THR B C 1 ATOM 4641 O O . THR B 1 204 ? 52.347 76.378 15.202 1.00 39.56 ? 203 THR B O 1 ATOM 4642 C CB . THR B 1 204 ? 49.392 75.366 15.968 1.00 43.82 ? 203 THR B CB 1 ATOM 4643 O OG1 . THR B 1 204 ? 50.385 75.057 16.954 1.00 46.29 ? 203 THR B OG1 1 ATOM 4644 C CG2 . THR B 1 204 ? 48.656 74.179 15.637 1.00 44.83 ? 203 THR B CG2 1 ATOM 4645 N N . LEU B 1 205 ? 51.922 74.983 13.514 1.00 43.21 ? 204 LEU B N 1 ATOM 4646 C CA . LEU B 1 205 ? 53.340 74.807 13.203 1.00 42.01 ? 204 LEU B CA 1 ATOM 4647 C C . LEU B 1 205 ? 53.973 76.108 12.769 1.00 42.01 ? 204 LEU B C 1 ATOM 4648 O O . LEU B 1 205 ? 55.085 76.426 13.212 1.00 42.34 ? 204 LEU B O 1 ATOM 4649 C CB . LEU B 1 205 ? 53.529 73.693 12.190 1.00 42.78 ? 204 LEU B CB 1 ATOM 4650 C CG . LEU B 1 205 ? 53.270 72.359 12.909 1.00 43.70 ? 204 LEU B CG 1 ATOM 4651 C CD1 . LEU B 1 205 ? 52.253 71.470 12.209 1.00 44.99 ? 204 LEU B CD1 1 ATOM 4652 C CD2 . LEU B 1 205 ? 54.576 71.627 13.165 1.00 44.57 ? 204 LEU B CD2 1 ATOM 4653 N N . ARG B 1 206 ? 53.303 76.882 11.934 1.00 43.01 ? 205 ARG B N 1 ATOM 4654 C CA . ARG B 1 206 ? 53.852 78.164 11.500 1.00 45.01 ? 205 ARG B CA 1 ATOM 4655 C C . ARG B 1 206 ? 53.908 79.163 12.648 1.00 43.30 ? 205 ARG B C 1 ATOM 4656 O O . ARG B 1 206 ? 54.883 79.881 12.792 1.00 42.93 ? 205 ARG B O 1 ATOM 4657 C CB . ARG B 1 206 ? 53.016 78.731 10.346 1.00 48.01 ? 205 ARG B CB 1 ATOM 4658 C CG . ARG B 1 206 ? 53.398 80.119 9.851 1.00 52.57 ? 205 ARG B CG 1 ATOM 4659 C CD . ARG B 1 206 ? 52.318 80.625 8.898 1.00 59.01 ? 205 ARG B CD 1 ATOM 4660 N NE . ARG B 1 206 ? 52.743 81.741 8.058 1.00 66.06 ? 205 ARG B NE 1 ATOM 4661 C CZ . ARG B 1 206 ? 52.703 83.023 8.410 1.00 71.06 ? 205 ARG B CZ 1 ATOM 4662 N NH1 . ARG B 1 206 ? 52.255 83.384 9.610 1.00 71.71 ? 205 ARG B NH1 1 ATOM 4663 N NH2 . ARG B 1 206 ? 53.125 83.956 7.553 1.00 73.59 ? 205 ARG B NH2 1 ATOM 4664 N N . VAL B 1 207 ? 52.889 79.200 13.482 1.00 41.92 ? 206 VAL B N 1 ATOM 4665 C CA . VAL B 1 207 ? 52.865 80.059 14.657 1.00 40.37 ? 206 VAL B CA 1 ATOM 4666 C C . VAL B 1 207 ? 54.097 79.824 15.532 1.00 39.60 ? 206 VAL B C 1 ATOM 4667 O O . VAL B 1 207 ? 54.816 80.765 15.869 1.00 41.96 ? 206 VAL B O 1 ATOM 4668 C CB . VAL B 1 207 ? 51.605 79.809 15.512 1.00 40.16 ? 206 VAL B CB 1 ATOM 4669 C CG1 . VAL B 1 207 ? 51.719 80.495 16.861 1.00 40.82 ? 206 VAL B CG1 1 ATOM 4670 C CG2 . VAL B 1 207 ? 50.335 80.266 14.797 1.00 40.32 ? 206 VAL B CG2 1 ATOM 4671 N N . LEU B 1 208 ? 54.362 78.561 15.859 1.00 37.87 ? 207 LEU B N 1 ATOM 4672 C CA . LEU B 1 208 ? 55.481 78.212 16.721 1.00 37.90 ? 207 LEU B CA 1 ATOM 4673 C C . LEU B 1 208 ? 56.821 78.450 16.056 1.00 38.21 ? 207 LEU B C 1 ATOM 4674 O O . LEU B 1 208 ? 57.765 78.922 16.709 1.00 39.58 ? 207 LEU B O 1 ATOM 4675 C CB . LEU B 1 208 ? 55.379 76.760 17.185 1.00 37.81 ? 207 LEU B CB 1 ATOM 4676 C CG . LEU B 1 208 ? 54.212 76.485 18.140 1.00 37.55 ? 207 LEU B CG 1 ATOM 4677 C CD1 . LEU B 1 208 ? 53.894 75.004 18.190 1.00 38.06 ? 207 LEU B CD1 1 ATOM 4678 C CD2 . LEU B 1 208 ? 54.526 77.012 19.529 1.00 37.32 ? 207 LEU B CD2 1 ATOM 4679 N N . ALA B 1 209 ? 56.952 78.110 14.768 1.00 37.90 ? 208 ALA B N 1 ATOM 4680 C CA . ALA B 1 209 ? 58.228 78.255 14.081 1.00 39.02 ? 208 ALA B CA 1 ATOM 4681 C C . ALA B 1 209 ? 58.600 79.731 13.898 1.00 39.38 ? 208 ALA B C 1 ATOM 4682 O O . ALA B 1 209 ? 59.679 80.153 14.299 1.00 39.95 ? 208 ALA B O 1 ATOM 4683 C CB . ALA B 1 209 ? 58.196 77.552 12.738 1.00 39.52 ? 208 ALA B CB 1 ATOM 4684 N N . SER B 1 210 ? 57.704 80.494 13.273 1.00 39.31 ? 209 SER B N 1 ATOM 4685 C CA . SER B 1 210 ? 58.074 81.811 12.765 1.00 40.50 ? 209 SER B CA 1 ATOM 4686 C C . SER B 1 210 ? 57.129 82.944 13.176 1.00 41.51 ? 209 SER B C 1 ATOM 4687 O O . SER B 1 210 ? 57.353 84.086 12.807 1.00 43.42 ? 209 SER B O 1 ATOM 4688 C CB . SER B 1 210 ? 58.217 81.736 11.233 1.00 41.53 ? 209 SER B CB 1 ATOM 4689 O OG . SER B 1 210 ? 57.101 81.115 10.621 1.00 38.75 ? 209 SER B OG 1 ATOM 4690 N N . GLY B 1 211 ? 56.122 82.650 13.997 1.00 44.09 ? 210 GLY B N 1 ATOM 4691 C CA . GLY B 1 211 ? 55.176 83.665 14.488 1.00 47.38 ? 210 GLY B CA 1 ATOM 4692 C C . GLY B 1 211 ? 54.055 83.933 13.505 1.00 49.42 ? 210 GLY B C 1 ATOM 4693 O O . GLY B 1 211 ? 54.190 83.679 12.321 1.00 48.32 ? 210 GLY B O 1 ATOM 4694 N N . ASP B 1 212 ? 52.926 84.404 14.017 1.00 53.65 ? 211 ASP B N 1 ATOM 4695 C CA . ASP B 1 212 ? 51.761 84.685 13.199 1.00 60.17 ? 211 ASP B CA 1 ATOM 4696 C C . ASP B 1 212 ? 51.128 85.971 13.686 1.00 63.94 ? 211 ASP B C 1 ATOM 4697 O O . ASP B 1 212 ? 50.473 85.992 14.733 1.00 62.02 ? 211 ASP B O 1 ATOM 4698 C CB . ASP B 1 212 ? 50.726 83.537 13.271 1.00 63.42 ? 211 ASP B CB 1 ATOM 4699 C CG . ASP B 1 212 ? 49.575 83.687 12.258 1.00 66.92 ? 211 ASP B CG 1 ATOM 4700 O OD1 . ASP B 1 212 ? 49.264 84.821 11.854 1.00 66.60 ? 211 ASP B OD1 1 ATOM 4701 O OD2 . ASP B 1 212 ? 48.979 82.651 11.859 1.00 71.84 ? 211 ASP B OD2 1 ATOM 4702 N N A ASN B 1 213 ? 51.282 87.030 12.904 0.50 66.62 ? 212 ASN B N 1 ATOM 4703 N N B ASN B 1 213 ? 51.336 87.045 12.920 0.50 67.11 ? 212 ASN B N 1 ATOM 4704 C CA A ASN B 1 213 ? 50.713 88.313 13.265 0.50 67.92 ? 212 ASN B CA 1 ATOM 4705 C CA B ASN B 1 213 ? 50.690 88.339 13.157 0.50 69.00 ? 212 ASN B CA 1 ATOM 4706 C C A ASN B 1 213 ? 49.433 88.662 12.511 0.50 71.31 ? 212 ASN B C 1 ATOM 4707 C C B ASN B 1 213 ? 49.537 88.582 12.182 0.50 73.12 ? 212 ASN B C 1 ATOM 4708 O O A ASN B 1 213 ? 48.935 89.759 12.662 0.50 72.07 ? 212 ASN B O 1 ATOM 4709 O O B ASN B 1 213 ? 48.366 88.398 12.527 0.50 72.75 ? 212 ASN B O 1 ATOM 4710 C CB A ASN B 1 213 ? 51.748 89.417 13.069 0.50 67.07 ? 212 ASN B CB 1 ATOM 4711 C CB B ASN B 1 213 ? 51.712 89.471 13.030 0.50 68.02 ? 212 ASN B CB 1 ATOM 4712 C CG A ASN B 1 213 ? 52.060 89.683 11.611 0.50 66.88 ? 212 ASN B CG 1 ATOM 4713 C CG B ASN B 1 213 ? 52.108 89.747 11.590 0.50 67.73 ? 212 ASN B CG 1 ATOM 4714 O OD1 A ASN B 1 213 ? 51.445 89.111 10.712 0.50 68.13 ? 212 ASN B OD1 1 ATOM 4715 O OD1 B ASN B 1 213 ? 51.269 89.743 10.691 0.50 69.22 ? 212 ASN B OD1 1 ATOM 4716 N ND2 A ASN B 1 213 ? 53.024 90.563 11.372 0.50 66.06 ? 212 ASN B ND2 1 ATOM 4717 N ND2 B ASN B 1 213 ? 53.393 90.002 11.368 0.50 66.50 ? 212 ASN B ND2 1 ATOM 4718 N N A ASN B 1 214 ? 48.891 87.735 11.724 0.50 73.75 ? 213 ASN B N 1 ATOM 4719 N N B ASN B 1 214 ? 49.884 88.993 10.963 0.50 77.69 ? 213 ASN B N 1 ATOM 4720 C CA A ASN B 1 214 ? 47.722 88.026 10.886 0.50 77.25 ? 213 ASN B CA 1 ATOM 4721 C CA B ASN B 1 214 ? 48.902 89.314 9.923 0.50 80.75 ? 213 ASN B CA 1 ATOM 4722 C C A ASN B 1 214 ? 46.549 88.611 11.664 0.50 79.00 ? 213 ASN B C 1 ATOM 4723 C C B ASN B 1 214 ? 47.724 90.118 10.461 0.50 82.17 ? 213 ASN B C 1 ATOM 4724 O O A ASN B 1 214 ? 45.729 89.343 11.106 0.50 80.82 ? 213 ASN B O 1 ATOM 4725 O O B ASN B 1 214 ? 47.073 90.856 9.720 0.50 82.16 ? 213 ASN B O 1 ATOM 4726 C CB A ASN B 1 214 ? 47.216 86.752 10.194 0.50 77.87 ? 213 ASN B CB 1 ATOM 4727 C CB B ASN B 1 214 ? 48.411 88.041 9.229 0.50 81.02 ? 213 ASN B CB 1 ATOM 4728 C CG A ASN B 1 214 ? 48.268 86.096 9.320 0.50 78.08 ? 213 ASN B CG 1 ATOM 4729 C CG B ASN B 1 214 ? 49.439 87.470 8.267 0.50 80.75 ? 213 ASN B CG 1 ATOM 4730 O OD1 A ASN B 1 214 ? 49.467 86.322 9.490 0.50 80.31 ? 213 ASN B OD1 1 ATOM 4731 O OD1 B ASN B 1 214 ? 50.292 88.193 7.747 0.50 78.45 ? 213 ASN B OD1 1 ATOM 4732 N ND2 A ASN B 1 214 ? 47.822 85.264 8.386 0.50 77.45 ? 213 ASN B ND2 1 ATOM 4733 N ND2 B ASN B 1 214 ? 49.362 86.166 8.026 0.50 80.58 ? 213 ASN B ND2 1 ATOM 4734 N N A ARG B 1 215 ? 46.439 88.252 12.939 0.50 80.74 ? 214 ARG B N 1 ATOM 4735 N N B ARG B 1 215 ? 47.453 89.969 11.752 0.50 84.96 ? 214 ARG B N 1 ATOM 4736 C CA A ARG B 1 215 ? 45.341 88.749 13.763 0.50 83.83 ? 214 ARG B CA 1 ATOM 4737 C CA B ARG B 1 215 ? 46.484 90.825 12.422 0.50 89.13 ? 214 ARG B CA 1 ATOM 4738 C C A ARG B 1 215 ? 45.695 90.102 14.380 0.50 85.87 ? 214 ARG B C 1 ATOM 4739 C C B ARG B 1 215 ? 47.151 92.140 12.836 0.50 89.97 ? 214 ARG B C 1 ATOM 4740 O O A ARG B 1 215 ? 44.800 90.851 14.756 0.50 89.07 ? 214 ARG B O 1 ATOM 4741 O O B ARG B 1 215 ? 46.681 92.820 13.752 0.50 87.98 ? 214 ARG B O 1 ATOM 4742 C CB A ARG B 1 215 ? 44.960 87.745 14.862 0.50 85.35 ? 214 ARG B CB 1 ATOM 4743 C CB B ARG B 1 215 ? 45.877 90.121 13.643 0.50 89.10 ? 214 ARG B CB 1 ATOM 4744 C CG A ARG B 1 215 ? 44.229 86.494 14.373 0.50 86.27 ? 214 ARG B CG 1 ATOM 4745 C CG B ARG B 1 215 ? 44.618 89.318 13.345 0.50 89.29 ? 214 ARG B CG 1 ATOM 4746 C CD A ARG B 1 215 ? 42.851 86.795 13.781 0.50 87.09 ? 214 ARG B CD 1 ATOM 4747 C CD B ARG B 1 215 ? 44.899 88.151 12.411 0.50 90.71 ? 214 ARG B CD 1 ATOM 4748 N NE A ARG B 1 215 ? 42.351 85.688 12.953 0.50 87.05 ? 214 ARG B NE 1 ATOM 4749 N NE B ARG B 1 215 ? 43.684 87.658 11.766 0.50 94.40 ? 214 ARG B NE 1 ATOM 4750 C CZ A ARG B 1 215 ? 41.423 85.802 12.000 0.50 86.09 ? 214 ARG B CZ 1 ATOM 4751 C CZ B ARG B 1 215 ? 43.652 86.644 10.905 0.50 95.79 ? 214 ARG B CZ 1 ATOM 4752 N NH1 A ARG B 1 215 ? 40.873 86.979 11.726 0.50 86.47 ? 214 ARG B NH1 1 ATOM 4753 N NH1 B ARG B 1 215 ? 44.771 86.005 10.588 0.50 94.81 ? 214 ARG B NH1 1 ATOM 4754 N NH2 A ARG B 1 215 ? 41.039 84.730 11.310 0.50 85.21 ? 214 ARG B NH2 1 ATOM 4755 N NH2 B ARG B 1 215 ? 42.501 86.265 10.366 0.50 96.73 ? 214 ARG B NH2 1 ATOM 4756 N N A ILE B 1 216 ? 46.992 90.411 14.473 0.50 84.48 ? 215 ILE B N 1 ATOM 4757 N N B ILE B 1 216 ? 48.245 92.491 12.156 0.50 90.45 ? 215 ILE B N 1 ATOM 4758 C CA A ILE B 1 216 ? 47.465 91.684 15.040 0.50 83.36 ? 215 ILE B CA 1 ATOM 4759 C CA B ILE B 1 216 ? 48.955 93.743 12.425 0.50 89.13 ? 215 ILE B CA 1 ATOM 4760 C C A ILE B 1 216 ? 48.735 92.189 14.302 0.50 84.28 ? 215 ILE B C 1 ATOM 4761 C C B ILE B 1 216 ? 50.425 93.679 11.997 0.50 82.86 ? 215 ILE B C 1 ATOM 4762 O O A ILE B 1 216 ? 49.883 92.075 14.798 0.50 84.24 ? 215 ILE B O 1 ATOM 4763 O O B ILE B 1 216 ? 51.299 93.375 12.809 0.50 81.86 ? 215 ILE B O 1 ATOM 4764 C CB A ILE B 1 216 ? 47.667 91.574 16.575 0.50 80.12 ? 215 ILE B CB 1 ATOM 4765 C CB B ILE B 1 216 ? 48.910 94.087 13.927 0.50 92.70 ? 215 ILE B CB 1 ATOM 4766 C CG1 A ILE B 1 216 ? 46.764 90.470 17.137 0.50 76.36 ? 215 ILE B CG1 1 ATOM 4767 C CG1 B ILE B 1 216 ? 47.970 93.127 14.666 0.50 94.65 ? 215 ILE B CG1 1 ATOM 4768 C CG2 A ILE B 1 216 ? 47.377 92.910 17.246 0.50 81.38 ? 215 ILE B CG2 1 ATOM 4769 C CG2 B ILE B 1 216 ? 48.499 95.540 14.131 0.50 93.70 ? 215 ILE B CG2 1 ATOM 4770 C CD1 A ILE B 1 216 ? 47.368 89.083 17.073 0.50 73.55 ? 215 ILE B CD1 1 ATOM 4771 C CD1 B ILE B 1 216 ? 48.464 91.694 14.691 0.50 93.91 ? 215 ILE B CD1 1 ATOM 4772 N N A PRO B 1 217 ? 48.521 92.771 13.104 0.50 86.19 ? 216 PRO B N 1 ATOM 4773 N N B PRO B 1 217 ? 50.701 93.969 10.717 0.50 78.07 ? 216 PRO B N 1 ATOM 4774 C CA A PRO B 1 217 ? 49.584 93.166 12.170 0.50 85.69 ? 216 PRO B CA 1 ATOM 4775 C CA B PRO B 1 217 ? 52.064 93.978 10.174 0.50 74.61 ? 216 PRO B CA 1 ATOM 4776 C C A PRO B 1 217 ? 50.504 94.284 12.652 0.50 85.99 ? 216 PRO B C 1 ATOM 4777 C C B PRO B 1 217 ? 53.019 94.893 10.944 0.50 69.78 ? 216 PRO B C 1 ATOM 4778 O O A PRO B 1 217 ? 51.549 94.506 12.050 0.50 84.32 ? 216 PRO B O 1 ATOM 4779 O O B PRO B 1 217 ? 54.225 94.655 10.955 0.50 66.23 ? 216 PRO B O 1 ATOM 4780 C CB A PRO B 1 217 ? 48.814 93.615 10.915 0.50 86.05 ? 216 PRO B CB 1 ATOM 4781 C CB B PRO B 1 217 ? 51.869 94.490 8.742 0.50 77.18 ? 216 PRO B CB 1 ATOM 4782 C CG A PRO B 1 217 ? 47.429 93.094 11.074 0.50 86.21 ? 216 PRO B CG 1 ATOM 4783 C CG B PRO B 1 217 ? 50.466 94.122 8.395 0.50 78.77 ? 216 PRO B CG 1 ATOM 4784 C CD A PRO B 1 217 ? 47.183 93.051 12.551 0.50 87.03 ? 216 PRO B CD 1 ATOM 4785 C CD B PRO B 1 217 ? 49.685 94.216 9.677 0.50 79.55 ? 216 PRO B CD 1 ATOM 4786 N N A VAL B 1 218 ? 50.120 94.987 13.712 0.50 87.91 ? 217 VAL B N 1 ATOM 4787 N N B VAL B 1 218 ? 52.481 95.932 11.575 0.50 67.29 ? 217 VAL B N 1 ATOM 4788 C CA A VAL B 1 218 ? 50.982 96.005 14.310 0.50 89.03 ? 217 VAL B CA 1 ATOM 4789 C CA B VAL B 1 218 ? 53.287 96.800 12.429 0.50 65.70 ? 217 VAL B CA 1 ATOM 4790 C C A VAL B 1 218 ? 52.147 95.366 15.078 0.50 87.11 ? 217 VAL B C 1 ATOM 4791 C C B VAL B 1 218 ? 54.047 95.945 13.432 0.50 61.65 ? 217 VAL B C 1 ATOM 4792 O O A VAL B 1 218 ? 53.102 96.050 15.443 0.50 88.98 ? 217 VAL B O 1 ATOM 4793 O O B VAL B 1 218 ? 55.184 96.240 13.778 0.50 59.86 ? 217 VAL B O 1 ATOM 4794 C CB A VAL B 1 218 ? 50.192 96.914 15.279 0.50 91.32 ? 217 VAL B CB 1 ATOM 4795 C CB B VAL B 1 218 ? 52.421 97.809 13.205 0.50 66.77 ? 217 VAL B CB 1 ATOM 4796 C CG1 A VAL B 1 218 ? 51.009 98.148 15.642 0.50 92.03 ? 217 VAL B CG1 1 ATOM 4797 C CG1 B VAL B 1 218 ? 53.303 98.713 14.051 0.50 67.09 ? 217 VAL B CG1 1 ATOM 4798 C CG2 A VAL B 1 218 ? 48.846 97.310 14.677 0.50 91.96 ? 217 VAL B CG2 1 ATOM 4799 C CG2 B VAL B 1 218 ? 51.569 98.631 12.248 0.50 68.65 ? 217 VAL B CG2 1 ATOM 4800 N N A ILE B 1 219 ? 52.060 94.066 15.350 0.50 83.35 ? 218 ILE B N 1 ATOM 4801 N N B ILE B 1 219 ? 53.397 94.885 13.899 0.50 59.86 ? 218 ILE B N 1 ATOM 4802 C CA A ILE B 1 219 ? 53.169 93.351 15.980 0.50 80.51 ? 218 ILE B CA 1 ATOM 4803 C CA B ILE B 1 219 ? 54.031 93.911 14.776 0.50 57.89 ? 218 ILE B CA 1 ATOM 4804 C C A ILE B 1 219 ? 53.924 92.545 14.929 0.50 76.83 ? 218 ILE B C 1 ATOM 4805 C C B ILE B 1 219 ? 54.911 92.957 13.974 0.50 56.15 ? 218 ILE B C 1 ATOM 4806 O O A ILE B 1 219 ? 53.328 91.762 14.180 0.50 76.47 ? 218 ILE B O 1 ATOM 4807 O O B ILE B 1 219 ? 54.455 92.332 13.018 0.50 55.29 ? 218 ILE B O 1 ATOM 4808 C CB A ILE B 1 219 ? 52.689 92.401 17.098 0.50 80.76 ? 218 ILE B CB 1 ATOM 4809 C CB B ILE B 1 219 ? 52.987 93.060 15.526 0.50 57.58 ? 218 ILE B CB 1 ATOM 4810 C CG1 A ILE B 1 219 ? 51.610 93.071 17.947 0.50 82.31 ? 218 ILE B CG1 1 ATOM 4811 C CG1 B ILE B 1 219 ? 52.096 93.935 16.407 0.50 58.64 ? 218 ILE B CG1 1 ATOM 4812 C CG2 A ILE B 1 219 ? 53.866 91.976 17.969 0.50 81.02 ? 218 ILE B CG2 1 ATOM 4813 C CG2 B ILE B 1 219 ? 53.674 92.005 16.377 0.50 56.88 ? 218 ILE B CG2 1 ATOM 4814 C CD1 A ILE B 1 219 ? 51.024 92.186 19.028 0.50 81.90 ? 218 ILE B CD1 1 ATOM 4815 C CD1 B ILE B 1 219 ? 50.672 94.058 15.912 0.50 58.90 ? 218 ILE B CD1 1 ATOM 4816 N N A GLY B 1 220 ? 55.236 92.755 14.873 0.50 72.87 ? 219 GLY B N 1 ATOM 4817 N N B GLY B 1 220 ? 56.174 92.844 14.363 0.50 55.36 ? 219 GLY B N 1 ATOM 4818 C CA A GLY B 1 220 ? 56.112 91.983 13.993 0.50 69.39 ? 219 GLY B CA 1 ATOM 4819 C CA B GLY B 1 220 ? 57.058 91.857 13.764 0.50 54.56 ? 219 GLY B CA 1 ATOM 4820 C C A GLY B 1 220 ? 56.075 90.510 14.351 0.50 65.65 ? 219 GLY B C 1 ATOM 4821 C C B GLY B 1 220 ? 56.649 90.458 14.196 0.50 53.91 ? 219 GLY B C 1 ATOM 4822 O O A GLY B 1 220 ? 55.947 90.165 15.500 0.50 62.82 ? 219 GLY B O 1 ATOM 4823 O O B GLY B 1 220 ? 56.504 90.185 15.390 0.50 51.60 ? 219 GLY B O 1 ATOM 4824 N N A PRO B 1 221 ? 56.198 89.625 13.361 0.50 61.99 ? 220 PRO B N 1 ATOM 4825 N N B PRO B 1 221 ? 56.463 89.551 13.226 0.50 53.66 ? 220 PRO B N 1 ATOM 4826 C CA A PRO B 1 221 ? 56.022 88.191 13.601 0.50 58.59 ? 220 PRO B CA 1 ATOM 4827 C CA B PRO B 1 221 ? 56.073 88.176 13.550 0.50 52.34 ? 220 PRO B CA 1 ATOM 4828 C C A PRO B 1 221 ? 56.994 87.567 14.621 0.50 56.27 ? 220 PRO B C 1 ATOM 4829 C C B PRO B 1 221 ? 57.018 87.500 14.551 0.50 52.55 ? 220 PRO B C 1 ATOM 4830 O O A PRO B 1 221 ? 56.560 86.779 15.455 0.50 54.81 ? 220 PRO B O 1 ATOM 4831 O O B PRO B 1 221 ? 56.597 86.607 15.287 0.50 51.06 ? 220 PRO B O 1 ATOM 4832 C CB A PRO B 1 221 ? 56.240 87.578 12.214 0.50 59.52 ? 220 PRO B CB 1 ATOM 4833 C CB B PRO B 1 221 ? 56.126 87.457 12.191 0.50 52.42 ? 220 PRO B CB 1 ATOM 4834 C CG A PRO B 1 221 ? 57.023 88.599 11.455 0.50 61.19 ? 220 PRO B CG 1 ATOM 4835 C CG B PRO B 1 221 ? 56.920 88.347 11.289 0.50 53.51 ? 220 PRO B CG 1 ATOM 4836 C CD A PRO B 1 221 ? 56.546 89.921 11.965 0.50 61.93 ? 220 PRO B CD 1 ATOM 4837 C CD B PRO B 1 221 ? 56.685 89.743 11.783 0.50 53.95 ? 220 PRO B CD 1 ATOM 4838 N N . LEU B 1 222 ? 58.280 87.918 14.569 1.00 53.72 ? 221 LEU B N 1 ATOM 4839 C CA . LEU B 1 222 ? 59.274 87.337 15.483 1.00 52.75 ? 221 LEU B CA 1 ATOM 4840 C C . LEU B 1 222 ? 59.092 87.823 16.920 1.00 54.11 ? 221 LEU B C 1 ATOM 4841 O O . LEU B 1 222 ? 59.447 87.128 17.876 1.00 55.02 ? 221 LEU B O 1 ATOM 4842 C CB . LEU B 1 222 ? 60.703 87.635 15.028 1.00 52.74 ? 221 LEU B CB 1 ATOM 4843 C CG . LEU B 1 222 ? 61.176 87.040 13.701 1.00 52.73 ? 221 LEU B CG 1 ATOM 4844 C CD1 . LEU B 1 222 ? 62.653 87.340 13.497 1.00 52.76 ? 221 LEU B CD1 1 ATOM 4845 C CD2 . LEU B 1 222 ? 60.927 85.547 13.633 1.00 52.17 ? 221 LEU B CD2 1 ATOM 4846 N N . LYS B 1 223 ? 58.516 89.012 17.069 1.00 56.64 ? 222 LYS B N 1 ATOM 4847 C CA . LYS B 1 223 ? 58.227 89.564 18.392 1.00 58.92 ? 222 LYS B CA 1 ATOM 4848 C C . LYS B 1 223 ? 57.036 88.869 19.003 1.00 56.88 ? 222 LYS B C 1 ATOM 4849 O O . LYS B 1 223 ? 57.119 88.382 20.131 1.00 59.81 ? 222 LYS B O 1 ATOM 4850 C CB . LYS B 1 223 ? 57.986 91.078 18.370 1.00 60.77 ? 222 LYS B CB 1 ATOM 4851 C CG . LYS B 1 223 ? 59.267 91.889 18.475 1.00 63.22 ? 222 LYS B CG 1 ATOM 4852 C CD . LYS B 1 223 ? 59.843 91.822 19.884 1.00 64.57 ? 222 LYS B CD 1 ATOM 4853 C CE . LYS B 1 223 ? 61.357 91.742 19.893 1.00 65.35 ? 222 LYS B CE 1 ATOM 4854 N NZ . LYS B 1 223 ? 61.952 93.079 19.652 1.00 68.64 ? 222 LYS B NZ 1 ATOM 4855 N N . ILE B 1 224 ? 55.930 88.777 18.272 1.00 54.41 ? 223 ILE B N 1 ATOM 4856 C CA . ILE B 1 224 ? 54.728 88.111 18.801 1.00 55.19 ? 223 ILE B CA 1 ATOM 4857 C C . ILE B 1 224 ? 54.913 86.598 18.986 1.00 54.02 ? 223 ILE B C 1 ATOM 4858 O O . ILE B 1 224 ? 54.225 86.001 19.812 1.00 53.47 ? 223 ILE B O 1 ATOM 4859 C CB . ILE B 1 224 ? 53.477 88.381 17.921 1.00 56.51 ? 223 ILE B CB 1 ATOM 4860 C CG1 . ILE B 1 224 ? 52.184 88.104 18.711 1.00 59.92 ? 223 ILE B CG1 1 ATOM 4861 C CG2 . ILE B 1 224 ? 53.518 87.581 16.626 1.00 55.44 ? 223 ILE B CG2 1 ATOM 4862 C CD1 . ILE B 1 224 ? 50.924 88.031 17.865 1.00 64.37 ? 223 ILE B CD1 1 ATOM 4863 N N . ARG B 1 225 ? 55.843 85.995 18.253 1.00 51.36 ? 224 ARG B N 1 ATOM 4864 C CA . ARG B 1 225 ? 56.161 84.569 18.410 1.00 47.56 ? 224 ARG B CA 1 ATOM 4865 C C . ARG B 1 225 ? 56.531 84.241 19.876 1.00 46.97 ? 224 ARG B C 1 ATOM 4866 O O . ARG B 1 225 ? 56.207 83.167 20.391 1.00 46.07 ? 224 ARG B O 1 ATOM 4867 C CB . ARG B 1 225 ? 57.310 84.188 17.481 1.00 45.93 ? 224 ARG B CB 1 ATOM 4868 C CG . ARG B 1 225 ? 57.604 82.705 17.443 1.00 44.09 ? 224 ARG B CG 1 ATOM 4869 C CD . ARG B 1 225 ? 58.758 82.421 16.511 1.00 43.02 ? 224 ARG B CD 1 ATOM 4870 N NE . ARG B 1 225 ? 60.013 82.975 17.000 1.00 42.54 ? 224 ARG B NE 1 ATOM 4871 C CZ . ARG B 1 225 ? 61.171 82.896 16.353 1.00 41.77 ? 224 ARG B CZ 1 ATOM 4872 N NH1 . ARG B 1 225 ? 61.260 82.283 15.187 1.00 43.12 ? 224 ARG B NH1 1 ATOM 4873 N NH2 . ARG B 1 225 ? 62.253 83.426 16.882 1.00 42.00 ? 224 ARG B NH2 1 ATOM 4874 N N . GLU B 1 226 ? 57.189 85.194 20.529 1.00 47.61 ? 225 GLU B N 1 ATOM 4875 C CA . GLU B 1 226 ? 57.573 85.006 21.938 1.00 49.26 ? 225 GLU B CA 1 ATOM 4876 C C . GLU B 1 226 ? 56.377 84.766 22.840 1.00 47.64 ? 225 GLU B C 1 ATOM 4877 O O . GLU B 1 226 ? 56.415 83.863 23.654 1.00 47.87 ? 225 GLU B O 1 ATOM 4878 C CB . GLU B 1 226 ? 58.409 86.178 22.460 1.00 52.40 ? 225 GLU B CB 1 ATOM 4879 C CG . GLU B 1 226 ? 59.837 86.230 21.924 1.00 56.56 ? 225 GLU B CG 1 ATOM 4880 C CD . GLU B 1 226 ? 60.589 87.494 22.346 1.00 61.34 ? 225 GLU B CD 1 ATOM 4881 O OE1 . GLU B 1 226 ? 60.814 87.688 23.567 1.00 67.80 ? 225 GLU B OE1 1 ATOM 4882 O OE2 . GLU B 1 226 ? 60.972 88.292 21.457 1.00 61.18 ? 225 GLU B OE2 1 ATOM 4883 N N . GLN B 1 227 ? 55.292 85.498 22.653 1.00 46.65 ? 226 GLN B N 1 ATOM 4884 C CA . GLN B 1 227 ? 54.066 85.256 23.420 1.00 45.99 ? 226 GLN B CA 1 ATOM 4885 C C . GLN B 1 227 ? 53.407 83.963 23.020 1.00 45.63 ? 226 GLN B C 1 ATOM 4886 O O . GLN B 1 227 ? 52.965 83.185 23.841 1.00 44.76 ? 226 GLN B O 1 ATOM 4887 C CB . GLN B 1 227 ? 53.084 86.393 23.157 1.00 46.68 ? 226 GLN B CB 1 ATOM 4888 C CG . GLN B 1 227 ? 51.793 86.315 23.957 1.00 48.56 ? 226 GLN B CG 1 ATOM 4889 C CD . GLN B 1 227 ? 50.701 85.489 23.306 1.00 48.85 ? 226 GLN B CD 1 ATOM 4890 O OE1 . GLN B 1 227 ? 50.523 85.517 22.090 1.00 51.29 ? 226 GLN B OE1 1 ATOM 4891 N NE2 . GLN B 1 227 ? 49.940 84.762 24.127 1.00 51.28 ? 226 GLN B NE2 1 ATOM 4892 N N . GLN B 1 228 ? 53.339 83.738 21.717 1.00 44.19 ? 227 GLN B N 1 ATOM 4893 C CA . GLN B 1 228 ? 52.603 82.581 21.201 1.00 44.26 ? 227 GLN B CA 1 ATOM 4894 C C . GLN B 1 228 ? 53.237 81.266 21.631 1.00 41.04 ? 227 GLN B C 1 ATOM 4895 O O . GLN B 1 228 ? 52.558 80.343 21.972 1.00 40.18 ? 227 GLN B O 1 ATOM 4896 C CB . GLN B 1 228 ? 52.480 82.675 19.681 1.00 45.80 ? 227 GLN B CB 1 ATOM 4897 C CG . GLN B 1 228 ? 51.600 83.837 19.242 1.00 47.77 ? 227 GLN B CG 1 ATOM 4898 C CD . GLN B 1 228 ? 51.691 84.154 17.758 1.00 50.07 ? 227 GLN B CD 1 ATOM 4899 O OE1 . GLN B 1 228 ? 52.749 84.038 17.130 1.00 50.28 ? 227 GLN B OE1 1 ATOM 4900 N NE2 . GLN B 1 228 ? 50.565 84.532 17.185 1.00 51.76 ? 227 GLN B NE2 1 ATOM 4901 N N . ARG B 1 229 ? 54.572 81.216 21.705 1.00 39.26 ? 228 ARG B N 1 ATOM 4902 C CA . ARG B 1 229 ? 55.265 80.026 22.174 1.00 39.45 ? 228 ARG B CA 1 ATOM 4903 C C . ARG B 1 229 ? 55.005 79.782 23.653 1.00 39.64 ? 228 ARG B C 1 ATOM 4904 O O . ARG B 1 229 ? 54.894 78.617 24.084 1.00 39.95 ? 228 ARG B O 1 ATOM 4905 C CB . ARG B 1 229 ? 56.767 80.159 21.945 1.00 39.22 ? 228 ARG B CB 1 ATOM 4906 C CG . ARG B 1 229 ? 57.166 79.975 20.499 1.00 39.80 ? 228 ARG B CG 1 ATOM 4907 C CD . ARG B 1 229 ? 58.655 80.154 20.334 1.00 41.16 ? 228 ARG B CD 1 ATOM 4908 N NE . ARG B 1 229 ? 59.073 79.838 18.979 1.00 42.35 ? 228 ARG B NE 1 ATOM 4909 C CZ . ARG B 1 229 ? 60.335 79.857 18.563 1.00 43.58 ? 228 ARG B CZ 1 ATOM 4910 N NH1 . ARG B 1 229 ? 61.310 80.169 19.404 1.00 43.13 ? 228 ARG B NH1 1 ATOM 4911 N NH2 . ARG B 1 229 ? 60.622 79.560 17.298 1.00 45.26 ? 228 ARG B NH2 1 ATOM 4912 N N . SER B 1 230 ? 54.948 80.866 24.419 1.00 38.85 ? 229 SER B N 1 ATOM 4913 C CA . SER B 1 230 ? 54.843 80.757 25.874 1.00 39.78 ? 229 SER B CA 1 ATOM 4914 C C . SER B 1 230 ? 53.478 80.258 26.350 1.00 40.74 ? 229 SER B C 1 ATOM 4915 O O . SER B 1 230 ? 53.344 79.720 27.455 1.00 41.21 ? 229 SER B O 1 ATOM 4916 C CB . SER B 1 230 ? 55.195 82.086 26.541 1.00 40.41 ? 229 SER B CB 1 ATOM 4917 O OG . SER B 1 230 ? 54.184 83.058 26.322 1.00 41.92 ? 229 SER B OG 1 ATOM 4918 N N . ALA B 1 231 ? 52.477 80.424 25.482 1.00 40.05 ? 230 ALA B N 1 ATOM 4919 C CA . ALA B 1 231 ? 51.135 79.970 25.754 1.00 40.19 ? 230 ALA B CA 1 ATOM 4920 C C . ALA B 1 231 ? 51.000 78.463 25.520 1.00 41.81 ? 230 ALA B C 1 ATOM 4921 O O . ALA B 1 231 ? 51.109 77.986 24.399 1.00 43.72 ? 230 ALA B O 1 ATOM 4922 C CB . ALA B 1 231 ? 50.142 80.720 24.887 1.00 39.09 ? 230 ALA B CB 1 ATOM 4923 N N . VAL B 1 232 ? 50.704 77.733 26.597 1.00 42.08 ? 231 VAL B N 1 ATOM 4924 C CA . VAL B 1 232 ? 50.502 76.289 26.515 1.00 41.46 ? 231 VAL B CA 1 ATOM 4925 C C . VAL B 1 232 ? 49.420 75.916 25.494 1.00 42.35 ? 231 VAL B C 1 ATOM 4926 O O . VAL B 1 232 ? 49.530 74.900 24.797 1.00 43.90 ? 231 VAL B O 1 ATOM 4927 C CB . VAL B 1 232 ? 50.172 75.671 27.898 1.00 42.23 ? 231 VAL B CB 1 ATOM 4928 C CG1 . VAL B 1 232 ? 50.067 74.156 27.802 1.00 42.67 ? 231 VAL B CG1 1 ATOM 4929 C CG2 . VAL B 1 232 ? 51.233 76.046 28.925 1.00 42.86 ? 231 VAL B CG2 1 ATOM 4930 N N . SER B 1 233 ? 48.395 76.747 25.379 1.00 42.68 ? 232 SER B N 1 ATOM 4931 C CA . SER B 1 233 ? 47.283 76.465 24.468 1.00 42.65 ? 232 SER B CA 1 ATOM 4932 C C . SER B 1 233 ? 47.732 76.350 23.006 1.00 40.77 ? 232 SER B C 1 ATOM 4933 O O . SER B 1 233 ? 47.122 75.622 22.215 1.00 41.39 ? 232 SER B O 1 ATOM 4934 C CB . SER B 1 233 ? 46.214 77.550 24.590 1.00 43.23 ? 232 SER B CB 1 ATOM 4935 O OG . SER B 1 233 ? 46.798 78.847 24.536 1.00 42.85 ? 232 SER B OG 1 ATOM 4936 N N . THR B 1 234 ? 48.813 77.032 22.635 1.00 40.81 ? 233 THR B N 1 ATOM 4937 C CA . THR B 1 234 ? 49.339 76.919 21.264 1.00 41.38 ? 233 THR B CA 1 ATOM 4938 C C . THR B 1 234 ? 49.832 75.494 20.935 1.00 42.61 ? 233 THR B C 1 ATOM 4939 O O . THR B 1 234 ? 49.417 74.898 19.951 1.00 43.19 ? 233 THR B O 1 ATOM 4940 C CB . THR B 1 234 ? 50.502 77.917 20.993 1.00 40.79 ? 233 THR B CB 1 ATOM 4941 O OG1 . THR B 1 234 ? 50.126 79.258 21.346 1.00 40.32 ? 233 THR B OG1 1 ATOM 4942 C CG2 . THR B 1 234 ? 50.899 77.886 19.525 1.00 40.41 ? 233 THR B CG2 1 ATOM 4943 N N . SER B 1 235 ? 50.674 74.930 21.798 1.00 42.43 ? 234 SER B N 1 ATOM 4944 C CA . SER B 1 235 ? 51.175 73.567 21.624 1.00 42.58 ? 234 SER B CA 1 ATOM 4945 C C . SER B 1 235 ? 50.074 72.518 21.750 1.00 42.43 ? 234 SER B C 1 ATOM 4946 O O . SER B 1 235 ? 50.114 71.474 21.107 1.00 43.46 ? 234 SER B O 1 ATOM 4947 C CB . SER B 1 235 ? 52.291 73.269 22.620 1.00 45.00 ? 234 SER B CB 1 ATOM 4948 O OG . SER B 1 235 ? 53.430 74.059 22.329 1.00 47.14 ? 234 SER B OG 1 ATOM 4949 N N . TRP B 1 236 ? 49.106 72.781 22.605 1.00 42.42 ? 235 TRP B N 1 ATOM 4950 C CA . TRP B 1 236 ? 47.934 71.907 22.769 1.00 44.60 ? 235 TRP B CA 1 ATOM 4951 C C . TRP B 1 236 ? 47.179 71.713 21.455 1.00 46.02 ? 235 TRP B C 1 ATOM 4952 O O . TRP B 1 236 ? 46.561 70.666 21.234 1.00 47.05 ? 235 TRP B O 1 ATOM 4953 C CB . TRP B 1 236 ? 46.992 72.542 23.793 1.00 46.14 ? 235 TRP B CB 1 ATOM 4954 C CG . TRP B 1 236 ? 45.770 71.753 24.135 1.00 48.15 ? 235 TRP B CG 1 ATOM 4955 C CD1 . TRP B 1 236 ? 45.679 70.403 24.302 1.00 48.79 ? 235 TRP B CD1 1 ATOM 4956 C CD2 . TRP B 1 236 ? 44.463 72.275 24.395 1.00 49.16 ? 235 TRP B CD2 1 ATOM 4957 N NE1 . TRP B 1 236 ? 44.396 70.050 24.628 1.00 48.98 ? 235 TRP B NE1 1 ATOM 4958 C CE2 . TRP B 1 236 ? 43.626 71.178 24.694 1.00 49.24 ? 235 TRP B CE2 1 ATOM 4959 C CE3 . TRP B 1 236 ? 43.915 73.561 24.389 1.00 48.99 ? 235 TRP B CE3 1 ATOM 4960 C CZ2 . TRP B 1 236 ? 42.271 71.326 24.992 1.00 50.87 ? 235 TRP B CZ2 1 ATOM 4961 C CZ3 . TRP B 1 236 ? 42.565 73.706 24.678 1.00 51.09 ? 235 TRP B CZ3 1 ATOM 4962 C CH2 . TRP B 1 236 ? 41.760 72.593 24.984 1.00 51.92 ? 235 TRP B CH2 1 ATOM 4963 N N . LEU B 1 237 ? 47.198 72.724 20.587 1.00 46.47 ? 236 LEU B N 1 ATOM 4964 C CA . LEU B 1 237 ? 46.464 72.645 19.336 1.00 47.59 ? 236 LEU B CA 1 ATOM 4965 C C . LEU B 1 237 ? 47.249 72.200 18.105 1.00 45.62 ? 236 LEU B C 1 ATOM 4966 O O . LEU B 1 237 ? 46.741 72.301 16.976 1.00 43.24 ? 236 LEU B O 1 ATOM 4967 C CB . LEU B 1 237 ? 45.795 73.989 19.035 1.00 50.70 ? 236 LEU B CB 1 ATOM 4968 C CG . LEU B 1 237 ? 44.641 74.407 19.962 1.00 54.33 ? 236 LEU B CG 1 ATOM 4969 C CD1 . LEU B 1 237 ? 43.885 75.566 19.330 1.00 55.85 ? 236 LEU B CD1 1 ATOM 4970 C CD2 . LEU B 1 237 ? 43.679 73.265 20.270 1.00 55.42 ? 236 LEU B CD2 1 ATOM 4971 N N . LEU B 1 238 ? 48.459 71.672 18.295 1.00 44.48 ? 237 LEU B N 1 ATOM 4972 C CA . LEU B 1 238 ? 49.181 71.010 17.203 1.00 43.95 ? 237 LEU B CA 1 ATOM 4973 C C . LEU B 1 238 ? 48.357 69.826 16.721 1.00 44.73 ? 237 LEU B C 1 ATOM 4974 O O . LEU B 1 238 ? 47.669 69.183 17.524 1.00 44.99 ? 237 LEU B O 1 ATOM 4975 C CB . LEU B 1 238 ? 50.548 70.516 17.667 1.00 44.79 ? 237 LEU B CB 1 ATOM 4976 C CG . LEU B 1 238 ? 51.641 71.583 17.783 1.00 44.91 ? 237 LEU B CG 1 ATOM 4977 C CD1 . LEU B 1 238 ? 52.794 71.069 18.634 1.00 44.97 ? 237 LEU B CD1 1 ATOM 4978 C CD2 . LEU B 1 238 ? 52.149 72.015 16.415 1.00 44.53 ? 237 LEU B CD2 1 ATOM 4979 N N . PRO B 1 239 ? 48.455 69.500 15.416 1.00 44.68 ? 238 PRO B N 1 ATOM 4980 C CA . PRO B 1 239 ? 47.768 68.349 14.858 1.00 45.26 ? 238 PRO B CA 1 ATOM 4981 C C . PRO B 1 239 ? 47.913 67.063 15.656 1.00 46.04 ? 238 PRO B C 1 ATOM 4982 O O . PRO B 1 239 ? 49.000 66.732 16.123 1.00 46.21 ? 238 PRO B O 1 ATOM 4983 C CB . PRO B 1 239 ? 48.432 68.188 13.488 1.00 44.74 ? 238 PRO B CB 1 ATOM 4984 C CG . PRO B 1 239 ? 48.766 69.569 13.092 1.00 43.75 ? 238 PRO B CG 1 ATOM 4985 C CD . PRO B 1 239 ? 49.137 70.277 14.366 1.00 43.43 ? 238 PRO B CD 1 ATOM 4986 N N . TYR B 1 240 ? 46.800 66.338 15.773 1.00 47.94 ? 239 TYR B N 1 ATOM 4987 C CA . TYR B 1 240 ? 46.735 65.044 16.458 1.00 49.94 ? 239 TYR B CA 1 ATOM 4988 C C . TYR B 1 240 ? 46.587 63.892 15.461 1.00 53.16 ? 239 TYR B C 1 ATOM 4989 O O . TYR B 1 240 ? 45.997 64.059 14.396 1.00 54.77 ? 239 TYR B O 1 ATOM 4990 C CB . TYR B 1 240 ? 45.537 65.013 17.406 1.00 50.00 ? 239 TYR B CB 1 ATOM 4991 C CG . TYR B 1 240 ? 45.698 65.848 18.639 1.00 49.28 ? 239 TYR B CG 1 ATOM 4992 C CD1 . TYR B 1 240 ? 45.429 67.218 18.620 1.00 48.52 ? 239 TYR B CD1 1 ATOM 4993 C CD2 . TYR B 1 240 ? 46.103 65.272 19.843 1.00 48.33 ? 239 TYR B CD2 1 ATOM 4994 C CE1 . TYR B 1 240 ? 45.574 67.994 19.764 1.00 47.50 ? 239 TYR B CE1 1 ATOM 4995 C CE2 . TYR B 1 240 ? 46.254 66.043 20.985 1.00 47.71 ? 239 TYR B CE2 1 ATOM 4996 C CZ . TYR B 1 240 ? 45.990 67.400 20.940 1.00 46.74 ? 239 TYR B CZ 1 ATOM 4997 O OH . TYR B 1 240 ? 46.144 68.165 22.067 1.00 46.10 ? 239 TYR B OH 1 ATOM 4998 N N . ASN B 1 241 ? 47.086 62.719 15.829 1.00 56.84 ? 240 ASN B N 1 ATOM 4999 C CA . ASN B 1 241 ? 47.001 61.532 14.970 1.00 60.67 ? 240 ASN B CA 1 ATOM 5000 C C . ASN B 1 241 ? 45.629 60.878 14.837 1.00 61.58 ? 240 ASN B C 1 ATOM 5001 O O . ASN B 1 241 ? 45.455 59.979 14.043 1.00 66.24 ? 240 ASN B O 1 ATOM 5002 C CB . ASN B 1 241 ? 47.975 60.476 15.485 1.00 65.19 ? 240 ASN B CB 1 ATOM 5003 C CG . ASN B 1 241 ? 47.660 60.044 16.907 1.00 70.81 ? 240 ASN B CG 1 ATOM 5004 O OD1 . ASN B 1 241 ? 46.540 60.232 17.397 1.00 74.27 ? 240 ASN B OD1 1 ATOM 5005 N ND2 . ASN B 1 241 ? 48.642 59.457 17.574 1.00 76.54 ? 240 ASN B ND2 1 ATOM 5006 N N . TYR B 1 242 ? 44.644 61.333 15.598 1.00 61.94 ? 241 TYR B N 1 ATOM 5007 C CA . TYR B 1 242 ? 43.288 60.826 15.399 1.00 63.10 ? 241 TYR B CA 1 ATOM 5008 C C . TYR B 1 242 ? 42.542 61.549 14.268 1.00 64.66 ? 241 TYR B C 1 ATOM 5009 O O . TYR B 1 242 ? 41.473 61.114 13.861 1.00 67.32 ? 241 TYR B O 1 ATOM 5010 C CB . TYR B 1 242 ? 42.477 60.832 16.711 1.00 63.39 ? 241 TYR B CB 1 ATOM 5011 C CG . TYR B 1 242 ? 42.303 62.166 17.416 1.00 61.55 ? 241 TYR B CG 1 ATOM 5012 C CD1 . TYR B 1 242 ? 41.359 63.097 16.980 1.00 62.01 ? 241 TYR B CD1 1 ATOM 5013 C CD2 . TYR B 1 242 ? 43.043 62.476 18.556 1.00 59.91 ? 241 TYR B CD2 1 ATOM 5014 C CE1 . TYR B 1 242 ? 41.179 64.311 17.643 1.00 60.35 ? 241 TYR B CE1 1 ATOM 5015 C CE2 . TYR B 1 242 ? 42.869 63.685 19.221 1.00 58.55 ? 241 TYR B CE2 1 ATOM 5016 C CZ . TYR B 1 242 ? 41.935 64.600 18.766 1.00 58.38 ? 241 TYR B CZ 1 ATOM 5017 O OH . TYR B 1 242 ? 41.748 65.803 19.424 1.00 58.58 ? 241 TYR B OH 1 ATOM 5018 N N . THR B 1 243 ? 43.121 62.641 13.777 1.00 62.29 ? 242 THR B N 1 ATOM 5019 C CA . THR B 1 243 ? 42.582 63.402 12.668 1.00 61.90 ? 242 THR B CA 1 ATOM 5020 C C . THR B 1 243 ? 43.494 63.317 11.449 1.00 62.18 ? 242 THR B C 1 ATOM 5021 O O . THR B 1 243 ? 43.025 63.211 10.308 1.00 63.53 ? 242 THR B O 1 ATOM 5022 C CB . THR B 1 243 ? 42.375 64.878 13.067 1.00 61.17 ? 242 THR B CB 1 ATOM 5023 O OG1 . THR B 1 243 ? 41.419 64.954 14.132 1.00 61.85 ? 242 THR B OG1 1 ATOM 5024 C CG2 . THR B 1 243 ? 41.869 65.719 11.889 1.00 61.48 ? 242 THR B CG2 1 ATOM 5025 N N . TRP B 1 244 ? 44.803 63.406 11.683 1.00 59.44 ? 243 TRP B N 1 ATOM 5026 C CA . TRP B 1 244 ? 45.781 63.492 10.606 1.00 58.26 ? 243 TRP B CA 1 ATOM 5027 C C . TRP B 1 244 ? 46.615 62.225 10.522 1.00 57.85 ? 243 TRP B C 1 ATOM 5028 O O . TRP B 1 244 ? 46.791 61.523 11.512 1.00 56.09 ? 243 TRP B O 1 ATOM 5029 C CB . TRP B 1 244 ? 46.727 64.672 10.843 1.00 56.84 ? 243 TRP B CB 1 ATOM 5030 C CG . TRP B 1 244 ? 46.068 66.020 11.041 1.00 55.12 ? 243 TRP B CG 1 ATOM 5031 C CD1 . TRP B 1 244 ? 45.575 66.550 12.211 1.00 54.65 ? 243 TRP B CD1 1 ATOM 5032 C CD2 . TRP B 1 244 ? 45.877 67.017 10.044 1.00 53.92 ? 243 TRP B CD2 1 ATOM 5033 N NE1 . TRP B 1 244 ? 45.082 67.821 11.991 1.00 52.73 ? 243 TRP B NE1 1 ATOM 5034 C CE2 . TRP B 1 244 ? 45.256 68.127 10.669 1.00 53.08 ? 243 TRP B CE2 1 ATOM 5035 C CE3 . TRP B 1 244 ? 46.166 67.078 8.677 1.00 54.51 ? 243 TRP B CE3 1 ATOM 5036 C CZ2 . TRP B 1 244 ? 44.917 69.273 9.976 1.00 54.71 ? 243 TRP B CZ2 1 ATOM 5037 C CZ3 . TRP B 1 244 ? 45.831 68.215 7.986 1.00 56.03 ? 243 TRP B CZ3 1 ATOM 5038 C CH2 . TRP B 1 244 ? 45.209 69.302 8.634 1.00 56.66 ? 243 TRP B CH2 1 ATOM 5039 N N . SER B 1 245 ? 47.141 61.960 9.331 1.00 59.39 ? 244 SER B N 1 ATOM 5040 C CA . SER B 1 245 ? 48.012 60.825 9.091 1.00 60.90 ? 244 SER B CA 1 ATOM 5041 C C . SER B 1 245 ? 49.372 61.041 9.772 1.00 63.30 ? 244 SER B C 1 ATOM 5042 O O . SER B 1 245 ? 49.962 62.118 9.679 1.00 59.29 ? 244 SER B O 1 ATOM 5043 C CB . SER B 1 245 ? 48.227 60.632 7.588 1.00 60.65 ? 244 SER B CB 1 ATOM 5044 O OG . SER B 1 245 ? 49.201 59.634 7.335 1.00 60.02 ? 244 SER B OG 1 ATOM 5045 N N . PRO B 1 246 ? 49.905 60.003 10.432 1.00 67.82 ? 245 PRO B N 1 ATOM 5046 C CA . PRO B 1 246 ? 51.232 60.145 11.028 1.00 67.84 ? 245 PRO B CA 1 ATOM 5047 C C . PRO B 1 246 ? 52.345 60.348 9.999 1.00 65.60 ? 245 PRO B C 1 ATOM 5048 O O . PRO B 1 246 ? 53.438 60.761 10.358 1.00 64.86 ? 245 PRO B O 1 ATOM 5049 C CB . PRO B 1 246 ? 51.423 58.822 11.776 1.00 70.76 ? 245 PRO B CB 1 ATOM 5050 C CG . PRO B 1 246 ? 50.037 58.347 12.065 1.00 71.95 ? 245 PRO B CG 1 ATOM 5051 C CD . PRO B 1 246 ? 49.255 58.745 10.847 1.00 71.27 ? 245 PRO B CD 1 ATOM 5052 N N . GLU B 1 247 ? 52.072 60.088 8.727 1.00 65.57 ? 246 GLU B N 1 ATOM 5053 C CA . GLU B 1 247 ? 53.046 60.331 7.673 1.00 66.61 ? 246 GLU B CA 1 ATOM 5054 C C . GLU B 1 247 ? 52.923 61.703 6.953 1.00 61.30 ? 246 GLU B C 1 ATOM 5055 O O . GLU B 1 247 ? 53.763 62.024 6.132 1.00 61.17 ? 246 GLU B O 1 ATOM 5056 C CB . GLU B 1 247 ? 52.941 59.225 6.601 1.00 72.60 ? 246 GLU B CB 1 ATOM 5057 C CG . GLU B 1 247 ? 52.989 57.775 7.082 1.00 80.13 ? 246 GLU B CG 1 ATOM 5058 C CD . GLU B 1 247 ? 51.999 56.859 6.342 1.00 88.20 ? 246 GLU B CD 1 ATOM 5059 O OE1 . GLU B 1 247 ? 50.969 56.415 6.928 1.00 92.26 ? 246 GLU B OE1 1 ATOM 5060 O OE2 . GLU B 1 247 ? 52.252 56.573 5.152 1.00 90.22 ? 246 GLU B OE2 1 ATOM 5061 N N . LYS B 1 248 ? 51.908 62.487 7.264 1.00 57.10 ? 247 LYS B N 1 ATOM 5062 C CA . LYS B 1 248 ? 51.759 63.784 6.632 1.00 54.44 ? 247 LYS B CA 1 ATOM 5063 C C . LYS B 1 248 ? 52.891 64.731 7.059 1.00 51.77 ? 247 LYS B C 1 ATOM 5064 O O . LYS B 1 248 ? 53.114 64.937 8.235 1.00 50.89 ? 247 LYS B O 1 ATOM 5065 C CB . LYS B 1 248 ? 50.392 64.349 7.046 1.00 54.43 ? 247 LYS B CB 1 ATOM 5066 C CG . LYS B 1 248 ? 50.196 65.837 6.866 1.00 55.17 ? 247 LYS B CG 1 ATOM 5067 C CD . LYS B 1 248 ? 49.638 66.158 5.509 1.00 57.08 ? 247 LYS B CD 1 ATOM 5068 C CE . LYS B 1 248 ? 49.455 67.651 5.343 1.00 58.33 ? 247 LYS B CE 1 ATOM 5069 N NZ . LYS B 1 248 ? 49.399 67.987 3.889 1.00 61.26 ? 247 LYS B NZ 1 ATOM 5070 N N . VAL B 1 249 ? 53.576 65.329 6.093 1.00 49.37 ? 248 VAL B N 1 ATOM 5071 C CA . VAL B 1 249 ? 54.607 66.319 6.368 1.00 46.98 ? 248 VAL B CA 1 ATOM 5072 C C . VAL B 1 249 ? 53.966 67.692 6.478 1.00 46.71 ? 248 VAL B C 1 ATOM 5073 O O . VAL B 1 249 ? 53.367 68.155 5.532 1.00 47.47 ? 248 VAL B O 1 ATOM 5074 C CB . VAL B 1 249 ? 55.660 66.358 5.248 1.00 48.47 ? 248 VAL B CB 1 ATOM 5075 C CG1 . VAL B 1 249 ? 56.704 67.433 5.537 1.00 48.39 ? 248 VAL B CG1 1 ATOM 5076 C CG2 . VAL B 1 249 ? 56.298 64.984 5.079 1.00 48.95 ? 248 VAL B CG2 1 ATOM 5077 N N . PHE B 1 250 ? 54.073 68.318 7.650 1.00 45.34 ? 249 PHE B N 1 ATOM 5078 C CA . PHE B 1 250 ? 53.525 69.654 7.902 1.00 44.04 ? 249 PHE B CA 1 ATOM 5079 C C . PHE B 1 250 ? 54.537 70.749 7.627 1.00 42.53 ? 249 PHE B C 1 ATOM 5080 O O . PHE B 1 250 ? 54.158 71.856 7.246 1.00 40.94 ? 249 PHE B O 1 ATOM 5081 C CB . PHE B 1 250 ? 53.038 69.775 9.353 1.00 44.15 ? 249 PHE B CB 1 ATOM 5082 C CG . PHE B 1 250 ? 51.792 68.997 9.635 1.00 45.03 ? 249 PHE B CG 1 ATOM 5083 C CD1 . PHE B 1 250 ? 50.554 69.474 9.223 1.00 45.16 ? 249 PHE B CD1 1 ATOM 5084 C CD2 . PHE B 1 250 ? 51.852 67.785 10.315 1.00 46.21 ? 249 PHE B CD2 1 ATOM 5085 C CE1 . PHE B 1 250 ? 49.395 68.757 9.481 1.00 45.75 ? 249 PHE B CE1 1 ATOM 5086 C CE2 . PHE B 1 250 ? 50.696 67.068 10.576 1.00 46.66 ? 249 PHE B CE2 1 ATOM 5087 C CZ . PHE B 1 250 ? 49.467 67.554 10.158 1.00 46.04 ? 249 PHE B CZ 1 ATOM 5088 N N . VAL B 1 251 ? 55.814 70.460 7.883 1.00 42.49 ? 250 VAL B N 1 ATOM 5089 C CA . VAL B 1 251 ? 56.875 71.434 7.686 1.00 41.72 ? 250 VAL B CA 1 ATOM 5090 C C . VAL B 1 251 ? 58.027 70.770 6.951 1.00 43.31 ? 250 VAL B C 1 ATOM 5091 O O . VAL B 1 251 ? 58.554 69.720 7.349 1.00 42.23 ? 250 VAL B O 1 ATOM 5092 C CB . VAL B 1 251 ? 57.417 71.983 9.009 1.00 41.21 ? 250 VAL B CB 1 ATOM 5093 C CG1 . VAL B 1 251 ? 58.627 72.870 8.748 1.00 42.02 ? 250 VAL B CG1 1 ATOM 5094 C CG2 . VAL B 1 251 ? 56.345 72.762 9.747 1.00 41.33 ? 250 VAL B CG2 1 ATOM 5095 N N . GLN B 1 252 ? 58.421 71.387 5.851 1.00 45.51 ? 251 GLN B N 1 ATOM 5096 C CA . GLN B 1 252 ? 59.564 70.944 5.078 1.00 47.98 ? 251 GLN B CA 1 ATOM 5097 C C . GLN B 1 252 ? 60.592 72.068 5.032 1.00 47.95 ? 251 GLN B C 1 ATOM 5098 O O . GLN B 1 252 ? 60.253 73.233 4.886 1.00 48.60 ? 251 GLN B O 1 ATOM 5099 C CB . GLN B 1 252 ? 59.071 70.610 3.679 1.00 49.66 ? 251 GLN B CB 1 ATOM 5100 C CG . GLN B 1 252 ? 60.058 69.836 2.834 1.00 54.18 ? 251 GLN B CG 1 ATOM 5101 C CD . GLN B 1 252 ? 59.476 69.454 1.475 1.00 55.27 ? 251 GLN B CD 1 ATOM 5102 O OE1 . GLN B 1 252 ? 58.259 69.543 1.233 1.00 53.16 ? 251 GLN B OE1 1 ATOM 5103 N NE2 . GLN B 1 252 ? 60.346 69.013 0.585 1.00 56.82 ? 251 GLN B NE2 1 ATOM 5104 N N . THR B 1 253 ? 61.861 71.689 5.129 1.00 48.50 ? 252 THR B N 1 ATOM 5105 C CA . THR B 1 253 ? 62.984 72.603 5.010 1.00 49.08 ? 252 THR B CA 1 ATOM 5106 C C . THR B 1 253 ? 63.955 71.970 4.015 1.00 51.26 ? 252 THR B C 1 ATOM 5107 O O . THR B 1 253 ? 63.728 70.820 3.590 1.00 52.80 ? 252 THR B O 1 ATOM 5108 C CB . THR B 1 253 ? 63.706 72.769 6.364 1.00 49.00 ? 252 THR B CB 1 ATOM 5109 O OG1 . THR B 1 253 ? 64.459 71.583 6.679 1.00 48.98 ? 252 THR B OG1 1 ATOM 5110 C CG2 . THR B 1 253 ? 62.696 73.027 7.472 1.00 47.84 ? 252 THR B CG2 1 ATOM 5111 N N . PRO B 1 254 ? 65.035 72.682 3.650 1.00 53.39 ? 253 PRO B N 1 ATOM 5112 C CA . PRO B 1 254 ? 65.973 72.045 2.693 1.00 55.39 ? 253 PRO B CA 1 ATOM 5113 C C . PRO B 1 254 ? 66.661 70.778 3.215 1.00 56.59 ? 253 PRO B C 1 ATOM 5114 O O . PRO B 1 254 ? 67.114 69.978 2.406 1.00 59.08 ? 253 PRO B O 1 ATOM 5115 C CB . PRO B 1 254 ? 66.986 73.160 2.394 1.00 55.36 ? 253 PRO B CB 1 ATOM 5116 C CG . PRO B 1 254 ? 66.310 74.426 2.829 1.00 53.73 ? 253 PRO B CG 1 ATOM 5117 C CD . PRO B 1 254 ? 65.485 74.034 4.018 1.00 52.61 ? 253 PRO B CD 1 ATOM 5118 N N . THR B 1 255 ? 66.734 70.593 4.534 1.00 58.41 ? 254 THR B N 1 ATOM 5119 C CA . THR B 1 255 ? 67.489 69.481 5.107 1.00 60.49 ? 254 THR B CA 1 ATOM 5120 C C . THR B 1 255 ? 66.684 68.483 5.930 1.00 60.66 ? 254 THR B C 1 ATOM 5121 O O . THR B 1 255 ? 67.217 67.449 6.306 1.00 65.13 ? 254 THR B O 1 ATOM 5122 C CB . THR B 1 255 ? 68.613 69.990 6.040 1.00 60.50 ? 254 THR B CB 1 ATOM 5123 O OG1 . THR B 1 255 ? 68.041 70.590 7.206 1.00 58.46 ? 254 THR B OG1 1 ATOM 5124 C CG2 . THR B 1 255 ? 69.503 71.004 5.334 1.00 62.34 ? 254 THR B CG2 1 ATOM 5125 N N . ILE B 1 256 ? 65.438 68.772 6.228 1.00 57.98 ? 255 ILE B N 1 ATOM 5126 C CA . ILE B 1 256 ? 64.679 67.903 7.124 1.00 55.21 ? 255 ILE B CA 1 ATOM 5127 C C . ILE B 1 256 ? 63.174 68.206 7.012 1.00 51.88 ? 255 ILE B C 1 ATOM 5128 O O . ILE B 1 256 ? 62.765 69.332 6.689 1.00 49.26 ? 255 ILE B O 1 ATOM 5129 C CB . ILE B 1 256 ? 65.177 68.065 8.594 1.00 56.50 ? 255 ILE B CB 1 ATOM 5130 C CG1 . ILE B 1 256 ? 64.317 67.302 9.612 1.00 55.87 ? 255 ILE B CG1 1 ATOM 5131 C CG2 . ILE B 1 256 ? 65.198 69.531 9.012 1.00 56.70 ? 255 ILE B CG2 1 ATOM 5132 C CD1 . ILE B 1 256 ? 64.879 67.332 11.012 1.00 54.58 ? 255 ILE B CD1 1 ATOM 5133 N N . ASN B 1 257 ? 62.339 67.202 7.237 1.00 52.24 ? 256 ASN B N 1 ATOM 5134 C CA . ASN B 1 257 ? 60.935 67.522 7.451 1.00 51.83 ? 256 ASN B CA 1 ATOM 5135 C C . ASN B 1 257 ? 60.312 66.975 8.722 1.00 47.78 ? 256 ASN B C 1 ATOM 5136 O O . ASN B 1 257 ? 60.832 66.087 9.387 1.00 49.08 ? 256 ASN B O 1 ATOM 5137 C CB . ASN B 1 257 ? 60.022 67.298 6.227 1.00 55.27 ? 256 ASN B CB 1 ATOM 5138 C CG . ASN B 1 257 ? 60.468 66.197 5.303 1.00 59.92 ? 256 ASN B CG 1 ATOM 5139 O OD1 . ASN B 1 257 ? 60.926 66.481 4.186 1.00 66.56 ? 256 ASN B OD1 1 ATOM 5140 N ND2 . ASN B 1 257 ? 60.232 64.942 5.689 1.00 63.59 ? 256 ASN B ND2 1 ATOM 5141 N N . TYR B 1 258 ? 59.186 67.577 9.056 1.00 44.64 ? 257 TYR B N 1 ATOM 5142 C CA . TYR B 1 258 ? 58.477 67.296 10.299 1.00 43.26 ? 257 TYR B CA 1 ATOM 5143 C C . TYR B 1 258 ? 57.052 66.860 10.040 1.00 42.03 ? 257 TYR B C 1 ATOM 5144 O O . TYR B 1 258 ? 56.252 67.571 9.426 1.00 40.88 ? 257 TYR B O 1 ATOM 5145 C CB . TYR B 1 258 ? 58.486 68.559 11.159 1.00 41.98 ? 257 TYR B CB 1 ATOM 5146 C CG . TYR B 1 258 ? 59.876 69.107 11.382 1.00 42.15 ? 257 TYR B CG 1 ATOM 5147 C CD1 . TYR B 1 258 ? 60.646 68.687 12.466 1.00 42.00 ? 257 TYR B CD1 1 ATOM 5148 C CD2 . TYR B 1 258 ? 60.433 70.039 10.493 1.00 41.81 ? 257 TYR B CD2 1 ATOM 5149 C CE1 . TYR B 1 258 ? 61.927 69.192 12.673 1.00 42.04 ? 257 TYR B CE1 1 ATOM 5150 C CE2 . TYR B 1 258 ? 61.711 70.544 10.688 1.00 42.00 ? 257 TYR B CE2 1 ATOM 5151 C CZ . TYR B 1 258 ? 62.455 70.119 11.781 1.00 42.61 ? 257 TYR B CZ 1 ATOM 5152 O OH . TYR B 1 258 ? 63.725 70.621 11.979 1.00 43.53 ? 257 TYR B OH 1 ATOM 5153 N N . THR B 1 259 ? 56.748 65.662 10.569 1.00 42.17 ? 258 THR B N 1 ATOM 5154 C CA . THR B 1 259 ? 55.390 65.116 10.720 1.00 42.29 ? 258 THR B CA 1 ATOM 5155 C C . THR B 1 259 ? 54.943 65.252 12.169 1.00 41.47 ? 258 THR B C 1 ATOM 5156 O O . THR B 1 259 ? 55.703 65.702 13.016 1.00 41.33 ? 258 THR B O 1 ATOM 5157 C CB . THR B 1 259 ? 55.352 63.602 10.383 1.00 42.80 ? 258 THR B CB 1 ATOM 5158 O OG1 . THR B 1 259 ? 55.937 62.864 11.460 1.00 42.40 ? 258 THR B OG1 1 ATOM 5159 C CG2 . THR B 1 259 ? 56.101 63.287 9.085 1.00 42.58 ? 258 THR B CG2 1 ATOM 5160 N N . LEU B 1 260 ? 53.729 64.814 12.485 1.00 42.49 ? 259 LEU B N 1 ATOM 5161 C CA . LEU B 1 260 ? 53.253 64.868 13.869 1.00 41.95 ? 259 LEU B CA 1 ATOM 5162 C C . LEU B 1 260 ? 53.983 63.887 14.793 1.00 41.65 ? 259 LEU B C 1 ATOM 5163 O O . LEU B 1 260 ? 53.831 63.956 16.028 1.00 42.48 ? 259 LEU B O 1 ATOM 5164 C CB . LEU B 1 260 ? 51.733 64.667 13.949 1.00 43.27 ? 259 LEU B CB 1 ATOM 5165 C CG . LEU B 1 260 ? 51.157 63.309 13.557 1.00 45.14 ? 259 LEU B CG 1 ATOM 5166 C CD1 . LEU B 1 260 ? 51.159 62.331 14.731 1.00 46.31 ? 259 LEU B CD1 1 ATOM 5167 C CD2 . LEU B 1 260 ? 49.740 63.524 13.052 1.00 45.91 ? 259 LEU B CD2 1 ATOM 5168 N N . ARG B 1 261 ? 54.768 62.982 14.215 1.00 40.61 ? 260 ARG B N 1 ATOM 5169 C CA . ARG B 1 261 ? 55.628 62.116 15.034 1.00 40.92 ? 260 ARG B CA 1 ATOM 5170 C C . ARG B 1 261 ? 56.988 62.738 15.319 1.00 41.12 ? 260 ARG B C 1 ATOM 5171 O O . ARG B 1 261 ? 57.840 62.115 15.978 1.00 42.47 ? 260 ARG B O 1 ATOM 5172 C CB . ARG B 1 261 ? 55.830 60.753 14.368 1.00 41.68 ? 260 ARG B CB 1 ATOM 5173 C CG . ARG B 1 261 ? 54.525 60.020 14.124 1.00 42.67 ? 260 ARG B CG 1 ATOM 5174 C CD . ARG B 1 261 ? 54.706 58.513 14.072 1.00 43.66 ? 260 ARG B CD 1 ATOM 5175 N NE . ARG B 1 261 ? 55.473 58.114 12.901 1.00 44.81 ? 260 ARG B NE 1 ATOM 5176 C CZ . ARG B 1 261 ? 56.037 56.920 12.727 1.00 46.23 ? 260 ARG B CZ 1 ATOM 5177 N NH1 . ARG B 1 261 ? 55.941 55.975 13.655 1.00 47.60 ? 260 ARG B NH1 1 ATOM 5178 N NH2 . ARG B 1 261 ? 56.720 56.680 11.619 1.00 46.75 ? 260 ARG B NH2 1 ATOM 5179 N N . ASP B 1 262 ? 57.193 63.972 14.872 1.00 39.73 ? 261 ASP B N 1 ATOM 5180 C CA . ASP B 1 262 ? 58.506 64.627 14.963 1.00 39.78 ? 261 ASP B CA 1 ATOM 5181 C C . ASP B 1 262 ? 58.495 65.907 15.780 1.00 38.97 ? 261 ASP B C 1 ATOM 5182 O O . ASP B 1 262 ? 59.385 66.766 15.615 1.00 38.10 ? 261 ASP B O 1 ATOM 5183 C CB . ASP B 1 262 ? 59.045 64.938 13.555 1.00 39.36 ? 261 ASP B CB 1 ATOM 5184 C CG . ASP B 1 262 ? 59.174 63.705 12.682 1.00 40.36 ? 261 ASP B CG 1 ATOM 5185 O OD1 . ASP B 1 262 ? 59.838 62.733 13.109 1.00 40.24 ? 261 ASP B OD1 1 ATOM 5186 O OD2 . ASP B 1 262 ? 58.635 63.723 11.543 1.00 41.71 ? 261 ASP B OD2 1 ATOM 5187 N N . TYR B 1 263 ? 57.530 66.055 16.691 1.00 39.29 ? 262 TYR B N 1 ATOM 5188 C CA . TYR B 1 263 ? 57.416 67.300 17.446 1.00 39.24 ? 262 TYR B CA 1 ATOM 5189 C C . TYR B 1 263 ? 58.620 67.557 18.350 1.00 39.82 ? 262 TYR B C 1 ATOM 5190 O O . TYR B 1 263 ? 59.020 68.704 18.526 1.00 39.95 ? 262 TYR B O 1 ATOM 5191 C CB . TYR B 1 263 ? 56.105 67.393 18.268 1.00 39.24 ? 262 TYR B CB 1 ATOM 5192 C CG . TYR B 1 263 ? 54.822 67.507 17.451 1.00 40.35 ? 262 TYR B CG 1 ATOM 5193 C CD1 . TYR B 1 263 ? 54.779 68.230 16.257 1.00 40.17 ? 262 TYR B CD1 1 ATOM 5194 C CD2 . TYR B 1 263 ? 53.640 66.899 17.883 1.00 41.87 ? 262 TYR B CD2 1 ATOM 5195 C CE1 . TYR B 1 263 ? 53.609 68.329 15.521 1.00 40.77 ? 262 TYR B CE1 1 ATOM 5196 C CE2 . TYR B 1 263 ? 52.464 66.990 17.144 1.00 41.87 ? 262 TYR B CE2 1 ATOM 5197 C CZ . TYR B 1 263 ? 52.455 67.710 15.964 1.00 41.96 ? 262 TYR B CZ 1 ATOM 5198 O OH . TYR B 1 263 ? 51.292 67.813 15.216 1.00 43.26 ? 262 TYR B OH 1 ATOM 5199 N N . ARG B 1 264 ? 59.209 66.525 18.939 1.00 41.78 ? 263 ARG B N 1 ATOM 5200 C CA . ARG B 1 264 ? 60.382 66.739 19.777 1.00 43.28 ? 263 ARG B CA 1 ATOM 5201 C C . ARG B 1 264 ? 61.530 67.362 18.975 1.00 42.42 ? 263 ARG B C 1 ATOM 5202 O O . ARG B 1 264 ? 62.111 68.342 19.413 1.00 44.02 ? 263 ARG B O 1 ATOM 5203 C CB . ARG B 1 264 ? 60.838 65.462 20.455 1.00 46.60 ? 263 ARG B CB 1 ATOM 5204 C CG . ARG B 1 264 ? 61.850 65.782 21.524 1.00 49.66 ? 263 ARG B CG 1 ATOM 5205 C CD . ARG B 1 264 ? 62.327 64.564 22.265 1.00 54.49 ? 263 ARG B CD 1 ATOM 5206 N NE . ARG B 1 264 ? 63.373 64.968 23.196 1.00 58.96 ? 263 ARG B NE 1 ATOM 5207 C CZ . ARG B 1 264 ? 64.192 64.135 23.823 1.00 64.46 ? 263 ARG B CZ 1 ATOM 5208 N NH1 . ARG B 1 264 ? 64.100 62.822 23.626 1.00 67.98 ? 263 ARG B NH1 1 ATOM 5209 N NH2 . ARG B 1 264 ? 65.110 64.620 24.651 1.00 66.64 ? 263 ARG B NH2 1 ATOM 5210 N N . LYS B 1 265 ? 61.809 66.834 17.789 1.00 41.44 ? 264 LYS B N 1 ATOM 5211 C CA . LYS B 1 265 ? 62.818 67.398 16.861 1.00 40.98 ? 264 LYS B CA 1 ATOM 5212 C C . LYS B 1 265 ? 62.472 68.828 16.467 1.00 39.67 ? 264 LYS B C 1 ATOM 5213 O O . LYS B 1 265 ? 63.346 69.696 16.404 1.00 39.60 ? 264 LYS B O 1 ATOM 5214 C CB . LYS B 1 265 ? 62.891 66.605 15.560 1.00 41.05 ? 264 LYS B CB 1 ATOM 5215 C CG . LYS B 1 265 ? 63.587 65.279 15.662 1.00 42.52 ? 264 LYS B CG 1 ATOM 5216 C CD . LYS B 1 265 ? 64.071 64.823 14.288 1.00 43.92 ? 264 LYS B CD 1 ATOM 5217 C CE . LYS B 1 265 ? 62.943 64.694 13.280 1.00 42.64 ? 264 LYS B CE 1 ATOM 5218 N NZ . LYS B 1 265 ? 63.353 63.778 12.188 1.00 43.89 ? 264 LYS B NZ 1 ATOM 5219 N N . PHE B 1 266 ? 61.202 69.041 16.127 1.00 38.87 ? 265 PHE B N 1 ATOM 5220 C CA . PHE B 1 266 ? 60.701 70.347 15.712 1.00 39.49 ? 265 PHE B CA 1 ATOM 5221 C C . PHE B 1 266 ? 60.985 71.404 16.779 1.00 39.84 ? 265 PHE B C 1 ATOM 5222 O O . PHE B 1 266 ? 61.553 72.463 16.507 1.00 38.77 ? 265 PHE B O 1 ATOM 5223 C CB . PHE B 1 266 ? 59.191 70.253 15.456 1.00 40.03 ? 265 PHE B CB 1 ATOM 5224 C CG . PHE B 1 266 ? 58.549 71.552 15.067 1.00 41.14 ? 265 PHE B CG 1 ATOM 5225 C CD1 . PHE B 1 266 ? 58.775 72.097 13.820 1.00 42.36 ? 265 PHE B CD1 1 ATOM 5226 C CD2 . PHE B 1 266 ? 57.686 72.215 15.935 1.00 42.06 ? 265 PHE B CD2 1 ATOM 5227 C CE1 . PHE B 1 266 ? 58.182 73.291 13.446 1.00 42.92 ? 265 PHE B CE1 1 ATOM 5228 C CE2 . PHE B 1 266 ? 57.086 73.408 15.567 1.00 42.02 ? 265 PHE B CE2 1 ATOM 5229 C CZ . PHE B 1 266 ? 57.339 73.949 14.317 1.00 42.28 ? 265 PHE B CZ 1 ATOM 5230 N N . PHE B 1 267 ? 60.621 71.082 18.011 1.00 41.06 ? 266 PHE B N 1 ATOM 5231 C CA . PHE B 1 267 ? 60.840 72.026 19.109 1.00 40.60 ? 266 PHE B CA 1 ATOM 5232 C C . PHE B 1 267 ? 62.318 72.244 19.404 1.00 43.46 ? 266 PHE B C 1 ATOM 5233 O O . PHE B 1 267 ? 62.716 73.367 19.697 1.00 44.96 ? 266 PHE B O 1 ATOM 5234 C CB . PHE B 1 267 ? 60.113 71.567 20.379 1.00 39.29 ? 266 PHE B CB 1 ATOM 5235 C CG . PHE B 1 267 ? 58.624 71.845 20.367 1.00 37.91 ? 266 PHE B CG 1 ATOM 5236 C CD1 . PHE B 1 267 ? 58.144 73.146 20.360 1.00 36.71 ? 266 PHE B CD1 1 ATOM 5237 C CD2 . PHE B 1 267 ? 57.703 70.808 20.377 1.00 37.44 ? 266 PHE B CD2 1 ATOM 5238 C CE1 . PHE B 1 267 ? 56.778 73.402 20.356 1.00 36.01 ? 266 PHE B CE1 1 ATOM 5239 C CE2 . PHE B 1 267 ? 56.337 71.059 20.368 1.00 36.58 ? 266 PHE B CE2 1 ATOM 5240 C CZ . PHE B 1 267 ? 55.874 72.358 20.358 1.00 35.73 ? 266 PHE B CZ 1 ATOM 5241 N N . GLN B 1 268 ? 63.138 71.210 19.314 1.00 46.05 ? 267 GLN B N 1 ATOM 5242 C CA . GLN B 1 268 ? 64.574 71.394 19.415 1.00 49.92 ? 267 GLN B CA 1 ATOM 5243 C C . GLN B 1 268 ? 65.092 72.327 18.329 1.00 49.16 ? 267 GLN B C 1 ATOM 5244 O O . GLN B 1 268 ? 65.878 73.232 18.596 1.00 49.41 ? 267 GLN B O 1 ATOM 5245 C CB . GLN B 1 268 ? 65.333 70.076 19.306 1.00 55.96 ? 267 GLN B CB 1 ATOM 5246 C CG . GLN B 1 268 ? 65.452 69.331 20.617 1.00 63.66 ? 267 GLN B CG 1 ATOM 5247 C CD . GLN B 1 268 ? 66.020 67.931 20.460 1.00 70.85 ? 267 GLN B CD 1 ATOM 5248 O OE1 . GLN B 1 268 ? 65.530 66.986 21.084 1.00 78.26 ? 267 GLN B OE1 1 ATOM 5249 N NE2 . GLN B 1 268 ? 67.061 67.788 19.635 1.00 71.95 ? 267 GLN B NE2 1 ATOM 5250 N N . ASP B 1 269 ? 64.640 72.108 17.092 1.00 47.52 ? 268 ASP B N 1 ATOM 5251 C CA . ASP B 1 269 ? 65.205 72.801 15.946 1.00 46.23 ? 268 ASP B CA 1 ATOM 5252 C C . ASP B 1 269 ? 64.742 74.265 15.817 1.00 46.67 ? 268 ASP B C 1 ATOM 5253 O O . ASP B 1 269 ? 65.445 75.042 15.192 1.00 47.74 ? 268 ASP B O 1 ATOM 5254 C CB . ASP B 1 269 ? 64.932 72.039 14.651 1.00 44.06 ? 268 ASP B CB 1 ATOM 5255 C CG . ASP B 1 269 ? 65.668 70.718 14.584 1.00 44.32 ? 268 ASP B CG 1 ATOM 5256 O OD1 . ASP B 1 269 ? 66.576 70.470 15.405 1.00 45.05 ? 268 ASP B OD1 1 ATOM 5257 O OD2 . ASP B 1 269 ? 65.323 69.903 13.711 1.00 42.52 ? 268 ASP B OD2 1 ATOM 5258 N N . ILE B 1 270 ? 63.586 74.615 16.383 1.00 46.37 ? 269 ILE B N 1 ATOM 5259 C CA . ILE B 1 270 ? 63.193 75.989 16.419 1.00 46.85 ? 269 ILE B CA 1 ATOM 5260 C C . ILE B 1 270 ? 63.713 76.737 17.655 1.00 47.61 ? 269 ILE B C 1 ATOM 5261 O O . ILE B 1 270 ? 63.483 77.926 17.802 1.00 49.41 ? 269 ILE B O 1 ATOM 5262 C CB . ILE B 1 270 ? 61.664 76.181 16.290 1.00 46.66 ? 269 ILE B CB 1 ATOM 5263 C CG1 . ILE B 1 270 ? 60.926 75.661 17.534 1.00 47.31 ? 269 ILE B CG1 1 ATOM 5264 C CG2 . ILE B 1 270 ? 61.152 75.529 15.013 1.00 47.47 ? 269 ILE B CG2 1 ATOM 5265 C CD1 . ILE B 1 270 ? 59.418 75.778 17.434 1.00 47.41 ? 269 ILE B CD1 1 ATOM 5266 N N . GLY B 1 271 ? 64.376 76.023 18.556 1.00 47.50 ? 270 GLY B N 1 ATOM 5267 C CA . GLY B 1 271 ? 64.973 76.629 19.733 1.00 48.27 ? 270 GLY B CA 1 ATOM 5268 C C . GLY B 1 271 ? 63.965 76.826 20.856 1.00 49.46 ? 270 GLY B C 1 ATOM 5269 O O . GLY B 1 271 ? 64.089 77.785 21.601 1.00 53.75 ? 270 GLY B O 1 ATOM 5270 N N . PHE B 1 272 ? 62.986 75.940 20.988 1.00 47.99 ? 271 PHE B N 1 ATOM 5271 C CA . PHE B 1 272 ? 61.996 76.046 22.025 1.00 45.97 ? 271 PHE B CA 1 ATOM 5272 C C . PHE B 1 272 ? 61.634 74.691 22.641 1.00 46.76 ? 271 PHE B C 1 ATOM 5273 O O . PHE B 1 272 ? 60.517 74.158 22.439 1.00 44.02 ? 271 PHE B O 1 ATOM 5274 C CB . PHE B 1 272 ? 60.758 76.743 21.465 1.00 45.40 ? 271 PHE B CB 1 ATOM 5275 C CG . PHE B 1 272 ? 59.723 77.041 22.496 1.00 44.28 ? 271 PHE B CG 1 ATOM 5276 C CD1 . PHE B 1 272 ? 60.044 77.818 23.605 1.00 45.00 ? 271 PHE B CD1 1 ATOM 5277 C CD2 . PHE B 1 272 ? 58.436 76.546 22.367 1.00 43.42 ? 271 PHE B CD2 1 ATOM 5278 C CE1 . PHE B 1 272 ? 59.097 78.104 24.563 1.00 45.02 ? 271 PHE B CE1 1 ATOM 5279 C CE2 . PHE B 1 272 ? 57.484 76.822 23.327 1.00 44.66 ? 271 PHE B CE2 1 ATOM 5280 C CZ . PHE B 1 272 ? 57.818 77.600 24.430 1.00 45.09 ? 271 PHE B CZ 1 ATOM 5281 N N . GLU B 1 273 ? 62.573 74.130 23.395 1.00 51.50 ? 272 GLU B N 1 ATOM 5282 C CA . GLU B 1 273 ? 62.385 72.775 23.939 1.00 54.18 ? 272 GLU B CA 1 ATOM 5283 C C . GLU B 1 273 ? 61.227 72.665 24.942 1.00 52.03 ? 272 GLU B C 1 ATOM 5284 O O . GLU B 1 273 ? 60.612 71.611 25.039 1.00 53.28 ? 272 GLU B O 1 ATOM 5285 C CB . GLU B 1 273 ? 63.690 72.229 24.529 1.00 57.91 ? 272 GLU B CB 1 ATOM 5286 C CG . GLU B 1 273 ? 64.761 72.007 23.463 1.00 63.70 ? 272 GLU B CG 1 ATOM 5287 C CD . GLU B 1 273 ? 65.837 71.006 23.862 1.00 70.88 ? 272 GLU B CD 1 ATOM 5288 O OE1 . GLU B 1 273 ? 65.499 69.891 24.331 1.00 76.35 ? 272 GLU B OE1 1 ATOM 5289 O OE2 . GLU B 1 273 ? 67.032 71.324 23.678 1.00 73.41 ? 272 GLU B OE2 1 ATOM 5290 N N . ASP B 1 274 ? 60.916 73.750 25.639 1.00 50.01 ? 273 ASP B N 1 ATOM 5291 C CA . ASP B 1 274 ? 59.780 73.768 26.560 1.00 50.70 ? 273 ASP B CA 1 ATOM 5292 C C . ASP B 1 274 ? 58.461 73.431 25.880 1.00 47.89 ? 273 ASP B C 1 ATOM 5293 O O . ASP B 1 274 ? 57.557 72.884 26.501 1.00 46.87 ? 273 ASP B O 1 ATOM 5294 C CB . ASP B 1 274 ? 59.621 75.144 27.218 1.00 53.25 ? 273 ASP B CB 1 ATOM 5295 C CG . ASP B 1 274 ? 60.721 75.466 28.221 1.00 55.51 ? 273 ASP B CG 1 ATOM 5296 O OD1 . ASP B 1 274 ? 61.427 74.540 28.695 1.00 54.87 ? 273 ASP B OD1 1 ATOM 5297 O OD2 . ASP B 1 274 ? 60.867 76.675 28.527 1.00 58.95 ? 273 ASP B OD2 1 ATOM 5298 N N . GLY B 1 275 ? 58.340 73.770 24.599 1.00 45.02 ? 274 GLY B N 1 ATOM 5299 C CA . GLY B 1 275 ? 57.128 73.464 23.859 1.00 43.23 ? 274 GLY B CA 1 ATOM 5300 C C . GLY B 1 275 ? 56.842 71.970 23.778 1.00 42.90 ? 274 GLY B C 1 ATOM 5301 O O . GLY B 1 275 ? 55.677 71.567 23.787 1.00 42.60 ? 274 GLY B O 1 ATOM 5302 N N . TRP B 1 276 ? 57.897 71.162 23.692 1.00 42.47 ? 275 TRP B N 1 ATOM 5303 C CA . TRP B 1 276 ? 57.724 69.718 23.667 1.00 42.58 ? 275 TRP B CA 1 ATOM 5304 C C . TRP B 1 276 ? 57.166 69.224 25.009 1.00 44.61 ? 275 TRP B C 1 ATOM 5305 O O . TRP B 1 276 ? 56.273 68.374 25.063 1.00 44.85 ? 275 TRP B O 1 ATOM 5306 C CB . TRP B 1 276 ? 59.054 69.031 23.343 1.00 42.69 ? 275 TRP B CB 1 ATOM 5307 C CG . TRP B 1 276 ? 59.051 67.557 23.558 1.00 43.16 ? 275 TRP B CG 1 ATOM 5308 C CD1 . TRP B 1 276 ? 59.854 66.853 24.410 1.00 44.53 ? 275 TRP B CD1 1 ATOM 5309 C CD2 . TRP B 1 276 ? 58.195 66.605 22.932 1.00 42.99 ? 275 TRP B CD2 1 ATOM 5310 N NE1 . TRP B 1 276 ? 59.553 65.520 24.347 1.00 46.82 ? 275 TRP B NE1 1 ATOM 5311 C CE2 . TRP B 1 276 ? 58.542 65.337 23.439 1.00 45.24 ? 275 TRP B CE2 1 ATOM 5312 C CE3 . TRP B 1 276 ? 57.177 66.696 21.987 1.00 42.77 ? 275 TRP B CE3 1 ATOM 5313 C CZ2 . TRP B 1 276 ? 57.905 64.169 23.033 1.00 45.04 ? 275 TRP B CZ2 1 ATOM 5314 C CZ3 . TRP B 1 276 ? 56.542 65.530 21.578 1.00 44.92 ? 275 TRP B CZ3 1 ATOM 5315 C CH2 . TRP B 1 276 ? 56.905 64.284 22.109 1.00 45.53 ? 275 TRP B CH2 1 ATOM 5316 N N . LEU B 1 277 ? 57.684 69.796 26.094 1.00 44.49 ? 276 LEU B N 1 ATOM 5317 C CA . LEU B 1 277 ? 57.171 69.451 27.422 1.00 45.34 ? 276 LEU B CA 1 ATOM 5318 C C . LEU B 1 277 ? 55.700 69.880 27.576 1.00 44.56 ? 276 LEU B C 1 ATOM 5319 O O . LEU B 1 277 ? 54.882 69.137 28.095 1.00 43.90 ? 276 LEU B O 1 ATOM 5320 C CB . LEU B 1 277 ? 58.023 70.088 28.521 1.00 46.46 ? 276 LEU B CB 1 ATOM 5321 C CG . LEU B 1 277 ? 59.515 69.733 28.532 1.00 47.53 ? 276 LEU B CG 1 ATOM 5322 C CD1 . LEU B 1 277 ? 60.257 70.584 29.542 1.00 47.74 ? 276 LEU B CD1 1 ATOM 5323 C CD2 . LEU B 1 277 ? 59.733 68.259 28.824 1.00 49.20 ? 276 LEU B CD2 1 ATOM 5324 N N . MET B 1 278 ? 55.362 71.055 27.049 1.00 44.47 ? 277 MET B N 1 ATOM 5325 C CA . MET B 1 278 ? 53.965 71.513 27.031 1.00 44.53 ? 277 MET B CA 1 ATOM 5326 C C . MET B 1 278 ? 53.045 70.569 26.232 1.00 45.20 ? 277 MET B C 1 ATOM 5327 O O . MET B 1 278 ? 51.913 70.254 26.653 1.00 45.63 ? 277 MET B O 1 ATOM 5328 C CB . MET B 1 278 ? 53.874 72.918 26.427 1.00 45.28 ? 277 MET B CB 1 ATOM 5329 C CG . MET B 1 278 ? 54.431 74.034 27.297 1.00 46.55 ? 277 MET B CG 1 ATOM 5330 S SD . MET B 1 278 ? 54.530 75.571 26.362 1.00 47.98 ? 277 MET B SD 1 ATOM 5331 C CE . MET B 1 278 ? 55.148 76.705 27.590 1.00 49.87 ? 277 MET B CE 1 ATOM 5332 N N . ARG B 1 279 ? 53.530 70.117 25.078 1.00 44.95 ? 278 ARG B N 1 ATOM 5333 C CA . ARG B 1 279 ? 52.774 69.184 24.273 1.00 45.31 ? 278 ARG B CA 1 ATOM 5334 C C . ARG B 1 279 ? 52.565 67.869 25.013 1.00 48.20 ? 278 ARG B C 1 ATOM 5335 O O . ARG B 1 279 ? 51.452 67.328 25.035 1.00 51.20 ? 278 ARG B O 1 ATOM 5336 C CB . ARG B 1 279 ? 53.466 68.899 22.938 1.00 45.19 ? 278 ARG B CB 1 ATOM 5337 C CG . ARG B 1 279 ? 52.746 67.894 22.039 1.00 43.64 ? 278 ARG B CG 1 ATOM 5338 C CD . ARG B 1 279 ? 51.367 68.382 21.623 1.00 42.77 ? 278 ARG B CD 1 ATOM 5339 N NE . ARG B 1 279 ? 50.710 67.460 20.699 1.00 43.43 ? 278 ARG B NE 1 ATOM 5340 C CZ . ARG B 1 279 ? 49.575 67.721 20.049 1.00 43.94 ? 278 ARG B CZ 1 ATOM 5341 N NH1 . ARG B 1 279 ? 48.945 68.886 20.211 1.00 44.76 ? 278 ARG B NH1 1 ATOM 5342 N NH2 . ARG B 1 279 ? 49.063 66.824 19.220 1.00 43.54 ? 278 ARG B NH2 1 ATOM 5343 N N . GLN B 1 280 ? 53.618 67.352 25.649 1.00 49.76 ? 279 GLN B N 1 ATOM 5344 C CA . GLN B 1 280 ? 53.459 66.144 26.459 1.00 52.24 ? 279 GLN B CA 1 ATOM 5345 C C . GLN B 1 280 ? 52.464 66.342 27.590 1.00 52.10 ? 279 GLN B C 1 ATOM 5346 O O . GLN B 1 280 ? 51.741 65.420 27.894 1.00 51.76 ? 279 GLN B O 1 ATOM 5347 C CB . GLN B 1 280 ? 54.799 65.690 27.029 1.00 55.30 ? 279 GLN B CB 1 ATOM 5348 C CG . GLN B 1 280 ? 55.747 65.115 25.990 1.00 58.16 ? 279 GLN B CG 1 ATOM 5349 C CD . GLN B 1 280 ? 56.927 64.407 26.625 1.00 62.34 ? 279 GLN B CD 1 ATOM 5350 O OE1 . GLN B 1 280 ? 57.659 64.985 27.430 1.00 66.38 ? 279 GLN B OE1 1 ATOM 5351 N NE2 . GLN B 1 280 ? 57.117 63.148 26.265 1.00 65.43 ? 279 GLN B NE2 1 ATOM 5352 N N . ASP B 1 281 ? 52.474 67.516 28.234 1.00 52.62 ? 280 ASP B N 1 ATOM 5353 C CA . ASP B 1 281 ? 51.529 67.816 29.321 1.00 52.79 ? 280 ASP B CA 1 ATOM 5354 C C . ASP B 1 281 ? 50.061 67.784 28.843 1.00 52.26 ? 280 ASP B C 1 ATOM 5355 O O . ASP B 1 281 ? 49.161 67.521 29.626 1.00 52.08 ? 280 ASP B O 1 ATOM 5356 C CB . ASP B 1 281 ? 51.749 69.215 29.919 1.00 52.43 ? 280 ASP B CB 1 ATOM 5357 C CG . ASP B 1 281 ? 53.082 69.369 30.603 1.00 53.34 ? 280 ASP B CG 1 ATOM 5358 O OD1 . ASP B 1 281 ? 53.741 68.341 30.897 1.00 54.05 ? 280 ASP B OD1 1 ATOM 5359 O OD2 . ASP B 1 281 ? 53.457 70.540 30.845 1.00 52.31 ? 280 ASP B OD2 1 ATOM 5360 N N . THR B 1 282 ? 49.829 68.150 27.576 1.00 50.88 ? 281 THR B N 1 ATOM 5361 C CA . THR B 1 282 ? 48.485 68.483 27.122 1.00 50.71 ? 281 THR B CA 1 ATOM 5362 C C . THR B 1 282 ? 47.871 67.529 26.073 1.00 51.20 ? 281 THR B C 1 ATOM 5363 O O . THR B 1 282 ? 46.646 67.518 25.907 1.00 51.48 ? 281 THR B O 1 ATOM 5364 C CB . THR B 1 282 ? 48.407 69.904 26.538 1.00 49.58 ? 281 THR B CB 1 ATOM 5365 O OG1 . THR B 1 282 ? 49.325 70.027 25.446 1.00 49.04 ? 281 THR B OG1 1 ATOM 5366 C CG2 . THR B 1 282 ? 48.727 70.941 27.609 1.00 49.69 ? 281 THR B CG2 1 ATOM 5367 N N . GLU B 1 283 ? 48.694 66.713 25.438 1.00 53.81 ? 282 GLU B N 1 ATOM 5368 C CA . GLU B 1 283 ? 48.261 65.868 24.313 1.00 55.93 ? 282 GLU B CA 1 ATOM 5369 C C . GLU B 1 283 ? 47.184 64.849 24.693 1.00 56.18 ? 282 GLU B C 1 ATOM 5370 O O . GLU B 1 283 ? 46.388 64.429 23.849 1.00 57.50 ? 282 GLU B O 1 ATOM 5371 C CB . GLU B 1 283 ? 49.453 65.156 23.646 1.00 58.49 ? 282 GLU B CB 1 ATOM 5372 C CG . GLU B 1 283 ? 50.138 64.078 24.485 1.00 61.86 ? 282 GLU B CG 1 ATOM 5373 C CD . GLU B 1 283 ? 51.363 63.476 23.802 1.00 64.77 ? 282 GLU B CD 1 ATOM 5374 O OE1 . GLU B 1 283 ? 51.450 63.526 22.557 1.00 65.38 ? 282 GLU B OE1 1 ATOM 5375 O OE2 . GLU B 1 283 ? 52.244 62.941 24.509 1.00 68.62 ? 282 GLU B OE2 1 ATOM 5376 N N . GLY B 1 284 ? 47.157 64.455 25.959 1.00 56.41 ? 283 GLY B N 1 ATOM 5377 C CA . GLY B 1 284 ? 46.191 63.465 26.419 1.00 56.71 ? 283 GLY B CA 1 ATOM 5378 C C . GLY B 1 284 ? 44.950 64.025 27.107 1.00 56.70 ? 283 GLY B C 1 ATOM 5379 O O . GLY B 1 284 ? 44.127 63.252 27.581 1.00 58.58 ? 283 GLY B O 1 ATOM 5380 N N . LEU B 1 285 ? 44.811 65.345 27.186 1.00 56.09 ? 284 LEU B N 1 ATOM 5381 C CA . LEU B 1 285 ? 43.724 65.931 27.985 1.00 56.64 ? 284 LEU B CA 1 ATOM 5382 C C . LEU B 1 285 ? 42.343 65.603 27.452 1.00 57.93 ? 284 LEU B C 1 ATOM 5383 O O . LEU B 1 285 ? 41.452 65.247 28.221 1.00 59.86 ? 284 LEU B O 1 ATOM 5384 C CB . LEU B 1 285 ? 43.882 67.449 28.102 1.00 54.65 ? 284 LEU B CB 1 ATOM 5385 C CG . LEU B 1 285 ? 45.107 67.889 28.905 1.00 52.46 ? 284 LEU B CG 1 ATOM 5386 C CD1 . LEU B 1 285 ? 45.211 69.400 28.878 1.00 50.52 ? 284 LEU B CD1 1 ATOM 5387 C CD2 . LEU B 1 285 ? 45.050 67.364 30.335 1.00 53.71 ? 284 LEU B CD2 1 ATOM 5388 N N . VAL B 1 286 ? 42.162 65.740 26.149 1.00 58.13 ? 285 VAL B N 1 ATOM 5389 C CA . VAL B 1 286 ? 40.880 65.454 25.523 1.00 60.23 ? 285 VAL B CA 1 ATOM 5390 C C . VAL B 1 286 ? 40.914 64.042 24.980 1.00 64.17 ? 285 VAL B C 1 ATOM 5391 O O . VAL B 1 286 ? 41.775 63.704 24.183 1.00 64.51 ? 285 VAL B O 1 ATOM 5392 C CB . VAL B 1 286 ? 40.584 66.455 24.390 1.00 58.08 ? 285 VAL B CB 1 ATOM 5393 C CG1 . VAL B 1 286 ? 39.525 65.925 23.427 1.00 59.12 ? 285 VAL B CG1 1 ATOM 5394 C CG2 . VAL B 1 286 ? 40.153 67.788 24.976 1.00 57.25 ? 285 VAL B CG2 1 ATOM 5395 N N . GLU B 1 287 ? 39.953 63.227 25.399 1.00 68.94 ? 286 GLU B N 1 ATOM 5396 C CA . GLU B 1 287 ? 39.915 61.844 24.966 1.00 73.11 ? 286 GLU B CA 1 ATOM 5397 C C . GLU B 1 287 ? 39.546 61.787 23.487 1.00 72.43 ? 286 GLU B C 1 ATOM 5398 O O . GLU B 1 287 ? 38.495 62.253 23.078 1.00 67.60 ? 286 GLU B O 1 ATOM 5399 C CB . GLU B 1 287 ? 38.930 61.035 25.827 1.00 79.92 ? 286 GLU B CB 1 ATOM 5400 C CG . GLU B 1 287 ? 39.415 59.640 26.208 1.00 85.50 ? 286 GLU B CG 1 ATOM 5401 C CD . GLU B 1 287 ? 39.620 58.715 25.014 1.00 90.55 ? 286 GLU B CD 1 ATOM 5402 O OE1 . GLU B 1 287 ? 38.889 58.841 24.006 1.00 94.06 ? 286 GLU B OE1 1 ATOM 5403 O OE2 . GLU B 1 287 ? 40.515 57.846 25.086 1.00 95.24 ? 286 GLU B OE2 1 ATOM 5404 N N . ALA B 1 288 ? 40.432 61.173 22.705 1.00 75.29 ? 287 ALA B N 1 ATOM 5405 C CA . ALA B 1 288 ? 40.398 61.180 21.252 1.00 76.42 ? 287 ALA B CA 1 ATOM 5406 C C . ALA B 1 288 ? 39.040 60.788 20.651 1.00 78.53 ? 287 ALA B C 1 ATOM 5407 O O . ALA B 1 288 ? 38.602 61.411 19.700 1.00 77.87 ? 287 ALA B O 1 ATOM 5408 C CB . ALA B 1 288 ? 41.505 60.270 20.711 1.00 77.59 ? 287 ALA B CB 1 ATOM 5409 N N . THR B 1 289 ? 38.400 59.768 21.220 1.00 79.49 ? 288 THR B N 1 ATOM 5410 C CA . THR B 1 289 ? 37.189 59.199 20.628 1.00 79.95 ? 288 THR B CA 1 ATOM 5411 C C . THR B 1 289 ? 35.895 59.481 21.392 1.00 81.91 ? 288 THR B C 1 ATOM 5412 O O . THR B 1 289 ? 34.812 59.297 20.831 1.00 84.31 ? 288 THR B O 1 ATOM 5413 C CB . THR B 1 289 ? 37.318 57.666 20.427 1.00 80.06 ? 288 THR B CB 1 ATOM 5414 O OG1 . THR B 1 289 ? 37.493 57.015 21.688 1.00 79.29 ? 288 THR B OG1 1 ATOM 5415 C CG2 . THR B 1 289 ? 38.499 57.325 19.520 1.00 78.07 ? 288 THR B CG2 1 ATOM 5416 N N . MET B 1 290 ? 35.988 59.866 22.661 1.00 81.87 ? 289 MET B N 1 ATOM 5417 C CA . MET B 1 290 ? 34.815 60.005 23.539 1.00 84.04 ? 289 MET B CA 1 ATOM 5418 C C . MET B 1 290 ? 33.959 61.209 23.139 1.00 81.69 ? 289 MET B C 1 ATOM 5419 O O . MET B 1 290 ? 34.452 62.331 23.128 1.00 79.23 ? 289 MET B O 1 ATOM 5420 C CB . MET B 1 290 ? 35.277 60.145 24.988 1.00 85.93 ? 289 MET B CB 1 ATOM 5421 C CG . MET B 1 290 ? 34.169 60.081 26.022 1.00 90.57 ? 289 MET B CG 1 ATOM 5422 S SD . MET B 1 290 ? 34.817 60.401 27.674 1.00 94.83 ? 289 MET B SD 1 ATOM 5423 C CE . MET B 1 290 ? 33.309 60.286 28.647 1.00 95.92 ? 289 MET B CE 1 ATOM 5424 N N . PRO B 1 291 ? 32.671 60.988 22.820 1.00 81.34 ? 290 PRO B N 1 ATOM 5425 C CA . PRO B 1 291 ? 31.789 62.082 22.413 1.00 79.05 ? 290 PRO B CA 1 ATOM 5426 C C . PRO B 1 291 ? 31.406 62.918 23.624 1.00 76.48 ? 290 PRO B C 1 ATOM 5427 O O . PRO B 1 291 ? 31.585 62.476 24.752 1.00 76.24 ? 290 PRO B O 1 ATOM 5428 C CB . PRO B 1 291 ? 30.579 61.355 21.845 1.00 82.15 ? 290 PRO B CB 1 ATOM 5429 C CG . PRO B 1 291 ? 30.507 60.106 22.649 1.00 85.18 ? 290 PRO B CG 1 ATOM 5430 C CD . PRO B 1 291 ? 31.931 59.720 22.949 1.00 84.22 ? 290 PRO B CD 1 ATOM 5431 N N . PRO B 1 292 ? 30.846 64.110 23.400 1.00 73.98 ? 291 PRO B N 1 ATOM 5432 C CA . PRO B 1 292 ? 30.482 64.944 24.537 1.00 73.52 ? 291 PRO B CA 1 ATOM 5433 C C . PRO B 1 292 ? 29.261 64.403 25.297 1.00 76.54 ? 291 PRO B C 1 ATOM 5434 O O . PRO B 1 292 ? 29.100 64.690 26.471 1.00 77.76 ? 291 PRO B O 1 ATOM 5435 C CB . PRO B 1 292 ? 30.174 66.307 23.904 1.00 72.66 ? 291 PRO B CB 1 ATOM 5436 C CG . PRO B 1 292 ? 29.869 66.022 22.478 1.00 73.15 ? 291 PRO B CG 1 ATOM 5437 C CD . PRO B 1 292 ? 30.661 64.803 22.112 1.00 73.17 ? 291 PRO B CD 1 ATOM 5438 N N . GLY B 1 293 ? 28.409 63.630 24.630 1.00 77.23 ? 292 GLY B N 1 ATOM 5439 C CA . GLY B 1 293 ? 27.265 63.017 25.282 1.00 79.30 ? 292 GLY B CA 1 ATOM 5440 C C . GLY B 1 293 ? 26.073 63.948 25.460 1.00 79.56 ? 292 GLY B C 1 ATOM 5441 O O . GLY B 1 293 ? 25.242 63.743 26.335 1.00 81.56 ? 292 GLY B O 1 ATOM 5442 N N . VAL B 1 294 ? 25.993 64.972 24.605 1.00 77.59 ? 293 VAL B N 1 ATOM 5443 C CA . VAL B 1 294 ? 24.851 65.892 24.554 1.00 78.53 ? 293 VAL B CA 1 ATOM 5444 C C . VAL B 1 294 ? 24.477 66.149 23.106 1.00 79.36 ? 293 VAL B C 1 ATOM 5445 O O . VAL B 1 294 ? 25.239 65.834 22.187 1.00 77.81 ? 293 VAL B O 1 ATOM 5446 C CB . VAL B 1 294 ? 25.155 67.232 25.258 1.00 76.85 ? 293 VAL B CB 1 ATOM 5447 C CG1 . VAL B 1 294 ? 25.614 66.988 26.687 1.00 77.13 ? 293 VAL B CG1 1 ATOM 5448 C CG2 . VAL B 1 294 ? 26.201 68.036 24.495 1.00 74.07 ? 293 VAL B CG2 1 ATOM 5449 N N . GLN B 1 295 ? 23.301 66.725 22.888 1.00 82.02 ? 294 GLN B N 1 ATOM 5450 C CA . GLN B 1 295 ? 22.892 67.126 21.544 1.00 82.84 ? 294 GLN B CA 1 ATOM 5451 C C . GLN B 1 295 ? 23.907 68.123 21.003 1.00 80.58 ? 294 GLN B C 1 ATOM 5452 O O . GLN B 1 295 ? 24.204 69.107 21.671 1.00 79.94 ? 294 GLN B O 1 ATOM 5453 C CB . GLN B 1 295 ? 21.485 67.736 21.549 1.00 85.06 ? 294 GLN B CB 1 ATOM 5454 C CG . GLN B 1 295 ? 21.021 68.175 20.167 1.00 85.40 ? 294 GLN B CG 1 ATOM 5455 C CD . GLN B 1 295 ? 19.592 68.665 20.145 1.00 88.11 ? 294 GLN B CD 1 ATOM 5456 O OE1 . GLN B 1 295 ? 19.336 69.853 19.948 1.00 87.57 ? 294 GLN B OE1 1 ATOM 5457 N NE2 . GLN B 1 295 ? 18.650 67.751 20.342 1.00 90.86 ? 294 GLN B NE2 1 ATOM 5458 N N . LEU B 1 296 ? 24.462 67.829 19.836 1.00 80.51 ? 295 LEU B N 1 ATOM 5459 C CA . LEU B 1 296 ? 25.591 68.585 19.301 1.00 78.27 ? 295 LEU B CA 1 ATOM 5460 C C . LEU B 1 296 ? 25.269 69.111 17.903 1.00 78.58 ? 295 LEU B C 1 ATOM 5461 O O . LEU B 1 296 ? 24.794 68.364 17.040 1.00 80.03 ? 295 LEU B O 1 ATOM 5462 C CB . LEU B 1 296 ? 26.821 67.679 19.232 1.00 76.80 ? 295 LEU B CB 1 ATOM 5463 C CG . LEU B 1 296 ? 28.094 68.264 18.625 1.00 74.77 ? 295 LEU B CG 1 ATOM 5464 C CD1 . LEU B 1 296 ? 28.538 69.505 19.387 1.00 73.78 ? 295 LEU B CD1 1 ATOM 5465 C CD2 . LEU B 1 296 ? 29.196 67.217 18.615 1.00 73.97 ? 295 LEU B CD2 1 ATOM 5466 N N . HIS B 1 297 ? 25.522 70.398 17.697 1.00 77.76 ? 296 HIS B N 1 ATOM 5467 C CA . HIS B 1 297 ? 25.403 71.038 16.395 1.00 78.04 ? 296 HIS B CA 1 ATOM 5468 C C . HIS B 1 297 ? 26.790 71.491 15.992 1.00 76.03 ? 296 HIS B C 1 ATOM 5469 O O . HIS B 1 297 ? 27.326 72.414 16.591 1.00 74.86 ? 296 HIS B O 1 ATOM 5470 C CB . HIS B 1 297 ? 24.443 72.221 16.456 1.00 79.36 ? 296 HIS B CB 1 ATOM 5471 C CG . HIS B 1 297 ? 23.074 71.854 16.927 1.00 82.35 ? 296 HIS B CG 1 ATOM 5472 N ND1 . HIS B 1 297 ? 22.001 71.732 16.071 1.00 85.75 ? 296 HIS B ND1 1 ATOM 5473 C CD2 . HIS B 1 297 ? 22.605 71.565 18.164 1.00 83.52 ? 296 HIS B CD2 1 ATOM 5474 C CE1 . HIS B 1 297 ? 20.928 71.393 16.763 1.00 88.26 ? 296 HIS B CE1 1 ATOM 5475 N NE2 . HIS B 1 297 ? 21.268 71.283 18.035 1.00 87.33 ? 296 HIS B NE2 1 ATOM 5476 N N . CYS B 1 298 ? 27.376 70.812 14.999 1.00 76.26 ? 297 CYS B N 1 ATOM 5477 C CA . CYS B 1 298 ? 28.737 71.121 14.534 1.00 73.21 ? 297 CYS B CA 1 ATOM 5478 C C . CYS B 1 298 ? 28.690 71.991 13.301 1.00 70.70 ? 297 CYS B C 1 ATOM 5479 O O . CYS B 1 298 ? 28.361 71.526 12.210 1.00 72.75 ? 297 CYS B O 1 ATOM 5480 C CB . CYS B 1 298 ? 29.530 69.856 14.220 1.00 74.86 ? 297 CYS B CB 1 ATOM 5481 S SG . CYS B 1 298 ? 29.786 68.802 15.654 1.00 81.64 ? 297 CYS B SG 1 ATOM 5482 N N . LEU B 1 299 ? 29.016 73.261 13.475 1.00 67.63 ? 298 LEU B N 1 ATOM 5483 C CA . LEU B 1 299 ? 29.022 74.215 12.386 1.00 66.13 ? 298 LEU B CA 1 ATOM 5484 C C . LEU B 1 299 ? 30.465 74.486 11.954 1.00 63.68 ? 298 LEU B C 1 ATOM 5485 O O . LEU B 1 299 ? 31.304 74.869 12.769 1.00 60.53 ? 298 LEU B O 1 ATOM 5486 C CB . LEU B 1 299 ? 28.338 75.514 12.796 1.00 66.69 ? 298 LEU B CB 1 ATOM 5487 C CG . LEU B 1 299 ? 26.815 75.539 12.675 1.00 69.40 ? 298 LEU B CG 1 ATOM 5488 C CD1 . LEU B 1 299 ? 26.176 74.451 13.523 1.00 71.18 ? 298 LEU B CD1 1 ATOM 5489 C CD2 . LEU B 1 299 ? 26.282 76.910 13.067 1.00 69.81 ? 298 LEU B CD2 1 ATOM 5490 N N . TYR B 1 300 ? 30.749 74.273 10.671 1.00 62.99 ? 299 TYR B N 1 ATOM 5491 C CA . TYR B 1 300 ? 32.115 74.392 10.173 1.00 61.36 ? 299 TYR B CA 1 ATOM 5492 C C . TYR B 1 300 ? 32.133 75.099 8.826 1.00 61.52 ? 299 TYR B C 1 ATOM 5493 O O . TYR B 1 300 ? 31.269 74.878 7.984 1.00 62.67 ? 299 TYR B O 1 ATOM 5494 C CB . TYR B 1 300 ? 32.779 73.017 10.058 1.00 61.45 ? 299 TYR B CB 1 ATOM 5495 C CG . TYR B 1 300 ? 32.063 72.055 9.140 1.00 64.00 ? 299 TYR B CG 1 ATOM 5496 C CD1 . TYR B 1 300 ? 30.956 71.341 9.579 1.00 67.10 ? 299 TYR B CD1 1 ATOM 5497 C CD2 . TYR B 1 300 ? 32.493 71.861 7.832 1.00 64.00 ? 299 TYR B CD2 1 ATOM 5498 C CE1 . TYR B 1 300 ? 30.291 70.463 8.740 1.00 69.69 ? 299 TYR B CE1 1 ATOM 5499 C CE2 . TYR B 1 300 ? 31.836 70.985 6.984 1.00 66.94 ? 299 TYR B CE2 1 ATOM 5500 C CZ . TYR B 1 300 ? 30.737 70.288 7.442 1.00 69.74 ? 299 TYR B CZ 1 ATOM 5501 O OH . TYR B 1 300 ? 30.082 69.416 6.604 1.00 72.58 ? 299 TYR B OH 1 ATOM 5502 N N . GLY B 1 301 ? 33.111 75.973 8.641 1.00 60.35 ? 300 GLY B N 1 ATOM 5503 C CA . GLY B 1 301 ? 33.284 76.672 7.374 1.00 60.75 ? 300 GLY B CA 1 ATOM 5504 C C . GLY B 1 301 ? 34.028 75.855 6.338 1.00 60.12 ? 300 GLY B C 1 ATOM 5505 O O . GLY B 1 301 ? 34.929 75.089 6.667 1.00 59.38 ? 300 GLY B O 1 ATOM 5506 N N . THR B 1 302 ? 33.650 76.049 5.069 1.00 60.96 ? 301 THR B N 1 ATOM 5507 C CA . THR B 1 302 ? 34.391 75.497 3.941 1.00 61.56 ? 301 THR B CA 1 ATOM 5508 C C . THR B 1 302 ? 34.588 76.575 2.884 1.00 60.82 ? 301 THR B C 1 ATOM 5509 O O . THR B 1 302 ? 34.011 77.653 2.981 1.00 60.68 ? 301 THR B O 1 ATOM 5510 C CB . THR B 1 302 ? 33.682 74.285 3.302 1.00 64.48 ? 301 THR B CB 1 ATOM 5511 O OG1 . THR B 1 302 ? 32.436 74.696 2.719 1.00 68.67 ? 301 THR B OG1 1 ATOM 5512 C CG2 . THR B 1 302 ? 33.426 73.206 4.338 1.00 64.97 ? 301 THR B CG2 1 ATOM 5513 N N . GLY B 1 303 ? 35.406 76.272 1.882 1.00 60.00 ? 302 GLY B N 1 ATOM 5514 C CA . GLY B 1 303 ? 35.595 77.146 0.731 1.00 60.36 ? 302 GLY B CA 1 ATOM 5515 C C . GLY B 1 303 ? 36.521 78.327 0.988 1.00 59.50 ? 302 GLY B C 1 ATOM 5516 O O . GLY B 1 303 ? 36.555 79.264 0.189 1.00 59.45 ? 302 GLY B O 1 ATOM 5517 N N . VAL B 1 304 ? 37.244 78.289 2.107 1.00 57.76 ? 303 VAL B N 1 ATOM 5518 C CA . VAL B 1 304 ? 38.232 79.309 2.404 1.00 57.08 ? 303 VAL B CA 1 ATOM 5519 C C . VAL B 1 304 ? 39.599 78.642 2.405 1.00 55.17 ? 303 VAL B C 1 ATOM 5520 O O . VAL B 1 304 ? 39.796 77.658 3.110 1.00 56.31 ? 303 VAL B O 1 ATOM 5521 C CB . VAL B 1 304 ? 37.955 79.990 3.754 1.00 57.84 ? 303 VAL B CB 1 ATOM 5522 C CG1 . VAL B 1 304 ? 38.973 81.098 4.020 1.00 57.88 ? 303 VAL B CG1 1 ATOM 5523 C CG2 . VAL B 1 304 ? 36.543 80.546 3.775 1.00 58.58 ? 303 VAL B CG2 1 ATOM 5524 N N . PRO B 1 305 ? 40.564 79.176 1.634 1.00 54.42 ? 304 PRO B N 1 ATOM 5525 C CA . PRO B 1 305 ? 41.889 78.551 1.640 1.00 52.87 ? 304 PRO B CA 1 ATOM 5526 C C . PRO B 1 305 ? 42.462 78.491 3.054 1.00 51.03 ? 304 PRO B C 1 ATOM 5527 O O . PRO B 1 305 ? 42.507 79.503 3.725 1.00 47.92 ? 304 PRO B O 1 ATOM 5528 C CB . PRO B 1 305 ? 42.737 79.491 0.775 1.00 53.30 ? 304 PRO B CB 1 ATOM 5529 C CG . PRO B 1 305 ? 41.765 80.311 0.006 1.00 55.67 ? 304 PRO B CG 1 ATOM 5530 C CD . PRO B 1 305 ? 40.536 80.415 0.839 1.00 55.60 ? 304 PRO B CD 1 ATOM 5531 N N . THR B 1 306 ? 42.866 77.305 3.491 1.00 50.28 ? 305 THR B N 1 ATOM 5532 C CA . THR B 1 306 ? 43.290 77.072 4.859 1.00 48.43 ? 305 THR B CA 1 ATOM 5533 C C . THR B 1 306 ? 44.691 76.451 4.853 1.00 47.87 ? 305 THR B C 1 ATOM 5534 O O . THR B 1 306 ? 44.904 75.426 4.202 1.00 48.13 ? 305 THR B O 1 ATOM 5535 C CB . THR B 1 306 ? 42.308 76.122 5.561 1.00 48.64 ? 305 THR B CB 1 ATOM 5536 O OG1 . THR B 1 306 ? 40.967 76.575 5.347 1.00 49.10 ? 305 THR B OG1 1 ATOM 5537 C CG2 . THR B 1 306 ? 42.591 76.042 7.064 1.00 47.54 ? 305 THR B CG2 1 ATOM 5538 N N . PRO B 1 307 ? 45.643 77.080 5.548 1.00 48.29 ? 306 PRO B N 1 ATOM 5539 C CA . PRO B 1 307 ? 46.987 76.506 5.606 1.00 47.26 ? 306 PRO B CA 1 ATOM 5540 C C . PRO B 1 307 ? 47.018 75.040 5.989 1.00 46.31 ? 306 PRO B C 1 ATOM 5541 O O . PRO B 1 307 ? 46.400 74.670 6.998 1.00 47.31 ? 306 PRO B O 1 ATOM 5542 C CB . PRO B 1 307 ? 47.688 77.352 6.674 1.00 46.00 ? 306 PRO B CB 1 ATOM 5543 C CG . PRO B 1 307 ? 47.007 78.661 6.590 1.00 47.23 ? 306 PRO B CG 1 ATOM 5544 C CD . PRO B 1 307 ? 45.562 78.325 6.336 1.00 48.40 ? 306 PRO B CD 1 ATOM 5545 N N . ASP B 1 308 ? 47.714 74.243 5.197 1.00 45.95 ? 307 ASP B N 1 ATOM 5546 C CA . ASP B 1 308 ? 47.807 72.801 5.352 1.00 46.52 ? 307 ASP B CA 1 ATOM 5547 C C . ASP B 1 308 ? 49.252 72.336 5.637 1.00 45.49 ? 307 ASP B C 1 ATOM 5548 O O . ASP B 1 308 ? 49.452 71.359 6.356 1.00 44.56 ? 307 ASP B O 1 ATOM 5549 C CB . ASP B 1 308 ? 47.202 72.162 4.099 1.00 48.83 ? 307 ASP B CB 1 ATOM 5550 C CG . ASP B 1 308 ? 47.573 70.707 3.942 1.00 50.96 ? 307 ASP B CG 1 ATOM 5551 O OD1 . ASP B 1 308 ? 48.645 70.422 3.349 1.00 50.84 ? 307 ASP B OD1 1 ATOM 5552 O OD2 . ASP B 1 308 ? 46.775 69.856 4.392 1.00 52.63 ? 307 ASP B OD2 1 ATOM 5553 N N . SER B 1 309 ? 50.238 73.029 5.086 1.00 45.48 ? 308 SER B N 1 ATOM 5554 C CA . SER B 1 309 ? 51.650 72.660 5.257 1.00 45.47 ? 308 SER B CA 1 ATOM 5555 C C . SER B 1 309 ? 52.527 73.802 4.745 1.00 44.50 ? 308 SER B C 1 ATOM 5556 O O . SER B 1 309 ? 52.030 74.707 4.056 1.00 45.66 ? 308 SER B O 1 ATOM 5557 C CB . SER B 1 309 ? 51.996 71.359 4.520 1.00 46.24 ? 308 SER B CB 1 ATOM 5558 O OG . SER B 1 309 ? 51.398 71.307 3.242 1.00 47.90 ? 308 SER B OG 1 ATOM 5559 N N . PHE B 1 310 ? 53.805 73.751 5.078 1.00 43.58 ? 309 PHE B N 1 ATOM 5560 C CA . PHE B 1 310 ? 54.722 74.863 4.933 1.00 44.19 ? 309 PHE B CA 1 ATOM 5561 C C . PHE B 1 310 ? 56.067 74.418 4.416 1.00 45.03 ? 309 PHE B C 1 ATOM 5562 O O . PHE B 1 310 ? 56.598 73.397 4.843 1.00 44.17 ? 309 PHE B O 1 ATOM 5563 C CB . PHE B 1 310 ? 54.898 75.559 6.287 1.00 43.29 ? 309 PHE B CB 1 ATOM 5564 C CG . PHE B 1 310 ? 53.599 75.921 6.946 1.00 42.58 ? 309 PHE B CG 1 ATOM 5565 C CD1 . PHE B 1 310 ? 52.942 77.082 6.592 1.00 42.46 ? 309 PHE B CD1 1 ATOM 5566 C CD2 . PHE B 1 310 ? 53.022 75.086 7.891 1.00 42.89 ? 309 PHE B CD2 1 ATOM 5567 C CE1 . PHE B 1 310 ? 51.738 77.415 7.166 1.00 42.31 ? 309 PHE B CE1 1 ATOM 5568 C CE2 . PHE B 1 310 ? 51.812 75.412 8.477 1.00 43.11 ? 309 PHE B CE2 1 ATOM 5569 C CZ . PHE B 1 310 ? 51.170 76.584 8.111 1.00 43.44 ? 309 PHE B CZ 1 ATOM 5570 N N . TYR B 1 311 ? 56.642 75.220 3.518 1.00 46.33 ? 310 TYR B N 1 ATOM 5571 C CA . TYR B 1 311 ? 58.008 75.033 3.082 1.00 48.52 ? 310 TYR B CA 1 ATOM 5572 C C . TYR B 1 311 ? 58.861 76.233 3.491 1.00 48.67 ? 310 TYR B C 1 ATOM 5573 O O . TYR B 1 311 ? 58.570 77.361 3.151 1.00 50.01 ? 310 TYR B O 1 ATOM 5574 C CB . TYR B 1 311 ? 58.115 74.851 1.564 1.00 50.71 ? 310 TYR B CB 1 ATOM 5575 C CG . TYR B 1 311 ? 59.551 74.663 1.113 1.00 52.72 ? 310 TYR B CG 1 ATOM 5576 C CD1 . TYR B 1 311 ? 60.140 73.409 1.091 1.00 54.53 ? 310 TYR B CD1 1 ATOM 5577 C CD2 . TYR B 1 311 ? 60.332 75.747 0.742 1.00 55.40 ? 310 TYR B CD2 1 ATOM 5578 C CE1 . TYR B 1 311 ? 61.462 73.231 0.690 1.00 56.45 ? 310 TYR B CE1 1 ATOM 5579 C CE2 . TYR B 1 311 ? 61.654 75.580 0.346 1.00 56.78 ? 310 TYR B CE2 1 ATOM 5580 C CZ . TYR B 1 311 ? 62.218 74.324 0.324 1.00 56.88 ? 310 TYR B CZ 1 ATOM 5581 O OH . TYR B 1 311 ? 63.535 74.173 -0.068 1.00 59.07 ? 310 TYR B OH 1 ATOM 5582 N N . TYR B 1 312 ? 59.901 75.956 4.262 1.00 48.38 ? 311 TYR B N 1 ATOM 5583 C CA . TYR B 1 312 ? 60.850 76.977 4.707 1.00 48.84 ? 311 TYR B CA 1 ATOM 5584 C C . TYR B 1 312 ? 62.133 76.900 3.913 1.00 53.00 ? 311 TYR B C 1 ATOM 5585 O O . TYR B 1 312 ? 62.821 75.884 3.915 1.00 56.24 ? 311 TYR B O 1 ATOM 5586 C CB . TYR B 1 312 ? 61.103 76.842 6.216 1.00 47.15 ? 311 TYR B CB 1 ATOM 5587 C CG . TYR B 1 312 ? 59.974 77.326 7.115 1.00 44.17 ? 311 TYR B CG 1 ATOM 5588 C CD1 . TYR B 1 312 ? 58.889 76.504 7.428 1.00 43.54 ? 311 TYR B CD1 1 ATOM 5589 C CD2 . TYR B 1 312 ? 60.015 78.586 7.697 1.00 43.42 ? 311 TYR B CD2 1 ATOM 5590 C CE1 . TYR B 1 312 ? 57.865 76.935 8.260 1.00 41.90 ? 311 TYR B CE1 1 ATOM 5591 C CE2 . TYR B 1 312 ? 58.991 79.015 8.529 1.00 42.86 ? 311 TYR B CE2 1 ATOM 5592 C CZ . TYR B 1 312 ? 57.923 78.187 8.809 1.00 41.57 ? 311 TYR B CZ 1 ATOM 5593 O OH . TYR B 1 312 ? 56.922 78.607 9.656 1.00 40.67 ? 311 TYR B OH 1 ATOM 5594 N N . GLU B 1 313 ? 62.453 77.993 3.223 1.00 56.71 ? 312 GLU B N 1 ATOM 5595 C CA . GLU B 1 313 ? 63.743 78.133 2.566 1.00 60.45 ? 312 GLU B CA 1 ATOM 5596 C C . GLU B 1 313 ? 64.818 78.396 3.612 1.00 58.97 ? 312 GLU B C 1 ATOM 5597 O O . GLU B 1 313 ? 65.979 77.990 3.469 1.00 58.01 ? 312 GLU B O 1 ATOM 5598 C CB . GLU B 1 313 ? 63.788 79.371 1.664 1.00 66.66 ? 312 GLU B CB 1 ATOM 5599 C CG . GLU B 1 313 ? 62.834 79.404 0.490 1.00 74.45 ? 312 GLU B CG 1 ATOM 5600 C CD . GLU B 1 313 ? 62.964 80.688 -0.326 1.00 81.77 ? 312 GLU B CD 1 ATOM 5601 O OE1 . GLU B 1 313 ? 63.149 81.772 0.280 1.00 85.40 ? 312 GLU B OE1 1 ATOM 5602 O OE2 . GLU B 1 313 ? 62.881 80.615 -1.574 1.00 84.38 ? 312 GLU B OE2 1 ATOM 5603 N N . SER B 1 314 ? 64.427 79.144 4.638 1.00 57.69 ? 313 SER B N 1 ATOM 5604 C CA . SER B 1 314 ? 65.323 79.492 5.735 1.00 57.11 ? 313 SER B CA 1 ATOM 5605 C C . SER B 1 314 ? 64.493 79.413 7.039 1.00 53.51 ? 313 SER B C 1 ATOM 5606 O O . SER B 1 314 ? 63.475 80.116 7.223 1.00 51.38 ? 313 SER B O 1 ATOM 5607 C CB . SER B 1 314 ? 66.051 80.838 5.546 1.00 57.51 ? 313 SER B CB 1 ATOM 5608 O OG . SER B 1 314 ? 65.383 81.898 6.186 1.00 57.43 ? 313 SER B OG 1 ATOM 5609 N N . PHE B 1 315 ? 64.912 78.492 7.894 1.00 50.98 ? 314 PHE B N 1 ATOM 5610 C CA . PHE B 1 315 ? 64.107 78.036 9.016 1.00 48.13 ? 314 PHE B CA 1 ATOM 5611 C C . PHE B 1 315 ? 64.840 78.324 10.312 1.00 47.40 ? 314 PHE B C 1 ATOM 5612 O O . PHE B 1 315 ? 66.018 78.016 10.390 1.00 45.99 ? 314 PHE B O 1 ATOM 5613 C CB . PHE B 1 315 ? 63.987 76.529 8.818 1.00 47.61 ? 314 PHE B CB 1 ATOM 5614 C CG . PHE B 1 315 ? 63.185 75.843 9.864 1.00 45.84 ? 314 PHE B CG 1 ATOM 5615 C CD1 . PHE B 1 315 ? 61.814 75.948 9.859 1.00 43.69 ? 314 PHE B CD1 1 ATOM 5616 C CD2 . PHE B 1 315 ? 63.801 75.092 10.848 1.00 45.14 ? 314 PHE B CD2 1 ATOM 5617 C CE1 . PHE B 1 315 ? 61.060 75.325 10.806 1.00 41.15 ? 314 PHE B CE1 1 ATOM 5618 C CE2 . PHE B 1 315 ? 63.048 74.451 11.800 1.00 43.88 ? 314 PHE B CE2 1 ATOM 5619 C CZ . PHE B 1 315 ? 61.674 74.569 11.776 1.00 42.47 ? 314 PHE B CZ 1 ATOM 5620 N N . PRO B 1 316 ? 64.176 78.833 11.365 1.00 49.62 ? 315 PRO B N 1 ATOM 5621 C CA . PRO B 1 316 ? 62.736 79.122 11.421 1.00 49.84 ? 315 PRO B CA 1 ATOM 5622 C C . PRO B 1 316 ? 62.382 80.619 11.334 1.00 51.25 ? 315 PRO B C 1 ATOM 5623 O O . PRO B 1 316 ? 61.233 80.983 11.594 1.00 50.35 ? 315 PRO B O 1 ATOM 5624 C CB . PRO B 1 316 ? 62.354 78.552 12.793 1.00 48.38 ? 315 PRO B CB 1 ATOM 5625 C CG . PRO B 1 316 ? 63.563 78.819 13.632 1.00 48.55 ? 315 PRO B CG 1 ATOM 5626 C CD . PRO B 1 316 ? 64.764 78.805 12.722 1.00 49.21 ? 315 PRO B CD 1 ATOM 5627 N N . ASP B 1 317 ? 63.346 81.476 11.017 1.00 56.72 ? 316 ASP B N 1 ATOM 5628 C CA . ASP B 1 317 ? 63.169 82.922 11.228 1.00 60.70 ? 316 ASP B CA 1 ATOM 5629 C C . ASP B 1 317 ? 62.652 83.725 10.005 1.00 61.50 ? 316 ASP B C 1 ATOM 5630 O O . ASP B 1 317 ? 62.609 84.953 10.079 1.00 64.04 ? 316 ASP B O 1 ATOM 5631 C CB . ASP B 1 317 ? 64.469 83.568 11.761 1.00 61.56 ? 316 ASP B CB 1 ATOM 5632 C CG . ASP B 1 317 ? 64.787 83.178 13.200 1.00 61.68 ? 316 ASP B CG 1 ATOM 5633 O OD1 . ASP B 1 317 ? 63.950 82.570 13.898 1.00 59.06 ? 316 ASP B OD1 1 ATOM 5634 O OD2 . ASP B 1 317 ? 65.901 83.502 13.646 1.00 66.92 ? 316 ASP B OD2 1 ATOM 5635 N N . ARG B 1 318 ? 62.280 83.025 8.938 1.00 62.74 ? 317 ARG B N 1 ATOM 5636 C CA . ARG B 1 318 ? 61.680 83.661 7.784 1.00 63.76 ? 317 ARG B CA 1 ATOM 5637 C C . ARG B 1 318 ? 60.352 83.028 7.439 1.00 59.76 ? 317 ARG B C 1 ATOM 5638 O O . ARG B 1 318 ? 60.164 81.862 7.676 1.00 61.82 ? 317 ARG B O 1 ATOM 5639 C CB . ARG B 1 318 ? 62.623 83.639 6.597 1.00 68.65 ? 317 ARG B CB 1 ATOM 5640 C CG . ARG B 1 318 ? 63.691 84.718 6.643 1.00 75.74 ? 317 ARG B CG 1 ATOM 5641 C CD . ARG B 1 318 ? 64.378 84.844 5.295 1.00 85.95 ? 317 ARG B CD 1 ATOM 5642 N NE . ARG B 1 318 ? 65.682 85.496 5.406 1.00 92.25 ? 317 ARG B NE 1 ATOM 5643 C CZ . ARG B 1 318 ? 66.620 85.482 4.459 1.00 97.24 ? 317 ARG B CZ 1 ATOM 5644 N NH1 . ARG B 1 318 ? 66.416 84.848 3.305 1.00 98.29 ? 317 ARG B NH1 1 ATOM 5645 N NH2 . ARG B 1 318 ? 67.775 86.105 4.667 1.00 99.94 ? 317 ARG B NH2 1 ATOM 5646 N N . ASP B 1 319 ? 59.435 83.812 6.877 1.00 57.07 ? 318 ASP B N 1 ATOM 5647 C CA . ASP B 1 319 ? 58.083 83.326 6.577 1.00 55.96 ? 318 ASP B CA 1 ATOM 5648 C C . ASP B 1 319 ? 58.141 82.222 5.519 1.00 53.06 ? 318 ASP B C 1 ATOM 5649 O O . ASP B 1 319 ? 58.938 82.276 4.581 1.00 52.79 ? 318 ASP B O 1 ATOM 5650 C CB . ASP B 1 319 ? 57.178 84.465 6.093 1.00 58.64 ? 318 ASP B CB 1 ATOM 5651 C CG . ASP B 1 319 ? 56.652 85.348 7.231 1.00 63.55 ? 318 ASP B CG 1 ATOM 5652 O OD1 . ASP B 1 319 ? 56.765 85.018 8.450 1.00 63.18 ? 318 ASP B OD1 1 ATOM 5653 O OD2 . ASP B 1 319 ? 56.098 86.406 6.879 1.00 68.13 ? 318 ASP B OD2 1 ATOM 5654 N N . PRO B 1 320 ? 57.281 81.213 5.659 1.00 50.60 ? 319 PRO B N 1 ATOM 5655 C CA . PRO B 1 320 ? 57.321 80.077 4.735 1.00 50.55 ? 319 PRO B CA 1 ATOM 5656 C C . PRO B 1 320 ? 56.449 80.258 3.513 1.00 50.20 ? 319 PRO B C 1 ATOM 5657 O O . PRO B 1 320 ? 55.577 81.118 3.491 1.00 48.28 ? 319 PRO B O 1 ATOM 5658 C CB . PRO B 1 320 ? 56.766 78.952 5.594 1.00 49.59 ? 319 PRO B CB 1 ATOM 5659 C CG . PRO B 1 320 ? 55.749 79.639 6.442 1.00 48.43 ? 319 PRO B CG 1 ATOM 5660 C CD . PRO B 1 320 ? 56.329 80.984 6.763 1.00 48.33 ? 319 PRO B CD 1 ATOM 5661 N N . LYS B 1 321 ? 56.682 79.414 2.512 1.00 51.30 ? 320 LYS B N 1 ATOM 5662 C CA . LYS B 1 321 ? 55.722 79.251 1.421 1.00 52.75 ? 320 LYS B CA 1 ATOM 5663 C C . LYS B 1 321 ? 54.627 78.332 1.952 1.00 50.25 ? 320 LYS B C 1 ATOM 5664 O O . LYS B 1 321 ? 54.888 77.432 2.749 1.00 51.26 ? 320 LYS B O 1 ATOM 5665 C CB . LYS B 1 321 ? 56.414 78.637 0.215 1.00 55.30 ? 320 LYS B CB 1 ATOM 5666 C CG . LYS B 1 321 ? 55.617 78.709 -1.065 1.00 59.05 ? 320 LYS B CG 1 ATOM 5667 C CD . LYS B 1 321 ? 56.472 78.385 -2.284 1.00 62.50 ? 320 LYS B CD 1 ATOM 5668 C CE . LYS B 1 321 ? 55.609 78.160 -3.516 1.00 63.29 ? 320 LYS B CE 1 ATOM 5669 N NZ . LYS B 1 321 ? 56.326 77.306 -4.494 1.00 65.10 ? 320 LYS B NZ 1 ATOM 5670 N N . ILE B 1 322 ? 53.397 78.551 1.504 1.00 48.31 ? 321 ILE B N 1 ATOM 5671 C CA . ILE B 1 322 ? 52.255 77.896 2.125 1.00 47.52 ? 321 ILE B CA 1 ATOM 5672 C C . ILE B 1 322 ? 51.460 77.074 1.128 1.00 47.98 ? 321 ILE B C 1 ATOM 5673 O O . ILE B 1 322 ? 51.169 77.534 0.016 1.00 49.81 ? 321 ILE B O 1 ATOM 5674 C CB . ILE B 1 322 ? 51.327 78.929 2.792 1.00 48.02 ? 321 ILE B CB 1 ATOM 5675 C CG1 . ILE B 1 322 ? 52.113 79.762 3.809 1.00 47.08 ? 321 ILE B CG1 1 ATOM 5676 C CG2 . ILE B 1 322 ? 50.146 78.242 3.460 1.00 47.71 ? 321 ILE B CG2 1 ATOM 5677 C CD1 . ILE B 1 322 ? 51.268 80.708 4.635 1.00 46.08 ? 321 ILE B CD1 1 ATOM 5678 N N . CYS B 1 323 ? 51.166 75.843 1.546 1.00 47.23 ? 322 CYS B N 1 ATOM 5679 C CA . CYS B 1 323 ? 50.233 74.945 0.842 1.00 49.04 ? 322 CYS B CA 1 ATOM 5680 C C . CYS B 1 323 ? 48.861 75.008 1.509 1.00 47.15 ? 322 CYS B C 1 ATOM 5681 O O . CYS B 1 323 ? 48.778 74.889 2.725 1.00 45.37 ? 322 CYS B O 1 ATOM 5682 C CB . CYS B 1 323 ? 50.709 73.491 0.902 1.00 50.37 ? 322 CYS B CB 1 ATOM 5683 S SG . CYS B 1 323 ? 51.854 72.970 -0.375 1.00 57.90 ? 322 CYS B SG 1 ATOM 5684 N N . PHE B 1 324 ? 47.802 75.212 0.719 1.00 46.94 ? 323 PHE B N 1 ATOM 5685 C CA . PHE B 1 324 ? 46.470 75.448 1.260 1.00 45.09 ? 323 PHE B CA 1 ATOM 5686 C C . PHE B 1 324 ? 45.538 74.301 0.928 1.00 45.98 ? 323 PHE B C 1 ATOM 5687 O O . PHE B 1 324 ? 45.564 73.772 -0.204 1.00 44.97 ? 323 PHE B O 1 ATOM 5688 C CB . PHE B 1 324 ? 45.874 76.717 0.647 1.00 45.64 ? 323 PHE B CB 1 ATOM 5689 C CG . PHE B 1 324 ? 46.530 77.986 1.097 1.00 44.15 ? 323 PHE B CG 1 ATOM 5690 C CD1 . PHE B 1 324 ? 46.109 78.632 2.248 1.00 43.50 ? 323 PHE B CD1 1 ATOM 5691 C CD2 . PHE B 1 324 ? 47.553 78.547 0.358 1.00 44.90 ? 323 PHE B CD2 1 ATOM 5692 C CE1 . PHE B 1 324 ? 46.706 79.809 2.663 1.00 42.56 ? 323 PHE B CE1 1 ATOM 5693 C CE2 . PHE B 1 324 ? 48.151 79.728 0.762 1.00 44.31 ? 323 PHE B CE2 1 ATOM 5694 C CZ . PHE B 1 324 ? 47.732 80.357 1.917 1.00 42.98 ? 323 PHE B CZ 1 ATOM 5695 N N . GLY B 1 325 ? 44.681 73.946 1.884 1.00 45.96 ? 324 GLY B N 1 ATOM 5696 C CA . GLY B 1 325 ? 43.574 73.039 1.644 1.00 47.64 ? 324 GLY B CA 1 ATOM 5697 C C . GLY B 1 325 ? 42.255 73.697 1.985 1.00 48.99 ? 324 GLY B C 1 ATOM 5698 O O . GLY B 1 325 ? 42.164 74.914 2.092 1.00 48.53 ? 324 GLY B O 1 ATOM 5699 N N . ASP B 1 326 ? 41.223 72.878 2.170 1.00 51.25 ? 325 ASP B N 1 ATOM 5700 C CA . ASP B 1 326 ? 39.892 73.391 2.425 1.00 53.45 ? 325 ASP B CA 1 ATOM 5701 C C . ASP B 1 326 ? 39.680 73.589 3.935 1.00 52.52 ? 325 ASP B C 1 ATOM 5702 O O . ASP B 1 326 ? 40.376 72.975 4.754 1.00 51.76 ? 325 ASP B O 1 ATOM 5703 C CB . ASP B 1 326 ? 38.839 72.419 1.861 1.00 55.88 ? 325 ASP B CB 1 ATOM 5704 C CG . ASP B 1 326 ? 37.533 73.112 1.432 1.00 58.48 ? 325 ASP B CG 1 ATOM 5705 O OD1 . ASP B 1 326 ? 37.308 74.290 1.794 1.00 58.06 ? 325 ASP B OD1 1 ATOM 5706 O OD2 . ASP B 1 326 ? 36.723 72.461 0.719 1.00 60.44 ? 325 ASP B OD2 1 ATOM 5707 N N . GLY B 1 327 ? 38.718 74.422 4.276 1.00 52.42 ? 326 GLY B N 1 ATOM 5708 C CA . GLY B 1 327 ? 38.378 74.741 5.667 1.00 52.35 ? 326 GLY B CA 1 ATOM 5709 C C . GLY B 1 327 ? 37.822 76.155 5.750 1.00 53.43 ? 326 GLY B C 1 ATOM 5710 O O . GLY B 1 327 ? 37.247 76.667 4.774 1.00 54.23 ? 326 GLY B O 1 ATOM 5711 N N . ASP B 1 328 ? 38.024 76.800 6.898 1.00 53.53 ? 327 ASP B N 1 ATOM 5712 C CA . ASP B 1 328 ? 37.487 78.132 7.145 1.00 56.04 ? 327 ASP B CA 1 ATOM 5713 C C . ASP B 1 328 ? 38.536 79.224 7.231 1.00 55.03 ? 327 ASP B C 1 ATOM 5714 O O . ASP B 1 328 ? 38.250 80.336 7.678 1.00 55.91 ? 327 ASP B O 1 ATOM 5715 C CB . ASP B 1 328 ? 36.611 78.130 8.409 1.00 57.11 ? 327 ASP B CB 1 ATOM 5716 C CG . ASP B 1 328 ? 37.416 77.999 9.692 1.00 57.08 ? 327 ASP B CG 1 ATOM 5717 O OD1 . ASP B 1 328 ? 38.664 77.991 9.633 1.00 57.28 ? 327 ASP B OD1 1 ATOM 5718 O OD2 . ASP B 1 328 ? 36.801 77.903 10.771 1.00 58.97 ? 327 ASP B OD2 1 ATOM 5719 N N . GLY B 1 329 ? 39.745 78.914 6.776 1.00 54.46 ? 328 GLY B N 1 ATOM 5720 C CA . GLY B 1 329 ? 40.866 79.854 6.859 1.00 52.71 ? 328 GLY B CA 1 ATOM 5721 C C . GLY B 1 329 ? 41.833 79.533 7.976 1.00 50.77 ? 328 GLY B C 1 ATOM 5722 O O . GLY B 1 329 ? 43.008 79.849 7.884 1.00 48.65 ? 328 GLY B O 1 ATOM 5723 N N . THR B 1 330 ? 41.339 78.862 9.016 1.00 50.70 ? 329 THR B N 1 ATOM 5724 C CA . THR B 1 330 ? 42.119 78.514 10.200 1.00 50.23 ? 329 THR B CA 1 ATOM 5725 C C . THR B 1 330 ? 41.994 77.018 10.490 1.00 50.75 ? 329 THR B C 1 ATOM 5726 O O . THR B 1 330 ? 42.993 76.309 10.595 1.00 51.66 ? 329 THR B O 1 ATOM 5727 C CB . THR B 1 330 ? 41.616 79.305 11.417 1.00 50.31 ? 329 THR B CB 1 ATOM 5728 O OG1 . THR B 1 330 ? 41.771 80.703 11.166 1.00 51.57 ? 329 THR B OG1 1 ATOM 5729 C CG2 . THR B 1 330 ? 42.378 78.934 12.674 1.00 49.72 ? 329 THR B CG2 1 ATOM 5730 N N . VAL B 1 331 ? 40.763 76.542 10.614 1.00 51.31 ? 330 VAL B N 1 ATOM 5731 C CA . VAL B 1 331 ? 40.496 75.152 10.914 1.00 51.80 ? 330 VAL B CA 1 ATOM 5732 C C . VAL B 1 331 ? 40.362 74.336 9.628 1.00 52.76 ? 330 VAL B C 1 ATOM 5733 O O . VAL B 1 331 ? 39.538 74.642 8.755 1.00 55.08 ? 330 VAL B O 1 ATOM 5734 C CB . VAL B 1 331 ? 39.194 75.011 11.742 1.00 53.28 ? 330 VAL B CB 1 ATOM 5735 C CG1 . VAL B 1 331 ? 38.803 73.547 11.916 1.00 53.19 ? 330 VAL B CG1 1 ATOM 5736 C CG2 . VAL B 1 331 ? 39.362 75.685 13.096 1.00 52.08 ? 330 VAL B CG2 1 ATOM 5737 N N . ASN B 1 332 ? 41.186 73.298 9.531 1.00 52.66 ? 331 ASN B N 1 ATOM 5738 C CA . ASN B 1 332 ? 41.208 72.476 8.339 1.00 53.89 ? 331 ASN B CA 1 ATOM 5739 C C . ASN B 1 332 ? 39.918 71.667 8.312 1.00 56.48 ? 331 ASN B C 1 ATOM 5740 O O . ASN B 1 332 ? 39.374 71.272 9.367 1.00 59.08 ? 331 ASN B O 1 ATOM 5741 C CB . ASN B 1 332 ? 42.465 71.601 8.283 1.00 52.61 ? 331 ASN B CB 1 ATOM 5742 C CG . ASN B 1 332 ? 43.740 72.395 8.571 1.00 50.91 ? 331 ASN B CG 1 ATOM 5743 O OD1 . ASN B 1 332 ? 44.079 72.657 9.736 1.00 48.60 ? 331 ASN B OD1 1 ATOM 5744 N ND2 . ASN B 1 332 ? 44.447 72.786 7.514 1.00 50.01 ? 331 ASN B ND2 1 ATOM 5745 N N . LEU B 1 333 ? 39.400 71.459 7.112 1.00 59.65 ? 332 LEU B N 1 ATOM 5746 C CA . LEU B 1 333 ? 38.143 70.730 6.946 1.00 61.67 ? 332 LEU B CA 1 ATOM 5747 C C . LEU B 1 333 ? 38.140 69.368 7.650 1.00 62.85 ? 332 LEU B C 1 ATOM 5748 O O . LEU B 1 333 ? 37.129 68.949 8.173 1.00 61.18 ? 332 LEU B O 1 ATOM 5749 C CB . LEU B 1 333 ? 37.825 70.551 5.460 1.00 62.65 ? 332 LEU B CB 1 ATOM 5750 C CG . LEU B 1 333 ? 36.612 69.698 5.086 1.00 64.59 ? 332 LEU B CG 1 ATOM 5751 C CD1 . LEU B 1 333 ? 35.337 70.191 5.758 1.00 65.57 ? 332 LEU B CD1 1 ATOM 5752 C CD2 . LEU B 1 333 ? 36.449 69.696 3.576 1.00 65.43 ? 332 LEU B CD2 1 ATOM 5753 N N . LYS B 1 334 ? 39.263 68.663 7.658 1.00 66.23 ? 333 LYS B N 1 ATOM 5754 C CA . LYS B 1 334 ? 39.357 67.371 8.327 1.00 71.24 ? 333 LYS B CA 1 ATOM 5755 C C . LYS B 1 334 ? 38.894 67.350 9.797 1.00 72.41 ? 333 LYS B C 1 ATOM 5756 O O . LYS B 1 334 ? 38.430 66.320 10.247 1.00 71.63 ? 333 LYS B O 1 ATOM 5757 C CB . LYS B 1 334 ? 40.820 66.898 8.348 1.00 74.10 ? 333 LYS B CB 1 ATOM 5758 C CG . LYS B 1 334 ? 41.318 66.246 7.073 1.00 80.84 ? 333 LYS B CG 1 ATOM 5759 C CD . LYS B 1 334 ? 42.793 65.877 7.197 1.00 85.20 ? 333 LYS B CD 1 ATOM 5760 C CE . LYS B 1 334 ? 43.466 65.729 5.838 1.00 91.46 ? 333 LYS B CE 1 ATOM 5761 N NZ . LYS B 1 334 ? 42.934 64.578 5.053 1.00 94.37 ? 333 LYS B NZ 1 ATOM 5762 N N . SER B 1 335 ? 38.999 68.457 10.527 1.00 74.06 ? 334 SER B N 1 ATOM 5763 C CA . SER B 1 335 ? 38.473 68.512 11.897 1.00 75.59 ? 334 SER B CA 1 ATOM 5764 C C . SER B 1 335 ? 36.982 68.132 11.987 1.00 82.04 ? 334 SER B C 1 ATOM 5765 O O . SER B 1 335 ? 36.570 67.449 12.923 1.00 85.55 ? 334 SER B O 1 ATOM 5766 C CB . SER B 1 335 ? 38.698 69.891 12.498 1.00 74.67 ? 334 SER B CB 1 ATOM 5767 O OG . SER B 1 335 ? 40.085 70.121 12.706 1.00 76.65 ? 334 SER B OG 1 ATOM 5768 N N . ALA B 1 336 ? 36.184 68.533 10.998 1.00 84.99 ? 335 ALA B N 1 ATOM 5769 C CA . ALA B 1 336 ? 34.747 68.214 10.979 1.00 87.63 ? 335 ALA B CA 1 ATOM 5770 C C . ALA B 1 336 ? 34.413 66.727 10.791 1.00 90.15 ? 335 ALA B C 1 ATOM 5771 O O . ALA B 1 336 ? 33.263 66.328 10.981 1.00 93.14 ? 335 ALA B O 1 ATOM 5772 C CB . ALA B 1 336 ? 34.038 69.030 9.908 1.00 89.61 ? 335 ALA B CB 1 ATOM 5773 N N . LEU B 1 337 ? 35.389 65.907 10.411 1.00 89.49 ? 336 LEU B N 1 ATOM 5774 C CA . LEU B 1 337 ? 35.178 64.456 10.385 1.00 92.65 ? 336 LEU B CA 1 ATOM 5775 C C . LEU B 1 337 ? 35.085 63.865 11.795 1.00 90.42 ? 336 LEU B C 1 ATOM 5776 O O . LEU B 1 337 ? 34.565 62.757 11.980 1.00 91.46 ? 336 LEU B O 1 ATOM 5777 C CB . LEU B 1 337 ? 36.278 63.747 9.579 1.00 95.40 ? 336 LEU B CB 1 ATOM 5778 C CG . LEU B 1 337 ? 36.153 63.864 8.052 1.00 99.22 ? 336 LEU B CG 1 ATOM 5779 C CD1 . LEU B 1 337 ? 37.453 63.462 7.359 1.00 98.65 ? 336 LEU B CD1 1 ATOM 5780 C CD2 . LEU B 1 337 ? 34.972 63.042 7.531 1.00 100.43 ? 336 LEU B CD2 1 ATOM 5781 N N . GLN B 1 338 ? 35.580 64.606 12.784 1.00 88.09 ? 337 GLN B N 1 ATOM 5782 C CA . GLN B 1 338 ? 35.544 64.161 14.169 1.00 88.58 ? 337 GLN B CA 1 ATOM 5783 C C . GLN B 1 338 ? 34.118 64.147 14.732 1.00 89.09 ? 337 GLN B C 1 ATOM 5784 O O . GLN B 1 338 ? 33.763 63.254 15.502 1.00 92.14 ? 337 GLN B O 1 ATOM 5785 C CB . GLN B 1 338 ? 36.464 65.039 15.020 1.00 87.76 ? 337 GLN B CB 1 ATOM 5786 C CG . GLN B 1 338 ? 36.608 64.605 16.471 1.00 90.08 ? 337 GLN B CG 1 ATOM 5787 C CD . GLN B 1 338 ? 37.212 63.223 16.630 1.00 92.55 ? 337 GLN B CD 1 ATOM 5788 O OE1 . GLN B 1 338 ? 37.831 62.679 15.708 1.00 90.45 ? 337 GLN B OE1 1 ATOM 5789 N NE2 . GLN B 1 338 ? 37.034 62.646 17.814 1.00 94.77 ? 337 GLN B NE2 1 ATOM 5790 N N . CYS B 1 339 ? 33.304 65.129 14.352 1.00 88.54 ? 338 CYS B N 1 ATOM 5791 C CA . CYS B 1 339 ? 31.889 65.144 14.735 1.00 92.51 ? 338 CYS B CA 1 ATOM 5792 C C . CYS B 1 339 ? 31.129 63.981 14.120 1.00 93.81 ? 338 CYS B C 1 ATOM 5793 O O . CYS B 1 339 ? 30.214 63.430 14.735 1.00 96.60 ? 338 CYS B O 1 ATOM 5794 C CB . CYS B 1 339 ? 31.232 66.432 14.256 1.00 94.01 ? 338 CYS B CB 1 ATOM 5795 S SG . CYS B 1 339 ? 32.104 67.929 14.744 1.00 99.43 ? 338 CYS B SG 1 ATOM 5796 N N . GLN B 1 340 ? 31.500 63.628 12.893 1.00 92.65 ? 339 GLN B N 1 ATOM 5797 C CA . GLN B 1 340 ? 30.862 62.536 12.189 1.00 94.74 ? 339 GLN B CA 1 ATOM 5798 C C . GLN B 1 340 ? 31.088 61.231 12.952 1.00 90.48 ? 339 GLN B C 1 ATOM 5799 O O . GLN B 1 340 ? 30.157 60.433 13.079 1.00 92.89 ? 339 GLN B O 1 ATOM 5800 C CB . GLN B 1 340 ? 31.371 62.443 10.741 1.00 97.58 ? 339 GLN B CB 1 ATOM 5801 C CG . GLN B 1 340 ? 30.349 61.845 9.775 1.00 103.39 ? 339 GLN B CG 1 ATOM 5802 C CD . GLN B 1 340 ? 30.776 61.928 8.315 1.00 105.83 ? 339 GLN B CD 1 ATOM 5803 O OE1 . GLN B 1 340 ? 31.536 62.816 7.918 1.00 105.47 ? 339 GLN B OE1 1 ATOM 5804 N NE2 . GLN B 1 340 ? 30.279 60.997 7.505 1.00 108.74 ? 339 GLN B NE2 1 ATOM 5805 N N . ALA B 1 341 ? 32.289 61.036 13.484 1.00 84.63 ? 340 ALA B N 1 ATOM 5806 C CA . ALA B 1 341 ? 32.612 59.825 14.228 1.00 84.08 ? 340 ALA B CA 1 ATOM 5807 C C . ALA B 1 341 ? 31.768 59.697 15.503 1.00 84.52 ? 340 ALA B C 1 ATOM 5808 O O . ALA B 1 341 ? 31.431 58.586 15.938 1.00 87.44 ? 340 ALA B O 1 ATOM 5809 C CB . ALA B 1 341 ? 34.091 59.809 14.572 1.00 82.23 ? 340 ALA B CB 1 ATOM 5810 N N . TRP B 1 342 ? 31.409 60.829 16.097 1.00 82.17 ? 341 TRP B N 1 ATOM 5811 C CA . TRP B 1 342 ? 30.637 60.818 17.327 1.00 83.01 ? 341 TRP B CA 1 ATOM 5812 C C . TRP B 1 342 ? 29.179 60.348 17.144 1.00 87.01 ? 341 TRP B C 1 ATOM 5813 O O . TRP B 1 342 ? 28.563 59.865 18.101 1.00 87.76 ? 341 TRP B O 1 ATOM 5814 C CB . TRP B 1 342 ? 30.660 62.204 17.984 1.00 80.80 ? 341 TRP B CB 1 ATOM 5815 C CG . TRP B 1 342 ? 32.000 62.611 18.547 1.00 77.25 ? 341 TRP B CG 1 ATOM 5816 C CD1 . TRP B 1 342 ? 32.996 61.787 18.983 1.00 75.59 ? 341 TRP B CD1 1 ATOM 5817 C CD2 . TRP B 1 342 ? 32.462 63.948 18.768 1.00 74.12 ? 341 TRP B CD2 1 ATOM 5818 N NE1 . TRP B 1 342 ? 34.054 62.528 19.443 1.00 73.92 ? 341 TRP B NE1 1 ATOM 5819 C CE2 . TRP B 1 342 ? 33.752 63.857 19.326 1.00 72.57 ? 341 TRP B CE2 1 ATOM 5820 C CE3 . TRP B 1 342 ? 31.911 65.213 18.544 1.00 73.72 ? 341 TRP B CE3 1 ATOM 5821 C CZ2 . TRP B 1 342 ? 34.500 64.982 19.669 1.00 70.58 ? 341 TRP B CZ2 1 ATOM 5822 C CZ3 . TRP B 1 342 ? 32.654 66.330 18.877 1.00 72.73 ? 341 TRP B CZ3 1 ATOM 5823 C CH2 . TRP B 1 342 ? 33.937 66.208 19.435 1.00 71.36 ? 341 TRP B CH2 1 ATOM 5824 N N . GLN B 1 343 ? 28.637 60.500 15.944 1.00 89.59 ? 342 GLN B N 1 ATOM 5825 C CA . GLN B 1 343 ? 27.262 60.080 15.666 1.00 94.98 ? 342 GLN B CA 1 ATOM 5826 C C . GLN B 1 343 ? 26.943 58.655 16.122 1.00 96.77 ? 342 GLN B C 1 ATOM 5827 O O . GLN B 1 343 ? 25.874 58.408 16.634 1.00 97.03 ? 342 GLN B O 1 ATOM 5828 C CB . GLN B 1 343 ? 26.911 60.231 14.180 1.00 98.28 ? 342 GLN B CB 1 ATOM 5829 C CG . GLN B 1 343 ? 26.426 61.623 13.816 1.00 99.49 ? 342 GLN B CG 1 ATOM 5830 C CD . GLN B 1 343 ? 25.902 61.727 12.398 1.00 101.22 ? 342 GLN B CD 1 ATOM 5831 O OE1 . GLN B 1 343 ? 24.690 61.744 12.178 1.00 102.91 ? 342 GLN B OE1 1 ATOM 5832 N NE2 . GLN B 1 343 ? 26.812 61.807 11.427 1.00 100.02 ? 342 GLN B NE2 1 ATOM 5833 N N . SER B 1 344 ? 27.871 57.731 15.935 1.00 96.30 ? 343 SER B N 1 ATOM 5834 C CA . SER B 1 344 ? 27.632 56.334 16.281 1.00 98.44 ? 343 SER B CA 1 ATOM 5835 C C . SER B 1 344 ? 28.018 56.002 17.725 1.00 99.32 ? 343 SER B C 1 ATOM 5836 O O . SER B 1 344 ? 27.783 54.884 18.173 1.00 102.32 ? 343 SER B O 1 ATOM 5837 C CB . SER B 1 344 ? 28.402 55.419 15.321 1.00 97.34 ? 343 SER B CB 1 ATOM 5838 O OG . SER B 1 344 ? 29.804 55.578 15.463 1.00 93.44 ? 343 SER B OG 1 ATOM 5839 N N . ARG B 1 345 ? 28.633 56.947 18.433 1.00 98.93 ? 344 ARG B N 1 ATOM 5840 C CA . ARG B 1 345 ? 29.123 56.687 19.794 1.00 99.85 ? 344 ARG B CA 1 ATOM 5841 C C . ARG B 1 345 ? 28.281 57.318 20.910 1.00 99.29 ? 344 ARG B C 1 ATOM 5842 O O . ARG B 1 345 ? 28.546 57.089 22.087 1.00 97.81 ? 344 ARG B O 1 ATOM 5843 C CB . ARG B 1 345 ? 30.578 57.152 19.941 1.00 99.49 ? 344 ARG B CB 1 ATOM 5844 C CG . ARG B 1 345 ? 31.542 56.495 18.967 1.00 100.84 ? 344 ARG B CG 1 ATOM 5845 C CD . ARG B 1 345 ? 32.968 56.502 19.496 1.00 100.87 ? 344 ARG B CD 1 ATOM 5846 N NE . ARG B 1 345 ? 33.947 56.241 18.435 1.00 102.60 ? 344 ARG B NE 1 ATOM 5847 C CZ . ARG B 1 345 ? 34.609 57.173 17.739 1.00 100.75 ? 344 ARG B CZ 1 ATOM 5848 N NH1 . ARG B 1 345 ? 34.427 58.473 17.965 1.00 100.48 ? 344 ARG B NH1 1 ATOM 5849 N NH2 . ARG B 1 345 ? 35.475 56.800 16.802 1.00 99.69 ? 344 ARG B NH2 1 ATOM 5850 N N . GLN B 1 346 ? 27.287 58.122 20.540 1.00 98.58 ? 345 GLN B N 1 ATOM 5851 C CA . GLN B 1 346 ? 26.393 58.676 21.555 1.00 99.04 ? 345 GLN B CA 1 ATOM 5852 C C . GLN B 1 346 ? 24.962 58.582 21.069 1.00 103.31 ? 345 GLN B C 1 ATOM 5853 O O . GLN B 1 346 ? 24.719 58.491 19.873 1.00 103.47 ? 345 GLN B O 1 ATOM 5854 C CB . GLN B 1 346 ? 26.757 60.126 21.904 1.00 95.70 ? 345 GLN B CB 1 ATOM 5855 C CG . GLN B 1 346 ? 26.483 61.146 20.805 1.00 94.02 ? 345 GLN B CG 1 ATOM 5856 C CD . GLN B 1 346 ? 26.684 62.579 21.269 1.00 91.12 ? 345 GLN B CD 1 ATOM 5857 O OE1 . GLN B 1 346 ? 27.598 62.873 22.036 1.00 89.98 ? 345 GLN B OE1 1 ATOM 5858 N NE2 . GLN B 1 346 ? 25.835 63.481 20.794 1.00 90.44 ? 345 GLN B NE2 1 ATOM 5859 N N . GLU B 1 347 ? 24.024 58.564 22.005 1.00 106.04 ? 346 GLU B N 1 ATOM 5860 C CA . GLU B 1 347 ? 22.596 58.517 21.666 1.00 108.95 ? 346 GLU B CA 1 ATOM 5861 C C . GLU B 1 347 ? 22.010 59.825 21.267 1.00 106.38 ? 346 GLU B C 1 ATOM 5862 O O . GLU B 1 347 ? 21.127 59.886 20.411 1.00 108.36 ? 346 GLU B O 1 ATOM 5863 C CB . GLU B 1 347 ? 21.794 57.964 22.853 1.00 114.22 ? 346 GLU B CB 1 ATOM 5864 C CG . GLU B 1 347 ? 20.349 57.548 22.516 1.00 120.34 ? 346 GLU B CG 1 ATOM 5865 C CD . GLU B 1 347 ? 19.348 57.893 23.616 1.00 124.84 ? 346 GLU B CD 1 ATOM 5866 O OE1 . GLU B 1 347 ? 18.561 57.008 24.045 1.00 127.53 ? 346 GLU B OE1 1 ATOM 5867 O OE2 . GLU B 1 347 ? 19.345 59.064 24.052 1.00 125.17 ? 346 GLU B OE2 1 ATOM 5868 N N . HIS B 1 348 ? 22.465 60.912 21.889 1.00 102.59 ? 347 HIS B N 1 ATOM 5869 C CA . HIS B 1 348 ? 22.026 62.242 21.504 1.00 100.54 ? 347 HIS B CA 1 ATOM 5870 C C . HIS B 1 348 ? 22.401 62.533 20.051 1.00 98.43 ? 347 HIS B C 1 ATOM 5871 O O . HIS B 1 348 ? 23.426 62.056 19.535 1.00 96.58 ? 347 HIS B O 1 ATOM 5872 C CB . HIS B 1 348 ? 22.616 63.297 22.438 1.00 98.17 ? 347 HIS B CB 1 ATOM 5873 C CG . HIS B 1 348 ? 22.074 63.231 23.832 1.00 100.22 ? 347 HIS B CG 1 ATOM 5874 N ND1 . HIS B 1 348 ? 22.605 62.404 24.799 1.00 100.00 ? 347 HIS B ND1 1 ATOM 5875 C CD2 . HIS B 1 348 ? 21.043 63.885 24.420 1.00 101.48 ? 347 HIS B CD2 1 ATOM 5876 C CE1 . HIS B 1 348 ? 21.930 62.556 25.924 1.00 101.74 ? 347 HIS B CE1 1 ATOM 5877 N NE2 . HIS B 1 348 ? 20.977 63.448 25.722 1.00 102.72 ? 347 HIS B NE2 1 ATOM 5878 N N . GLN B 1 349 ? 21.555 63.312 19.393 1.00 99.05 ? 348 GLN B N 1 ATOM 5879 C CA . GLN B 1 349 ? 21.752 63.632 17.988 1.00 97.83 ? 348 GLN B CA 1 ATOM 5880 C C . GLN B 1 349 ? 23.013 64.487 17.775 1.00 93.31 ? 348 GLN B C 1 ATOM 5881 O O . GLN B 1 349 ? 23.361 65.325 18.628 1.00 91.99 ? 348 GLN B O 1 ATOM 5882 C CB . GLN B 1 349 ? 20.507 64.346 17.460 1.00 100.97 ? 348 GLN B CB 1 ATOM 5883 C CG . GLN B 1 349 ? 20.354 64.316 15.949 1.00 102.62 ? 348 GLN B CG 1 ATOM 5884 C CD . GLN B 1 349 ? 18.933 64.607 15.492 1.00 106.18 ? 348 GLN B CD 1 ATOM 5885 O OE1 . GLN B 1 349 ? 18.587 64.365 14.335 1.00 107.99 ? 348 GLN B OE1 1 ATOM 5886 N NE2 . GLN B 1 349 ? 18.102 65.122 16.398 1.00 106.95 ? 348 GLN B NE2 1 ATOM 5887 N N . VAL B 1 350 ? 23.696 64.231 16.664 1.00 90.26 ? 349 VAL B N 1 ATOM 5888 C CA . VAL B 1 350 ? 24.815 65.040 16.214 1.00 86.98 ? 349 VAL B CA 1 ATOM 5889 C C . VAL B 1 350 ? 24.456 65.583 14.826 1.00 87.13 ? 349 VAL B C 1 ATOM 5890 O O . VAL B 1 350 ? 24.270 64.789 13.888 1.00 88.12 ? 349 VAL B O 1 ATOM 5891 C CB . VAL B 1 350 ? 26.111 64.219 16.110 1.00 84.79 ? 349 VAL B CB 1 ATOM 5892 C CG1 . VAL B 1 350 ? 27.258 65.083 15.599 1.00 82.40 ? 349 VAL B CG1 1 ATOM 5893 C CG2 . VAL B 1 350 ? 26.452 63.589 17.453 1.00 85.27 ? 349 VAL B CG2 1 ATOM 5894 N N . LEU B 1 351 ? 24.315 66.896 14.710 1.00 86.55 ? 350 LEU B N 1 ATOM 5895 C CA . LEU B 1 351 ? 23.919 67.525 13.451 1.00 86.78 ? 350 LEU B CA 1 ATOM 5896 C C . LEU B 1 351 ? 25.127 68.234 12.897 1.00 83.26 ? 350 LEU B C 1 ATOM 5897 O O . LEU B 1 351 ? 25.770 69.011 13.596 1.00 80.43 ? 350 LEU B O 1 ATOM 5898 C CB . LEU B 1 351 ? 22.765 68.494 13.691 1.00 89.26 ? 350 LEU B CB 1 ATOM 5899 C CG . LEU B 1 351 ? 21.474 67.785 14.123 1.00 93.80 ? 350 LEU B CG 1 ATOM 5900 C CD1 . LEU B 1 351 ? 20.643 68.642 15.067 1.00 95.61 ? 350 LEU B CD1 1 ATOM 5901 C CD2 . LEU B 1 351 ? 20.655 67.361 12.911 1.00 96.10 ? 350 LEU B CD2 1 ATOM 5902 N N . LEU B 1 352 ? 25.465 67.939 11.649 1.00 82.70 ? 351 LEU B N 1 ATOM 5903 C CA . LEU B 1 352 ? 26.553 68.638 10.964 1.00 80.02 ? 351 LEU B CA 1 ATOM 5904 C C . LEU B 1 352 ? 25.960 69.729 10.107 1.00 79.21 ? 351 LEU B C 1 ATOM 5905 O O . LEU B 1 352 ? 24.976 69.502 9.414 1.00 81.82 ? 351 LEU B O 1 ATOM 5906 C CB . LEU B 1 352 ? 27.380 67.671 10.116 1.00 80.97 ? 351 LEU B CB 1 ATOM 5907 C CG . LEU B 1 352 ? 28.529 66.990 10.871 1.00 81.33 ? 351 LEU B CG 1 ATOM 5908 C CD1 . LEU B 1 352 ? 28.015 66.160 12.040 1.00 82.92 ? 351 LEU B CD1 1 ATOM 5909 C CD2 . LEU B 1 352 ? 29.355 66.129 9.922 1.00 82.09 ? 351 LEU B CD2 1 ATOM 5910 N N . GLN B 1 353 ? 26.534 70.919 10.167 1.00 76.43 ? 352 GLN B N 1 ATOM 5911 C CA . GLN B 1 353 ? 26.102 72.002 9.286 1.00 76.60 ? 352 GLN B CA 1 ATOM 5912 C C . GLN B 1 353 ? 27.283 72.700 8.627 1.00 74.34 ? 352 GLN B C 1 ATOM 5913 O O . GLN B 1 353 ? 28.032 73.418 9.273 1.00 72.27 ? 352 GLN B O 1 ATOM 5914 C CB . GLN B 1 353 ? 25.251 73.001 10.074 1.00 77.26 ? 352 GLN B CB 1 ATOM 5915 C CG . GLN B 1 353 ? 24.707 74.168 9.263 1.00 78.39 ? 352 GLN B CG 1 ATOM 5916 C CD . GLN B 1 353 ? 23.765 73.739 8.157 1.00 80.58 ? 352 GLN B CD 1 ATOM 5917 O OE1 . GLN B 1 353 ? 22.661 73.258 8.416 1.00 82.52 ? 352 GLN B OE1 1 ATOM 5918 N NE2 . GLN B 1 353 ? 24.196 73.919 6.911 1.00 79.94 ? 352 GLN B NE2 1 ATOM 5919 N N . GLU B 1 354 ? 27.440 72.459 7.335 1.00 75.48 ? 353 GLU B N 1 ATOM 5920 C CA . GLU B 1 354 ? 28.424 73.168 6.524 1.00 74.40 ? 353 GLU B CA 1 ATOM 5921 C C . GLU B 1 354 ? 28.032 74.627 6.309 1.00 74.45 ? 353 GLU B C 1 ATOM 5922 O O . GLU B 1 354 ? 26.862 74.941 6.077 1.00 77.79 ? 353 GLU B O 1 ATOM 5923 C CB . GLU B 1 354 ? 28.564 72.489 5.159 1.00 76.62 ? 353 GLU B CB 1 ATOM 5924 C CG . GLU B 1 354 ? 29.675 73.051 4.278 1.00 76.78 ? 353 GLU B CG 1 ATOM 5925 C CD . GLU B 1 354 ? 29.742 72.392 2.909 1.00 78.13 ? 353 GLU B CD 1 ATOM 5926 O OE1 . GLU B 1 354 ? 28.779 71.691 2.528 1.00 81.10 ? 353 GLU B OE1 1 ATOM 5927 O OE2 . GLU B 1 354 ? 30.759 72.580 2.208 1.00 77.42 ? 353 GLU B OE2 1 ATOM 5928 N N . LEU B 1 355 ? 29.030 75.503 6.392 1.00 72.94 ? 354 LEU B N 1 ATOM 5929 C CA . LEU B 1 355 ? 28.869 76.940 6.150 1.00 74.07 ? 354 LEU B CA 1 ATOM 5930 C C . LEU B 1 355 ? 29.812 77.344 5.019 1.00 73.58 ? 354 LEU B C 1 ATOM 5931 O O . LEU B 1 355 ? 30.947 77.794 5.246 1.00 72.78 ? 354 LEU B O 1 ATOM 5932 C CB . LEU B 1 355 ? 29.193 77.729 7.419 1.00 73.35 ? 354 LEU B CB 1 ATOM 5933 C CG . LEU B 1 355 ? 28.360 77.384 8.652 1.00 75.10 ? 354 LEU B CG 1 ATOM 5934 C CD1 . LEU B 1 355 ? 28.860 78.167 9.857 1.00 74.33 ? 354 LEU B CD1 1 ATOM 5935 C CD2 . LEU B 1 355 ? 26.881 77.648 8.406 1.00 77.73 ? 354 LEU B CD2 1 ATOM 5936 N N . PRO B 1 356 ? 29.345 77.197 3.767 1.00 75.09 ? 355 PRO B N 1 ATOM 5937 C CA . PRO B 1 356 ? 30.259 77.415 2.644 1.00 73.71 ? 355 PRO B CA 1 ATOM 5938 C C . PRO B 1 356 ? 30.578 78.892 2.515 1.00 72.46 ? 355 PRO B C 1 ATOM 5939 O O . PRO B 1 356 ? 29.684 79.724 2.537 1.00 74.03 ? 355 PRO B O 1 ATOM 5940 C CB . PRO B 1 356 ? 29.461 76.925 1.422 1.00 75.30 ? 355 PRO B CB 1 ATOM 5941 C CG . PRO B 1 356 ? 28.253 76.237 1.963 1.00 77.15 ? 355 PRO B CG 1 ATOM 5942 C CD . PRO B 1 356 ? 27.993 76.838 3.308 1.00 77.03 ? 355 PRO B CD 1 ATOM 5943 N N . GLY B 1 357 ? 31.860 79.196 2.400 1.00 70.57 ? 356 GLY B N 1 ATOM 5944 C CA . GLY B 1 357 ? 32.335 80.567 2.251 1.00 70.63 ? 356 GLY B CA 1 ATOM 5945 C C . GLY B 1 357 ? 32.429 81.330 3.563 1.00 69.94 ? 356 GLY B C 1 ATOM 5946 O O . GLY B 1 357 ? 32.641 82.526 3.539 1.00 70.27 ? 356 GLY B O 1 ATOM 5947 N N . SER B 1 358 ? 32.276 80.652 4.698 1.00 69.30 ? 357 SER B N 1 ATOM 5948 C CA . SER B 1 358 ? 32.280 81.347 5.979 1.00 69.62 ? 357 SER B CA 1 ATOM 5949 C C . SER B 1 358 ? 33.644 81.261 6.644 1.00 66.88 ? 357 SER B C 1 ATOM 5950 O O . SER B 1 358 ? 34.111 80.177 7.000 1.00 64.57 ? 357 SER B O 1 ATOM 5951 C CB . SER B 1 358 ? 31.206 80.781 6.903 1.00 71.48 ? 357 SER B CB 1 ATOM 5952 O OG . SER B 1 358 ? 30.936 81.688 7.956 1.00 73.48 ? 357 SER B OG 1 ATOM 5953 N N . GLU B 1 359 ? 34.291 82.409 6.805 1.00 66.37 ? 358 GLU B N 1 ATOM 5954 C CA . GLU B 1 359 ? 35.596 82.478 7.451 1.00 64.83 ? 358 GLU B CA 1 ATOM 5955 C C . GLU B 1 359 ? 35.505 82.294 8.969 1.00 61.97 ? 358 GLU B C 1 ATOM 5956 O O . GLU B 1 359 ? 34.491 82.598 9.603 1.00 62.13 ? 358 GLU B O 1 ATOM 5957 C CB . GLU B 1 359 ? 36.288 83.825 7.119 1.00 65.95 ? 358 GLU B CB 1 ATOM 5958 C CG . GLU B 1 359 ? 37.783 83.929 7.466 1.00 65.47 ? 358 GLU B CG 1 ATOM 5959 C CD . GLU B 1 359 ? 38.087 84.371 8.906 1.00 65.34 ? 358 GLU B CD 1 ATOM 5960 O OE1 . GLU B 1 359 ? 37.321 85.187 9.473 1.00 66.02 ? 358 GLU B OE1 1 ATOM 5961 O OE2 . GLU B 1 359 ? 39.105 83.902 9.481 1.00 63.90 ? 358 GLU B OE2 1 ATOM 5962 N N . HIS B 1 360 ? 36.599 81.804 9.545 1.00 59.22 ? 359 HIS B N 1 ATOM 5963 C CA . HIS B 1 360 ? 36.671 81.384 10.940 1.00 58.47 ? 359 HIS B CA 1 ATOM 5964 C C . HIS B 1 360 ? 36.109 82.381 11.951 1.00 59.54 ? 359 HIS B C 1 ATOM 5965 O O . HIS B 1 360 ? 35.345 81.998 12.835 1.00 59.99 ? 359 HIS B O 1 ATOM 5966 C CB . HIS B 1 360 ? 38.123 81.070 11.302 1.00 55.67 ? 359 HIS B CB 1 ATOM 5967 C CG . HIS B 1 360 ? 38.303 80.459 12.656 1.00 54.26 ? 359 HIS B CG 1 ATOM 5968 N ND1 . HIS B 1 360 ? 37.854 79.195 12.975 1.00 53.96 ? 359 HIS B ND1 1 ATOM 5969 C CD2 . HIS B 1 360 ? 38.926 80.927 13.763 1.00 53.37 ? 359 HIS B CD2 1 ATOM 5970 C CE1 . HIS B 1 360 ? 38.179 78.919 14.226 1.00 53.51 ? 359 HIS B CE1 1 ATOM 5971 N NE2 . HIS B 1 360 ? 38.828 79.954 14.727 1.00 53.07 ? 359 HIS B NE2 1 ATOM 5972 N N . ILE B 1 361 ? 36.516 83.645 11.867 1.00 60.18 ? 360 ILE B N 1 ATOM 5973 C CA . ILE B 1 361 ? 36.013 84.662 12.776 1.00 62.52 ? 360 ILE B CA 1 ATOM 5974 C C . ILE B 1 361 ? 34.715 85.267 12.313 1.00 66.18 ? 360 ILE B C 1 ATOM 5975 O O . ILE B 1 361 ? 33.829 85.528 13.112 1.00 68.45 ? 360 ILE B O 1 ATOM 5976 C CB . ILE B 1 361 ? 37.025 85.830 12.954 1.00 62.78 ? 360 ILE B CB 1 ATOM 5977 C CG1 . ILE B 1 361 ? 38.406 85.346 13.427 1.00 60.88 ? 360 ILE B CG1 1 ATOM 5978 C CG2 . ILE B 1 361 ? 36.494 86.862 13.944 1.00 64.75 ? 360 ILE B CG2 1 ATOM 5979 C CD1 . ILE B 1 361 ? 38.447 84.822 14.842 1.00 60.71 ? 360 ILE B CD1 1 ATOM 5980 N N . GLU B 1 362 ? 34.593 85.502 11.013 1.00 69.14 ? 361 GLU B N 1 ATOM 5981 C CA . GLU B 1 362 ? 33.391 86.143 10.466 1.00 70.91 ? 361 GLU B CA 1 ATOM 5982 C C . GLU B 1 362 ? 32.135 85.321 10.728 1.00 70.76 ? 361 GLU B C 1 ATOM 5983 O O . GLU B 1 362 ? 31.049 85.879 10.801 1.00 71.84 ? 361 GLU B O 1 ATOM 5984 C CB . GLU B 1 362 ? 33.544 86.413 8.973 1.00 73.03 ? 361 GLU B CB 1 ATOM 5985 C CG . GLU B 1 362 ? 34.504 87.547 8.660 1.00 74.53 ? 361 GLU B CG 1 ATOM 5986 C CD . GLU B 1 362 ? 34.755 87.704 7.173 1.00 78.69 ? 361 GLU B CD 1 ATOM 5987 O OE1 . GLU B 1 362 ? 33.859 87.371 6.364 1.00 84.91 ? 361 GLU B OE1 1 ATOM 5988 O OE2 . GLU B 1 362 ? 35.854 88.162 6.806 1.00 79.45 ? 361 GLU B OE2 1 ATOM 5989 N N . MET B 1 363 ? 32.279 84.017 10.933 1.00 69.75 ? 362 MET B N 1 ATOM 5990 C CA . MET B 1 363 ? 31.114 83.172 11.176 1.00 72.02 ? 362 MET B CA 1 ATOM 5991 C C . MET B 1 363 ? 30.324 83.591 12.424 1.00 72.01 ? 362 MET B C 1 ATOM 5992 O O . MET B 1 363 ? 29.127 83.362 12.486 1.00 71.77 ? 362 MET B O 1 ATOM 5993 C CB . MET B 1 363 ? 31.473 81.671 11.227 1.00 72.57 ? 362 MET B CB 1 ATOM 5994 C CG . MET B 1 363 ? 32.101 81.165 12.526 1.00 72.57 ? 362 MET B CG 1 ATOM 5995 S SD . MET B 1 363 ? 32.154 79.360 12.643 1.00 72.91 ? 362 MET B SD 1 ATOM 5996 C CE . MET B 1 363 ? 33.117 78.932 11.191 1.00 73.00 ? 362 MET B CE 1 ATOM 5997 N N . LEU B 1 364 ? 30.990 84.225 13.385 1.00 71.00 ? 363 LEU B N 1 ATOM 5998 C CA . LEU B 1 364 ? 30.347 84.710 14.598 1.00 71.86 ? 363 LEU B CA 1 ATOM 5999 C C . LEU B 1 364 ? 29.390 85.883 14.421 1.00 73.91 ? 363 LEU B C 1 ATOM 6000 O O . LEU B 1 364 ? 28.557 86.132 15.288 1.00 75.08 ? 363 LEU B O 1 ATOM 6001 C CB . LEU B 1 364 ? 31.409 85.128 15.626 1.00 70.55 ? 363 LEU B CB 1 ATOM 6002 C CG . LEU B 1 364 ? 32.037 84.035 16.484 1.00 70.32 ? 363 LEU B CG 1 ATOM 6003 C CD1 . LEU B 1 364 ? 33.057 84.659 17.427 1.00 69.22 ? 363 LEU B CD1 1 ATOM 6004 C CD2 . LEU B 1 364 ? 30.981 83.273 17.268 1.00 72.46 ? 363 LEU B CD2 1 ATOM 6005 N N . ALA B 1 365 ? 29.537 86.627 13.325 1.00 74.40 ? 364 ALA B N 1 ATOM 6006 C CA . ALA B 1 365 ? 28.685 87.774 13.032 1.00 77.37 ? 364 ALA B CA 1 ATOM 6007 C C . ALA B 1 365 ? 27.859 87.539 11.772 1.00 79.30 ? 364 ALA B C 1 ATOM 6008 O O . ALA B 1 365 ? 27.216 88.449 11.273 1.00 80.81 ? 364 ALA B O 1 ATOM 6009 C CB . ALA B 1 365 ? 29.540 89.026 12.877 1.00 76.86 ? 364 ALA B CB 1 ATOM 6010 N N . ASN B 1 366 ? 27.858 86.310 11.273 1.00 79.19 ? 365 ASN B N 1 ATOM 6011 C CA . ASN B 1 366 ? 27.229 86.003 10.001 1.00 80.94 ? 365 ASN B CA 1 ATOM 6012 C C . ASN B 1 366 ? 25.742 85.681 10.202 1.00 83.35 ? 365 ASN B C 1 ATOM 6013 O O . ASN B 1 366 ? 25.382 84.920 11.097 1.00 84.62 ? 365 ASN B O 1 ATOM 6014 C CB . ASN B 1 366 ? 27.932 84.816 9.342 1.00 80.53 ? 365 ASN B CB 1 ATOM 6015 C CG . ASN B 1 366 ? 27.346 84.465 7.987 1.00 83.84 ? 365 ASN B CG 1 ATOM 6016 O OD1 . ASN B 1 366 ? 26.158 84.161 7.869 1.00 87.43 ? 365 ASN B OD1 1 ATOM 6017 N ND2 . ASN B 1 366 ? 28.179 84.515 6.945 1.00 85.30 ? 365 ASN B ND2 1 ATOM 6018 N N . ALA B 1 367 ? 24.900 86.264 9.350 1.00 85.06 ? 366 ALA B N 1 ATOM 6019 C CA . ALA B 1 367 ? 23.445 86.139 9.480 1.00 87.72 ? 366 ALA B CA 1 ATOM 6020 C C . ALA B 1 367 ? 22.965 84.686 9.392 1.00 87.97 ? 366 ALA B C 1 ATOM 6021 O O . ALA B 1 367 ? 21.980 84.330 10.028 1.00 89.60 ? 366 ALA B O 1 ATOM 6022 C CB . ALA B 1 367 ? 22.737 86.997 8.435 1.00 88.91 ? 366 ALA B CB 1 ATOM 6023 N N . THR B 1 368 ? 23.624 83.871 8.578 1.00 86.75 ? 367 THR B N 1 ATOM 6024 C CA . THR B 1 368 ? 23.284 82.467 8.471 1.00 87.23 ? 367 THR B CA 1 ATOM 6025 C C . THR B 1 368 ? 23.587 81.696 9.760 1.00 86.04 ? 367 THR B C 1 ATOM 6026 O O . THR B 1 368 ? 22.807 80.859 10.198 1.00 87.42 ? 367 THR B O 1 ATOM 6027 C CB . THR B 1 368 ? 24.035 81.797 7.301 1.00 86.85 ? 367 THR B CB 1 ATOM 6028 O OG1 . THR B 1 368 ? 23.772 82.514 6.090 1.00 87.84 ? 367 THR B OG1 1 ATOM 6029 C CG2 . THR B 1 368 ? 23.593 80.344 7.126 1.00 88.51 ? 367 THR B CG2 1 ATOM 6030 N N . THR B 1 369 ? 24.720 82.000 10.386 1.00 83.20 ? 368 THR B N 1 ATOM 6031 C CA . THR B 1 369 ? 25.064 81.419 11.670 1.00 81.16 ? 368 THR B CA 1 ATOM 6032 C C . THR B 1 369 ? 24.011 81.787 12.718 1.00 82.55 ? 368 THR B C 1 ATOM 6033 O O . THR B 1 369 ? 23.568 80.945 13.500 1.00 81.26 ? 368 THR B O 1 ATOM 6034 C CB . THR B 1 369 ? 26.432 81.916 12.154 1.00 78.14 ? 368 THR B CB 1 ATOM 6035 O OG1 . THR B 1 369 ? 27.417 81.637 11.151 1.00 77.43 ? 368 THR B OG1 1 ATOM 6036 C CG2 . THR B 1 369 ? 26.823 81.248 13.477 1.00 76.60 ? 368 THR B CG2 1 ATOM 6037 N N . LEU B 1 370 ? 23.643 83.064 12.729 1.00 83.35 ? 369 LEU B N 1 ATOM 6038 C CA . LEU B 1 370 ? 22.716 83.560 13.729 1.00 84.48 ? 369 LEU B CA 1 ATOM 6039 C C . LEU B 1 370 ? 21.316 82.993 13.495 1.00 86.82 ? 369 LEU B C 1 ATOM 6040 O O . LEU B 1 370 ? 20.606 82.698 14.462 1.00 88.41 ? 369 LEU B O 1 ATOM 6041 C CB . LEU B 1 370 ? 22.686 85.090 13.741 1.00 85.37 ? 369 LEU B CB 1 ATOM 6042 C CG . LEU B 1 370 ? 24.014 85.784 14.067 1.00 83.53 ? 369 LEU B CG 1 ATOM 6043 C CD1 . LEU B 1 370 ? 23.885 87.287 13.859 1.00 84.71 ? 369 LEU B CD1 1 ATOM 6044 C CD2 . LEU B 1 370 ? 24.493 85.458 15.478 1.00 82.27 ? 369 LEU B CD2 1 ATOM 6045 N N . ALA B 1 371 ? 20.922 82.822 12.241 1.00 87.80 ? 370 ALA B N 1 ATOM 6046 C CA . ALA B 1 371 ? 19.639 82.191 11.931 1.00 91.01 ? 370 ALA B CA 1 ATOM 6047 C C . ALA B 1 371 ? 19.606 80.739 12.420 1.00 90.63 ? 370 ALA B C 1 ATOM 6048 O O . ALA B 1 371 ? 18.565 80.271 12.898 1.00 95.68 ? 370 ALA B O 1 ATOM 6049 C CB . ALA B 1 371 ? 19.363 82.243 10.433 1.00 91.45 ? 370 ALA B CB 1 ATOM 6050 N N . TYR B 1 372 ? 20.733 80.026 12.306 1.00 87.01 ? 371 TYR B N 1 ATOM 6051 C CA . TYR B 1 372 ? 20.811 78.655 12.799 1.00 85.54 ? 371 TYR B CA 1 ATOM 6052 C C . TYR B 1 372 ? 20.656 78.625 14.327 1.00 86.17 ? 371 TYR B C 1 ATOM 6053 O O . TYR B 1 372 ? 19.880 77.841 14.891 1.00 87.86 ? 371 TYR B O 1 ATOM 6054 C CB . TYR B 1 372 ? 22.129 77.996 12.394 1.00 81.76 ? 371 TYR B CB 1 ATOM 6055 C CG . TYR B 1 372 ? 22.150 76.507 12.638 1.00 80.84 ? 371 TYR B CG 1 ATOM 6056 C CD1 . TYR B 1 372 ? 22.398 75.991 13.912 1.00 80.14 ? 371 TYR B CD1 1 ATOM 6057 C CD2 . TYR B 1 372 ? 21.916 75.611 11.601 1.00 81.21 ? 371 TYR B CD2 1 ATOM 6058 C CE1 . TYR B 1 372 ? 22.411 74.625 14.142 1.00 80.01 ? 371 TYR B CE1 1 ATOM 6059 C CE2 . TYR B 1 372 ? 21.931 74.241 11.821 1.00 81.44 ? 371 TYR B CE2 1 ATOM 6060 C CZ . TYR B 1 372 ? 22.177 73.754 13.091 1.00 80.61 ? 371 TYR B CZ 1 ATOM 6061 O OH . TYR B 1 372 ? 22.187 72.397 13.315 1.00 79.91 ? 371 TYR B OH 1 ATOM 6062 N N . LEU B 1 373 ? 21.381 79.502 15.007 1.00 85.23 ? 372 LEU B N 1 ATOM 6063 C CA . LEU B 1 373 ? 21.272 79.604 16.454 1.00 86.20 ? 372 LEU B CA 1 ATOM 6064 C C . LEU B 1 373 ? 19.846 79.941 16.902 1.00 89.90 ? 372 LEU B C 1 ATOM 6065 O O . LEU B 1 373 ? 19.336 79.386 17.869 1.00 89.94 ? 372 LEU B O 1 ATOM 6066 C CB . LEU B 1 373 ? 22.249 80.654 16.997 1.00 84.56 ? 372 LEU B CB 1 ATOM 6067 C CG . LEU B 1 373 ? 22.307 80.805 18.524 1.00 85.66 ? 372 LEU B CG 1 ATOM 6068 C CD1 . LEU B 1 373 ? 22.746 79.510 19.195 1.00 84.88 ? 372 LEU B CD1 1 ATOM 6069 C CD2 . LEU B 1 373 ? 23.233 81.945 18.909 1.00 84.23 ? 372 LEU B CD2 1 ATOM 6070 N N . LYS B 1 374 ? 19.198 80.862 16.201 1.00 92.91 ? 373 LYS B N 1 ATOM 6071 C CA . LYS B 1 374 ? 17.819 81.230 16.513 1.00 97.04 ? 373 LYS B CA 1 ATOM 6072 C C . LYS B 1 374 ? 16.886 80.016 16.497 1.00 99.46 ? 373 LYS B C 1 ATOM 6073 O O . LYS B 1 374 ? 16.026 79.870 17.373 1.00 101.26 ? 373 LYS B O 1 ATOM 6074 C CB . LYS B 1 374 ? 17.303 82.289 15.528 1.00 99.03 ? 373 LYS B CB 1 ATOM 6075 C CG . LYS B 1 374 ? 16.084 83.041 16.034 1.00 102.39 ? 373 LYS B CG 1 ATOM 6076 C CD . LYS B 1 374 ? 15.520 84.002 15.000 1.00 104.24 ? 373 LYS B CD 1 ATOM 6077 C CE . LYS B 1 374 ? 14.179 84.552 15.460 1.00 107.75 ? 373 LYS B CE 1 ATOM 6078 N NZ . LYS B 1 374 ? 13.632 85.566 14.522 1.00 109.51 ? 373 LYS B NZ 1 ATOM 6079 N N . ARG B 1 375 ? 17.050 79.166 15.490 1.00 99.53 ? 374 ARG B N 1 ATOM 6080 C CA . ARG B 1 375 ? 16.293 77.924 15.356 1.00 103.41 ? 374 ARG B CA 1 ATOM 6081 C C . ARG B 1 375 ? 16.523 76.982 16.550 1.00 101.99 ? 374 ARG B C 1 ATOM 6082 O O . ARG B 1 375 ? 15.572 76.395 17.077 1.00 105.69 ? 374 ARG B O 1 ATOM 6083 C CB . ARG B 1 375 ? 16.642 77.223 14.030 1.00 104.80 ? 374 ARG B CB 1 ATOM 6084 C CG . ARG B 1 375 ? 15.522 76.349 13.473 1.00 110.87 ? 374 ARG B CG 1 ATOM 6085 C CD . ARG B 1 375 ? 15.929 75.569 12.224 1.00 111.46 ? 374 ARG B CD 1 ATOM 6086 N NE . ARG B 1 375 ? 17.050 74.658 12.473 1.00 110.42 ? 374 ARG B NE 1 ATOM 6087 C CZ . ARG B 1 375 ? 17.481 73.725 11.622 1.00 110.54 ? 374 ARG B CZ 1 ATOM 6088 N NH1 . ARG B 1 375 ? 18.518 72.961 11.955 1.00 107.50 ? 374 ARG B NH1 1 ATOM 6089 N NH2 . ARG B 1 375 ? 16.881 73.539 10.448 1.00 111.93 ? 374 ARG B NH2 1 ATOM 6090 N N . VAL B 1 376 ? 17.785 76.849 16.954 1.00 97.73 ? 375 VAL B N 1 ATOM 6091 C CA . VAL B 1 376 ? 18.127 76.009 18.110 1.00 96.14 ? 375 VAL B CA 1 ATOM 6092 C C . VAL B 1 376 ? 17.459 76.536 19.390 1.00 97.57 ? 375 VAL B C 1 ATOM 6093 O O . VAL B 1 376 ? 16.889 75.768 20.160 1.00 99.05 ? 375 VAL B O 1 ATOM 6094 C CB . VAL B 1 376 ? 19.655 75.928 18.332 1.00 92.37 ? 375 VAL B CB 1 ATOM 6095 C CG1 . VAL B 1 376 ? 19.979 75.254 19.662 1.00 91.85 ? 375 VAL B CG1 1 ATOM 6096 C CG2 . VAL B 1 376 ? 20.330 75.187 17.183 1.00 90.53 ? 375 VAL B CG2 1 ATOM 6097 N N . LEU B 1 377 ? 17.519 77.849 19.592 1.00 97.56 ? 376 LEU B N 1 ATOM 6098 C CA . LEU B 1 377 ? 17.042 78.457 20.839 1.00 100.02 ? 376 LEU B CA 1 ATOM 6099 C C . LEU B 1 377 ? 15.548 78.655 20.926 1.00 106.04 ? 376 LEU B C 1 ATOM 6100 O O . LEU B 1 377 ? 14.967 78.411 21.981 1.00 107.56 ? 376 LEU B O 1 ATOM 6101 C CB . LEU B 1 377 ? 17.754 79.793 21.074 1.00 97.18 ? 376 LEU B CB 1 ATOM 6102 C CG . LEU B 1 377 ? 19.277 79.717 21.195 1.00 92.54 ? 376 LEU B CG 1 ATOM 6103 C CD1 . LEU B 1 377 ? 19.857 81.113 21.341 1.00 91.87 ? 376 LEU B CD1 1 ATOM 6104 C CD2 . LEU B 1 377 ? 19.697 78.832 22.359 1.00 91.16 ? 376 LEU B CD2 1 ATOM 6105 N N . LEU B 1 378 ? 14.940 79.132 19.844 1.00 110.46 ? 377 LEU B N 1 ATOM 6106 C CA . LEU B 1 378 ? 13.538 79.532 19.847 1.00 116.78 ? 377 LEU B CA 1 ATOM 6107 C C . LEU B 1 378 ? 12.623 78.483 19.208 1.00 123.12 ? 377 LEU B C 1 ATOM 6108 O O . LEU B 1 378 ? 11.404 78.594 19.348 1.00 126.97 ? 377 LEU B O 1 ATOM 6109 C CB . LEU B 1 378 ? 13.363 80.894 19.155 1.00 116.51 ? 377 LEU B CB 1 ATOM 6110 C CG . LEU B 1 378 ? 13.494 82.137 20.045 1.00 115.12 ? 377 LEU B CG 1 ATOM 6111 C CD1 . LEU B 1 378 ? 14.699 82.050 20.967 1.00 112.00 ? 377 LEU B CD1 1 ATOM 6112 C CD2 . LEU B 1 378 ? 13.562 83.398 19.196 1.00 114.43 ? 377 LEU B CD2 1 ATOM 6113 N N . GLY B 1 379 ? 13.186 77.497 18.546 1.00 126.80 ? 378 GLY B N 1 ATOM 6114 C CA . GLY B 1 379 ? 12.434 76.292 18.236 1.00 133.82 ? 378 GLY B CA 1 ATOM 6115 C C . GLY B 1 379 ? 11.720 76.289 16.947 1.00 141.35 ? 378 GLY B C 1 ATOM 6116 O O . GLY B 1 379 ? 11.034 75.263 16.706 1.00 142.75 ? 378 GLY B O 1 ATOM 6117 N N . PRO B 1 380 ? 11.808 77.358 16.085 1.00 147.77 ? 379 PRO B N 1 ATOM 6118 C CA . PRO B 1 380 ? 10.962 77.414 14.862 1.00 152.17 ? 379 PRO B CA 1 ATOM 6119 C C . PRO B 1 380 ? 11.378 76.423 13.767 1.00 151.57 ? 379 PRO B C 1 ATOM 6120 O O . PRO B 1 380 ? 12.490 75.895 13.810 1.00 147.54 ? 379 PRO B O 1 ATOM 6121 C CB . PRO B 1 380 ? 11.131 78.858 14.352 1.00 152.93 ? 379 PRO B CB 1 ATOM 6122 C CG . PRO B 1 380 ? 11.907 79.581 15.395 1.00 149.97 ? 379 PRO B CG 1 ATOM 6123 C CD . PRO B 1 380 ? 12.684 78.544 16.140 1.00 146.30 ? 379 PRO B CD 1 HETATM 6124 C C1 . NAG C 2 . ? 11.651 85.472 54.422 1.00 78.22 ? 401 NAG A C1 1 HETATM 6125 C C2 . NAG C 2 . ? 11.089 86.803 53.966 1.00 80.11 ? 401 NAG A C2 1 HETATM 6126 C C3 . NAG C 2 . ? 10.152 86.654 52.774 1.00 83.57 ? 401 NAG A C3 1 HETATM 6127 C C4 . NAG C 2 . ? 10.685 85.661 51.738 1.00 84.35 ? 401 NAG A C4 1 HETATM 6128 C C5 . NAG C 2 . ? 11.270 84.413 52.396 1.00 83.19 ? 401 NAG A C5 1 HETATM 6129 C C6 . NAG C 2 . ? 11.887 83.448 51.387 1.00 83.42 ? 401 NAG A C6 1 HETATM 6130 C C7 . NAG C 2 . ? 10.594 88.665 55.474 1.00 81.87 ? 401 NAG A C7 1 HETATM 6131 C C8 . NAG C 2 . ? 9.843 89.105 56.700 1.00 81.72 ? 401 NAG A C8 1 HETATM 6132 N N2 . NAG C 2 . ? 10.430 87.392 55.114 1.00 81.16 ? 401 NAG A N2 1 HETATM 6133 O O3 . NAG C 2 . ? 10.022 87.917 52.163 1.00 84.14 ? 401 NAG A O3 1 HETATM 6134 O O4 . NAG C 2 . ? 9.628 85.275 50.895 1.00 86.57 ? 401 NAG A O4 1 HETATM 6135 O O5 . NAG C 2 . ? 12.246 84.814 53.330 1.00 79.49 ? 401 NAG A O5 1 HETATM 6136 O O6 . NAG C 2 . ? 13.239 83.774 51.174 1.00 81.59 ? 401 NAG A O6 1 HETATM 6137 O O7 . NAG C 2 . ? 11.304 89.464 54.860 1.00 81.39 ? 401 NAG A O7 1 HETATM 6138 C C1 . NAG D 2 . ? 28.625 66.162 68.403 1.00 91.37 ? 402 NAG A C1 1 HETATM 6139 C C2 . NAG D 2 . ? 27.793 64.902 68.428 1.00 97.05 ? 402 NAG A C2 1 HETATM 6140 C C3 . NAG D 2 . ? 27.074 64.725 67.106 1.00 97.83 ? 402 NAG A C3 1 HETATM 6141 C C4 . NAG D 2 . ? 26.274 65.992 66.814 1.00 97.05 ? 402 NAG A C4 1 HETATM 6142 C C5 . NAG D 2 . ? 27.102 67.273 66.960 1.00 94.38 ? 402 NAG A C5 1 HETATM 6143 C C6 . NAG D 2 . ? 26.186 68.497 66.907 1.00 91.82 ? 402 NAG A C6 1 HETATM 6144 C C7 . NAG D 2 . ? 28.548 63.108 69.946 1.00 101.70 ? 402 NAG A C7 1 HETATM 6145 C C8 . NAG D 2 . ? 27.457 63.426 70.936 1.00 101.36 ? 402 NAG A C8 1 HETATM 6146 N N2 . NAG D 2 . ? 28.657 63.798 68.806 1.00 100.34 ? 402 NAG A N2 1 HETATM 6147 O O3 . NAG D 2 . ? 26.178 63.655 67.251 1.00 98.72 ? 402 NAG A O3 1 HETATM 6148 O O4 . NAG D 2 . ? 25.737 65.930 65.512 1.00 99.49 ? 402 NAG A O4 1 HETATM 6149 O O5 . NAG D 2 . ? 27.821 67.297 68.181 1.00 94.54 ? 402 NAG A O5 1 HETATM 6150 O O6 . NAG D 2 . ? 26.931 69.682 67.095 1.00 85.23 ? 402 NAG A O6 1 HETATM 6151 O O7 . NAG D 2 . ? 29.332 62.198 70.197 1.00 103.28 ? 402 NAG A O7 1 HETATM 6152 C C1 . NAG E 2 . ? 23.780 69.194 87.302 1.00 80.01 ? 403 NAG A C1 1 HETATM 6153 C C2 . NAG E 2 . ? 24.830 69.273 88.418 1.00 81.98 ? 403 NAG A C2 1 HETATM 6154 C C3 . NAG E 2 . ? 25.110 67.848 88.890 1.00 78.31 ? 403 NAG A C3 1 HETATM 6155 C C4 . NAG E 2 . ? 23.802 67.113 89.183 1.00 79.29 ? 403 NAG A C4 1 HETATM 6156 C C5 . NAG E 2 . ? 22.832 67.173 87.982 1.00 77.75 ? 403 NAG A C5 1 HETATM 6157 C C6 . NAG E 2 . ? 21.454 66.520 88.190 1.00 74.15 ? 403 NAG A C6 1 HETATM 6158 C C7 . NAG E 2 . ? 27.267 69.983 88.341 1.00 90.61 ? 403 NAG A C7 1 HETATM 6159 C C8 . NAG E 2 . ? 28.206 71.005 87.767 1.00 90.93 ? 403 NAG A C8 1 HETATM 6160 N N2 . NAG E 2 . ? 25.971 70.111 87.995 1.00 85.31 ? 403 NAG A N2 1 HETATM 6161 O O3 . NAG E 2 . ? 25.859 67.898 90.071 1.00 76.30 ? 403 NAG A O3 1 HETATM 6162 O O4 . NAG E 2 . ? 24.119 65.793 89.587 1.00 79.73 ? 403 NAG A O4 1 HETATM 6163 O O5 . NAG E 2 . ? 22.599 68.546 87.743 1.00 82.48 ? 403 NAG A O5 1 HETATM 6164 O O6 . NAG E 2 . ? 21.355 65.173 87.791 1.00 67.37 ? 403 NAG A O6 1 HETATM 6165 O O7 . NAG E 2 . ? 27.741 69.109 89.071 1.00 95.36 ? 403 NAG A O7 1 HETATM 6166 C C1 . NAG F 2 . ? 53.231 89.632 77.347 1.00 77.10 ? 404 NAG A C1 1 HETATM 6167 C C2 . NAG F 2 . ? 52.780 90.114 78.712 1.00 79.05 ? 404 NAG A C2 1 HETATM 6168 C C3 . NAG F 2 . ? 53.439 89.301 79.819 1.00 79.98 ? 404 NAG A C3 1 HETATM 6169 C C4 . NAG F 2 . ? 53.396 87.799 79.533 1.00 77.99 ? 404 NAG A C4 1 HETATM 6170 C C5 . NAG F 2 . ? 53.774 87.462 78.093 1.00 77.81 ? 404 NAG A C5 1 HETATM 6171 C C6 . NAG F 2 . ? 53.578 85.972 77.815 1.00 76.94 ? 404 NAG A C6 1 HETATM 6172 C C7 . NAG F 2 . ? 52.172 92.473 79.074 1.00 82.15 ? 404 NAG A C7 1 HETATM 6173 C C8 . NAG F 2 . ? 52.688 93.879 79.184 1.00 83.07 ? 404 NAG A C8 1 HETATM 6174 N N2 . NAG F 2 . ? 53.091 91.528 78.850 1.00 81.55 ? 404 NAG A N2 1 HETATM 6175 O O3 . NAG F 2 . ? 52.744 89.575 81.013 1.00 81.61 ? 404 NAG A O3 1 HETATM 6176 O O4 . NAG F 2 . ? 54.307 87.153 80.382 1.00 78.47 ? 404 NAG A O4 1 HETATM 6177 O O5 . NAG F 2 . ? 53.000 88.242 77.202 1.00 76.50 ? 404 NAG A O5 1 HETATM 6178 O O6 . NAG F 2 . ? 54.150 85.635 76.571 1.00 79.11 ? 404 NAG A O6 1 HETATM 6179 O O7 . NAG F 2 . ? 50.965 92.254 79.193 1.00 80.28 ? 404 NAG A O7 1 HETATM 6180 N N1 . EPE G 3 . ? 23.846 109.320 61.844 1.00 79.15 ? 405 EPE A N1 1 HETATM 6181 C C2 . EPE G 3 . ? 23.489 110.743 61.940 1.00 84.31 ? 405 EPE A C2 1 HETATM 6182 C C3 . EPE G 3 . ? 23.891 111.438 60.649 1.00 87.98 ? 405 EPE A C3 1 HETATM 6183 N N4 . EPE G 3 . ? 25.347 111.327 60.476 1.00 89.31 ? 405 EPE A N4 1 HETATM 6184 C C5 . EPE G 3 . ? 25.736 109.912 60.422 1.00 83.78 ? 405 EPE A C5 1 HETATM 6185 C C6 . EPE G 3 . ? 25.305 109.223 61.713 1.00 80.76 ? 405 EPE A C6 1 HETATM 6186 C C7 . EPE G 3 . ? 25.744 112.017 59.238 1.00 98.10 ? 405 EPE A C7 1 HETATM 6187 C C8 . EPE G 3 . ? 26.256 113.409 59.596 1.00 103.58 ? 405 EPE A C8 1 HETATM 6188 O O8 . EPE G 3 . ? 27.503 113.270 60.291 1.00 106.45 ? 405 EPE A O8 1 HETATM 6189 C C9 . EPE G 3 . ? 23.382 108.591 63.033 1.00 73.77 ? 405 EPE A C9 1 HETATM 6190 C C10 . EPE G 3 . ? 21.909 108.252 62.858 1.00 71.23 ? 405 EPE A C10 1 HETATM 6191 S S . EPE G 3 . ? 21.350 107.271 64.079 1.00 66.31 ? 405 EPE A S 1 HETATM 6192 O O1S . EPE G 3 . ? 21.503 105.850 63.711 1.00 64.16 ? 405 EPE A O1S 1 HETATM 6193 O O2S . EPE G 3 . ? 19.921 107.575 64.280 1.00 67.97 ? 405 EPE A O2S 1 HETATM 6194 O O3S . EPE G 3 . ? 22.080 107.545 65.328 1.00 65.62 ? 405 EPE A O3S 1 HETATM 6195 C C1 . NAG H 2 . ? 60.156 75.351 39.747 1.00 74.04 ? 401 NAG B C1 1 HETATM 6196 C C2 . NAG H 2 . ? 60.782 76.430 40.618 1.00 75.15 ? 401 NAG B C2 1 HETATM 6197 C C3 . NAG H 2 . ? 61.394 75.831 41.878 1.00 77.02 ? 401 NAG B C3 1 HETATM 6198 C C4 . NAG H 2 . ? 60.463 74.820 42.543 1.00 78.06 ? 401 NAG B C4 1 HETATM 6199 C C5 . NAG H 2 . ? 59.978 73.800 41.514 1.00 79.88 ? 401 NAG B C5 1 HETATM 6200 C C6 . NAG H 2 . ? 59.068 72.720 42.109 1.00 81.64 ? 401 NAG B C6 1 HETATM 6201 C C7 . NAG H 2 . ? 61.723 78.331 39.383 1.00 77.94 ? 401 NAG B C7 1 HETATM 6202 C C8 . NAG H 2 . ? 62.875 78.876 38.584 1.00 76.81 ? 401 NAG B C8 1 HETATM 6203 N N2 . NAG H 2 . ? 61.822 77.081 39.840 1.00 76.98 ? 401 NAG B N2 1 HETATM 6204 O O3 . NAG H 2 . ? 61.708 76.869 42.774 1.00 77.07 ? 401 NAG B O3 1 HETATM 6205 O O4 . NAG H 2 . ? 61.188 74.145 43.536 1.00 78.34 ? 401 NAG B O4 1 HETATM 6206 O O5 . NAG H 2 . ? 59.304 74.497 40.483 1.00 77.82 ? 401 NAG B O5 1 HETATM 6207 O O6 . NAG H 2 . ? 57.812 73.259 42.460 1.00 82.54 ? 401 NAG B O6 1 HETATM 6208 O O7 . NAG H 2 . ? 60.746 79.045 39.593 1.00 80.39 ? 401 NAG B O7 1 HETATM 6209 C C1 . NAG I 2 . ? 48.461 58.974 18.908 1.00 88.82 ? 402 NAG B C1 1 HETATM 6210 C C2 . NAG I 2 . ? 48.679 57.488 19.148 1.00 94.41 ? 402 NAG B C2 1 HETATM 6211 C C3 . NAG I 2 . ? 48.710 57.261 20.657 1.00 94.35 ? 402 NAG B C3 1 HETATM 6212 C C4 . NAG I 2 . ? 49.783 58.161 21.274 1.00 90.13 ? 402 NAG B C4 1 HETATM 6213 C C5 . NAG I 2 . ? 49.493 59.614 20.909 1.00 87.97 ? 402 NAG B C5 1 HETATM 6214 C C6 . NAG I 2 . ? 50.527 60.596 21.447 1.00 85.75 ? 402 NAG B C6 1 HETATM 6215 C C7 . NAG I 2 . ? 47.695 56.162 17.280 1.00 100.00 ? 402 NAG B C7 1 HETATM 6216 C C8 . NAG I 2 . ? 49.009 56.129 16.545 1.00 98.79 ? 402 NAG B C8 1 HETATM 6217 N N2 . NAG I 2 . ? 47.598 56.780 18.471 1.00 98.42 ? 402 NAG B N2 1 HETATM 6218 O O3 . NAG I 2 . ? 48.963 55.908 20.955 1.00 97.54 ? 402 NAG B O3 1 HETATM 6219 O O4 . NAG I 2 . ? 49.798 58.021 22.672 1.00 86.55 ? 402 NAG B O4 1 HETATM 6220 O O5 . NAG I 2 . ? 49.477 59.744 19.503 1.00 88.60 ? 402 NAG B O5 1 HETATM 6221 O O6 . NAG I 2 . ? 50.115 61.892 21.068 1.00 77.54 ? 402 NAG B O6 1 HETATM 6222 O O7 . NAG I 2 . ? 46.723 55.605 16.771 1.00 98.14 ? 402 NAG B O7 1 HETATM 6223 C C1 . NAG J 2 . ? 60.425 63.844 4.780 1.00 69.99 ? 403 NAG B C1 1 HETATM 6224 C C2 . NAG J 2 . ? 60.550 63.794 3.252 1.00 69.92 ? 403 NAG B C2 1 HETATM 6225 C C3 . NAG J 2 . ? 60.517 62.329 2.782 1.00 69.98 ? 403 NAG B C3 1 HETATM 6226 C C4 . NAG J 2 . ? 61.701 61.592 3.379 1.00 68.18 ? 403 NAG B C4 1 HETATM 6227 C C5 . NAG J 2 . ? 61.623 61.817 4.894 1.00 71.23 ? 403 NAG B C5 1 HETATM 6228 C C6 . NAG J 2 . ? 62.733 61.173 5.712 1.00 72.43 ? 403 NAG B C6 1 HETATM 6229 C C7 . NAG J 2 . ? 59.658 65.311 1.531 1.00 69.87 ? 403 NAG B C7 1 HETATM 6230 C C8 . NAG J 2 . ? 61.014 65.431 0.856 1.00 74.16 ? 403 NAG B C8 1 HETATM 6231 N N2 . NAG J 2 . ? 59.505 64.562 2.613 1.00 68.72 ? 403 NAG B N2 1 HETATM 6232 O O3 . NAG J 2 . ? 60.543 62.203 1.371 1.00 71.77 ? 403 NAG B O3 1 HETATM 6233 O O4 . NAG J 2 . ? 61.583 60.235 3.033 1.00 63.56 ? 403 NAG B O4 1 HETATM 6234 O O5 . NAG J 2 . ? 61.610 63.197 5.224 1.00 73.51 ? 403 NAG B O5 1 HETATM 6235 O O6 . NAG J 2 . ? 62.156 60.803 6.952 1.00 69.62 ? 403 NAG B O6 1 HETATM 6236 O O7 . NAG J 2 . ? 58.673 65.892 1.084 1.00 68.60 ? 403 NAG B O7 1 HETATM 6237 C C1 . NAG K 2 . ? 27.842 84.293 5.568 1.00 91.16 ? 404 NAG B C1 1 HETATM 6238 C C2 . NAG K 2 . ? 28.758 84.799 4.468 1.00 91.40 ? 404 NAG B C2 1 HETATM 6239 C C3 . NAG K 2 . ? 28.497 84.057 3.162 1.00 94.31 ? 404 NAG B C3 1 HETATM 6240 C C4 . NAG K 2 . ? 28.433 82.551 3.400 1.00 94.04 ? 404 NAG B C4 1 HETATM 6241 C C5 . NAG K 2 . ? 27.516 82.196 4.569 1.00 93.98 ? 404 NAG B C5 1 HETATM 6242 C C6 . NAG K 2 . ? 27.514 80.694 4.835 1.00 93.56 ? 404 NAG B C6 1 HETATM 6243 C C7 . NAG K 2 . ? 29.412 87.154 4.703 1.00 92.88 ? 404 NAG B C7 1 HETATM 6244 C C8 . NAG K 2 . ? 29.006 88.585 4.485 1.00 94.94 ? 404 NAG B C8 1 HETATM 6245 N N2 . NAG K 2 . ? 28.531 86.224 4.323 1.00 92.92 ? 404 NAG B N2 1 HETATM 6246 O O3 . NAG K 2 . ? 29.535 84.330 2.249 1.00 94.05 ? 404 NAG B O3 1 HETATM 6247 O O4 . NAG K 2 . ? 27.978 81.922 2.226 1.00 96.08 ? 404 NAG B O4 1 HETATM 6248 O O5 . NAG K 2 . ? 27.942 82.891 5.725 1.00 92.33 ? 404 NAG B O5 1 HETATM 6249 O O6 . NAG K 2 . ? 26.610 80.413 5.879 1.00 96.25 ? 404 NAG B O6 1 HETATM 6250 O O7 . NAG K 2 . ? 30.509 86.905 5.203 1.00 90.65 ? 404 NAG B O7 1 HETATM 6251 N N1 . EPE L 3 . ? 50.562 100.458 31.973 1.00 108.77 ? 405 EPE B N1 1 HETATM 6252 C C2 . EPE L 3 . ? 51.314 101.642 32.411 1.00 110.39 ? 405 EPE B C2 1 HETATM 6253 C C3 . EPE L 3 . ? 50.558 102.345 33.530 1.00 111.91 ? 405 EPE B C3 1 HETATM 6254 N N4 . EPE L 3 . ? 49.265 102.827 33.011 1.00 112.28 ? 405 EPE B N4 1 HETATM 6255 C C5 . EPE L 3 . ? 48.475 101.686 32.517 1.00 112.85 ? 405 EPE B C5 1 HETATM 6256 C C6 . EPE L 3 . ? 49.247 100.886 31.466 1.00 111.73 ? 405 EPE B C6 1 HETATM 6257 C C7 . EPE L 3 . ? 48.509 103.512 34.075 1.00 112.48 ? 405 EPE B C7 1 HETATM 6258 C C8 . EPE L 3 . ? 49.124 104.877 34.363 1.00 113.52 ? 405 EPE B C8 1 HETATM 6259 O O8 . EPE L 3 . ? 48.143 105.732 34.955 1.00 116.08 ? 405 EPE B O8 1 HETATM 6260 C C9 . EPE L 3 . ? 51.300 99.795 30.890 1.00 108.86 ? 405 EPE B C9 1 HETATM 6261 C C10 . EPE L 3 . ? 52.289 98.771 31.441 1.00 110.45 ? 405 EPE B C10 1 HETATM 6262 S S . EPE L 3 . ? 53.592 98.586 30.412 1.00 113.45 ? 405 EPE B S 1 HETATM 6263 O O1S . EPE L 3 . ? 54.107 97.200 30.477 1.00 106.40 ? 405 EPE B O1S 1 HETATM 6264 O O2S . EPE L 3 . ? 53.179 98.836 29.013 1.00 120.28 ? 405 EPE B O2S 1 HETATM 6265 O O3S . EPE L 3 . ? 54.656 99.545 30.791 1.00 108.20 ? 405 EPE B O3S 1 HETATM 6266 C C1 . PEG M 4 . ? 43.246 77.684 16.203 1.00 89.93 ? 406 PEG B C1 1 HETATM 6267 O O1 . PEG M 4 . ? 42.045 78.138 16.837 1.00 91.92 ? 406 PEG B O1 1 HETATM 6268 C C2 . PEG M 4 . ? 44.399 78.643 16.485 1.00 89.67 ? 406 PEG B C2 1 HETATM 6269 O O2 . PEG M 4 . ? 45.642 77.934 16.406 1.00 87.19 ? 406 PEG B O2 1 HETATM 6270 C C3 . PEG M 4 . ? 46.793 78.785 16.380 1.00 83.54 ? 406 PEG B C3 1 HETATM 6271 C C4 . PEG M 4 . ? 47.254 79.119 17.795 1.00 77.98 ? 406 PEG B C4 1 HETATM 6272 O O4 . PEG M 4 . ? 47.666 80.490 17.850 1.00 73.64 ? 406 PEG B O4 1 HETATM 6273 O O1 . PE8 N 5 . ? 42.610 75.183 -2.201 1.00 85.77 ? 407 PE8 B O1 1 HETATM 6274 C C2 . PE8 N 5 . ? 41.906 76.272 -1.594 1.00 85.24 ? 407 PE8 B C2 1 HETATM 6275 C C3 . PE8 N 5 . ? 40.592 75.780 -0.989 1.00 86.13 ? 407 PE8 B C3 1 HETATM 6276 O O4 . PE8 N 5 . ? 39.480 76.251 -1.754 1.00 90.04 ? 407 PE8 B O4 1 HETATM 6277 C C5 . PE8 N 5 . ? 39.110 77.603 -1.466 1.00 91.55 ? 407 PE8 B C5 1 HETATM 6278 C C6 . PE8 N 5 . ? 38.481 78.279 -2.688 1.00 95.13 ? 407 PE8 B C6 1 HETATM 6279 O O7 . PE8 N 5 . ? 38.777 79.683 -2.688 1.00 95.94 ? 407 PE8 B O7 1 HETATM 6280 C C8 . PE8 N 5 . ? 39.815 80.061 -3.605 1.00 96.22 ? 407 PE8 B C8 1 HETATM 6281 C C9 . PE8 N 5 . ? 40.348 81.451 -3.254 1.00 93.85 ? 407 PE8 B C9 1 HETATM 6282 O O10 . PE8 N 5 . ? 41.646 81.640 -3.832 1.00 89.70 ? 407 PE8 B O10 1 HETATM 6283 C C11 . PE8 N 5 . ? 42.510 82.515 -3.098 1.00 87.90 ? 407 PE8 B C11 1 HETATM 6284 C C12 . PE8 N 5 . ? 43.756 81.737 -2.678 1.00 86.00 ? 407 PE8 B C12 1 HETATM 6285 O O13 . PE8 N 5 . ? 44.675 82.574 -1.974 1.00 84.09 ? 407 PE8 B O13 1 HETATM 6286 C C14 . PE8 N 5 . ? 44.446 82.653 -0.569 1.00 88.22 ? 407 PE8 B C14 1 HETATM 6287 C C15 . PE8 N 5 . ? 45.554 83.473 0.073 1.00 90.08 ? 407 PE8 B C15 1 HETATM 6288 O O16 . PE8 N 5 . ? 46.779 83.180 -0.604 1.00 94.97 ? 407 PE8 B O16 1 HETATM 6289 C C17 . PE8 N 5 . ? 47.603 84.324 -0.851 1.00 95.50 ? 407 PE8 B C17 1 HETATM 6290 C C18 . PE8 N 5 . ? 48.926 83.889 -1.482 1.00 93.72 ? 407 PE8 B C18 1 HETATM 6291 O O19 . PE8 N 5 . ? 49.489 84.996 -2.185 1.00 93.46 ? 407 PE8 B O19 1 HETATM 6292 C C20 . PE8 N 5 . ? 50.542 84.654 -3.086 1.00 91.95 ? 407 PE8 B C20 1 HETATM 6293 C C21 . PE8 N 5 . ? 50.735 85.803 -4.071 1.00 92.95 ? 407 PE8 B C21 1 HETATM 6294 O O22 . PE8 N 5 . ? 49.456 86.347 -4.399 1.00 94.45 ? 407 PE8 B O22 1 HETATM 6295 C C23 . PE8 N 5 . ? 49.512 87.481 -5.265 1.00 96.12 ? 407 PE8 B C23 1 HETATM 6296 C C24 . PE8 N 5 . ? 49.545 88.759 -4.440 1.00 96.35 ? 407 PE8 B C24 1 HETATM 6297 O O25 . PE8 N 5 . ? 50.910 89.141 -4.250 1.00 97.47 ? 407 PE8 B O25 1 HETATM 6298 O O . HOH O 6 . ? 36.430 79.406 89.957 1.00 41.18 ? 501 HOH A O 1 HETATM 6299 O O . HOH O 6 . ? 17.870 68.442 76.141 1.00 32.14 ? 502 HOH A O 1 HETATM 6300 O O . HOH O 6 . ? 23.916 66.076 78.640 1.00 62.10 ? 503 HOH A O 1 HETATM 6301 O O . HOH O 6 . ? 17.474 70.559 74.239 1.00 40.05 ? 504 HOH A O 1 HETATM 6302 O O . HOH O 6 . ? 24.137 102.788 76.532 1.00 50.94 ? 505 HOH A O 1 HETATM 6303 O O . HOH O 6 . ? 22.191 70.923 72.290 1.00 33.18 ? 506 HOH A O 1 HETATM 6304 O O . HOH O 6 . ? 29.640 102.268 67.350 1.00 42.99 ? 507 HOH A O 1 HETATM 6305 O O . HOH O 6 . ? 45.404 100.888 55.015 1.00 41.15 ? 508 HOH A O 1 HETATM 6306 O O . HOH O 6 . ? 21.083 97.283 80.304 1.00 48.57 ? 509 HOH A O 1 HETATM 6307 O O . HOH O 6 . ? 34.269 91.488 53.695 1.00 40.38 ? 510 HOH A O 1 HETATM 6308 O O . HOH O 6 . ? 44.654 82.054 73.983 1.00 47.73 ? 511 HOH A O 1 HETATM 6309 O O . HOH O 6 . ? 30.633 88.052 52.198 1.00 48.44 ? 512 HOH A O 1 HETATM 6310 O O . HOH O 6 . ? 55.603 72.133 57.808 1.00 48.85 ? 513 HOH A O 1 HETATM 6311 O O . HOH O 6 . ? 48.313 95.095 67.388 1.00 46.69 ? 514 HOH A O 1 HETATM 6312 O O . HOH O 6 . ? 25.682 83.490 59.445 1.00 49.89 ? 515 HOH A O 1 HETATM 6313 O O . HOH O 6 . ? 28.631 107.096 50.996 1.00 54.36 ? 516 HOH A O 1 HETATM 6314 O O . HOH O 6 . ? 45.445 79.659 69.317 1.00 60.76 ? 517 HOH A O 1 HETATM 6315 O O . HOH O 6 . ? 52.875 101.591 54.641 1.00 46.92 ? 518 HOH A O 1 HETATM 6316 O O . HOH O 6 . ? 24.949 72.615 68.999 1.00 50.63 ? 519 HOH A O 1 HETATM 6317 O O . HOH O 6 . ? 16.276 99.117 69.626 1.00 53.80 ? 520 HOH A O 1 HETATM 6318 O O . HOH O 6 . ? 30.992 75.008 62.974 1.00 46.67 ? 521 HOH A O 1 HETATM 6319 O O . HOH O 6 . ? 39.789 89.895 46.250 1.00 49.20 ? 522 HOH A O 1 HETATM 6320 O O . HOH O 6 . ? 47.201 97.982 68.850 1.00 47.93 ? 523 HOH A O 1 HETATM 6321 O O . HOH O 6 . ? 30.529 94.573 52.498 1.00 40.66 ? 524 HOH A O 1 HETATM 6322 O O . HOH O 6 . ? 27.038 83.453 51.682 1.00 57.44 ? 525 HOH A O 1 HETATM 6323 O O . HOH O 6 . ? 17.524 103.230 64.430 1.00 50.43 ? 526 HOH A O 1 HETATM 6324 O O . HOH O 6 . ? 18.587 105.332 62.919 1.00 50.85 ? 527 HOH A O 1 HETATM 6325 O O . HOH O 6 . ? 28.448 70.164 78.068 1.00 36.77 ? 528 HOH A O 1 HETATM 6326 O O . HOH O 6 . ? 24.305 92.119 65.187 1.00 42.35 ? 529 HOH A O 1 HETATM 6327 O O . HOH O 6 . ? 23.280 84.306 68.434 1.00 47.42 ? 530 HOH A O 1 HETATM 6328 O O . HOH O 6 . ? 22.042 95.376 60.321 1.00 43.70 ? 531 HOH A O 1 HETATM 6329 O O . HOH O 6 . ? 36.356 86.886 68.480 1.00 41.45 ? 532 HOH A O 1 HETATM 6330 O O . HOH O 6 . ? 19.421 70.899 72.541 1.00 38.62 ? 533 HOH A O 1 HETATM 6331 O O . HOH O 6 . ? 31.831 90.146 54.893 1.00 40.29 ? 534 HOH A O 1 HETATM 6332 O O . HOH O 6 . ? 29.052 87.568 67.558 1.00 41.78 ? 535 HOH A O 1 HETATM 6333 O O . HOH O 6 . ? 43.685 80.054 75.894 1.00 45.87 ? 536 HOH A O 1 HETATM 6334 O O . HOH O 6 . ? 22.589 105.248 67.041 1.00 46.98 ? 537 HOH A O 1 HETATM 6335 O O . HOH O 6 . ? 23.263 103.848 64.627 1.00 56.49 ? 538 HOH A O 1 HETATM 6336 O O . HOH O 6 . ? 14.870 102.912 64.802 1.00 56.38 ? 539 HOH A O 1 HETATM 6337 O O . HOH O 6 . ? 22.658 110.067 76.724 1.00 54.94 ? 540 HOH A O 1 HETATM 6338 O O . HOH O 6 . ? 36.248 96.818 57.869 1.00 57.05 ? 541 HOH A O 1 HETATM 6339 O O . HOH O 6 . ? 22.622 81.408 59.617 1.00 52.01 ? 542 HOH A O 1 HETATM 6340 O O . HOH O 6 . ? 43.171 93.005 48.029 1.00 54.45 ? 543 HOH A O 1 HETATM 6341 O O . HOH O 6 . ? 34.849 69.332 79.801 1.00 36.67 ? 544 HOH A O 1 HETATM 6342 O O . HOH O 6 . ? 43.496 77.724 74.352 1.00 57.56 ? 545 HOH A O 1 HETATM 6343 O O . HOH P 6 . ? 57.671 100.867 20.229 1.00 55.31 ? 501 HOH B O 1 HETATM 6344 O O . HOH P 6 . ? 63.788 107.286 25.025 1.00 53.65 ? 502 HOH B O 1 HETATM 6345 O O . HOH P 6 . ? 43.177 72.282 4.854 1.00 57.52 ? 503 HOH B O 1 HETATM 6346 O O . HOH P 6 . ? 52.822 81.401 0.443 1.00 41.14 ? 504 HOH B O 1 HETATM 6347 O O . HOH P 6 . ? 41.476 69.122 5.531 1.00 32.41 ? 505 HOH B O 1 HETATM 6348 O O . HOH P 6 . ? 46.574 63.414 6.519 1.00 46.93 ? 506 HOH B O 1 HETATM 6349 O O . HOH P 6 . ? 60.865 63.710 17.469 1.00 35.26 ? 507 HOH B O 1 HETATM 6350 O O . HOH P 6 . ? 65.759 81.411 9.653 1.00 53.63 ? 508 HOH B O 1 HETATM 6351 O O . HOH P 6 . ? 62.549 76.253 25.769 1.00 48.65 ? 509 HOH B O 1 HETATM 6352 O O . HOH P 6 . ? 51.625 63.502 17.749 1.00 39.59 ? 510 HOH B O 1 HETATM 6353 O O . HOH P 6 . ? 61.500 80.607 4.977 1.00 41.72 ? 511 HOH B O 1 HETATM 6354 O O . HOH P 6 . ? 65.049 75.584 23.644 1.00 63.15 ? 512 HOH B O 1 HETATM 6355 O O . HOH P 6 . ? 58.728 85.029 10.494 1.00 54.67 ? 513 HOH B O 1 HETATM 6356 O O . HOH P 6 . ? 44.174 67.097 24.579 1.00 40.77 ? 514 HOH B O 1 HETATM 6357 O O . HOH P 6 . ? 61.161 81.595 22.102 1.00 45.14 ? 515 HOH B O 1 HETATM 6358 O O . HOH P 6 . ? 41.028 78.677 36.284 1.00 52.61 ? 516 HOH B O 1 HETATM 6359 O O . HOH P 6 . ? 40.762 81.074 33.660 1.00 47.39 ? 517 HOH B O 1 HETATM 6360 O O . HOH P 6 . ? 44.243 73.862 37.289 1.00 52.50 ? 518 HOH B O 1 HETATM 6361 O O . HOH P 6 . ? 51.148 72.572 31.197 1.00 62.13 ? 519 HOH B O 1 HETATM 6362 O O . HOH P 6 . ? 59.572 90.216 13.195 1.00 52.74 ? 520 HOH B O 1 HETATM 6363 O O . HOH P 6 . ? 60.259 91.125 26.526 1.00 42.47 ? 521 HOH B O 1 HETATM 6364 O O . HOH P 6 . ? 37.898 82.444 34.137 1.00 46.24 ? 522 HOH B O 1 HETATM 6365 O O . HOH P 6 . ? 55.801 75.716 39.360 1.00 46.74 ? 523 HOH B O 1 HETATM 6366 O O . HOH P 6 . ? 41.497 70.463 34.587 1.00 48.59 ? 524 HOH B O 1 HETATM 6367 O O . HOH P 6 . ? 60.189 85.986 36.266 1.00 61.62 ? 525 HOH B O 1 HETATM 6368 O O . HOH P 6 . ? 57.289 94.773 31.189 1.00 40.68 ? 526 HOH B O 1 HETATM 6369 O O . HOH P 6 . ? 53.194 76.606 22.990 1.00 37.86 ? 527 HOH B O 1 HETATM 6370 O O . HOH P 6 . ? 51.939 64.022 10.446 1.00 41.40 ? 528 HOH B O 1 HETATM 6371 O O . HOH P 6 . ? 51.381 84.017 26.816 1.00 40.81 ? 529 HOH B O 1 HETATM 6372 O O . HOH P 6 . ? 51.846 86.363 32.602 1.00 40.64 ? 530 HOH B O 1 HETATM 6373 O O . HOH P 6 . ? 47.037 94.122 24.263 1.00 48.97 ? 531 HOH B O 1 HETATM 6374 O O . HOH P 6 . ? 55.827 63.877 17.878 1.00 35.46 ? 532 HOH B O 1 HETATM 6375 O O . HOH P 6 . ? 58.463 63.828 18.676 1.00 34.85 ? 533 HOH B O 1 HETATM 6376 O O . HOH P 6 . ? 47.813 79.984 22.279 1.00 48.38 ? 534 HOH B O 1 HETATM 6377 O O . HOH P 6 . ? 45.488 75.531 9.762 1.00 46.10 ? 535 HOH B O 1 HETATM 6378 O O . HOH P 6 . ? 59.946 94.147 31.697 1.00 49.87 ? 536 HOH B O 1 HETATM 6379 O O . HOH P 6 . ? 55.541 82.946 9.892 1.00 47.37 ? 537 HOH B O 1 HETATM 6380 O O . HOH P 6 . ? 40.941 79.747 19.200 1.00 38.67 ? 538 HOH B O 1 HETATM 6381 O O . HOH P 6 . ? 36.362 74.114 8.821 1.00 47.94 ? 539 HOH B O 1 HETATM 6382 O O . HOH P 6 . ? 35.226 75.510 10.740 1.00 55.80 ? 540 HOH B O 1 HETATM 6383 O O . HOH P 6 . ? 55.930 96.715 32.365 1.00 48.58 ? 541 HOH B O 1 HETATM 6384 O O . HOH P 6 . ? 62.810 75.318 34.420 1.00 50.82 ? 542 HOH B O 1 HETATM 6385 O O . HOH P 6 . ? 37.513 88.258 30.195 1.00 55.76 ? 543 HOH B O 1 HETATM 6386 O O . HOH P 6 . ? 48.173 74.595 30.594 1.00 48.02 ? 544 HOH B O 1 HETATM 6387 O O . HOH P 6 . ? 27.543 84.216 36.840 1.00 56.40 ? 545 HOH B O 1 HETATM 6388 O O . HOH P 6 . ? 52.482 96.182 29.579 1.00 35.37 ? 546 HOH B O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . HIS A 5 ? 1.0659 1.0590 0.8617 0.0552 0.2504 0.0331 4 HIS A N 2 C CA . HIS A 5 ? 1.0319 1.0193 0.8271 0.0583 0.2319 0.0312 4 HIS A CA 3 C C . HIS A 5 ? 0.9911 0.9213 0.7489 0.0634 0.2267 0.0226 4 HIS A C 4 O O . HIS A 5 ? 0.9685 0.8646 0.6977 0.0566 0.2304 0.0162 4 HIS A O 5 C CB . HIS A 5 ? 1.0595 1.0716 0.8657 0.0392 0.2168 0.0286 4 HIS A CB 6 C CG . HIS A 5 ? 1.0999 1.0961 0.8885 0.0195 0.2188 0.0213 4 HIS A CG 7 N ND1 . HIS A 5 ? 1.1304 1.0754 0.8832 0.0162 0.2166 0.0132 4 HIS A ND1 8 C CD2 . HIS A 5 ? 1.1096 1.1349 0.9118 0.0018 0.2234 0.0216 4 HIS A CD2 9 C CE1 . HIS A 5 ? 1.1396 1.0804 0.8843 -0.0012 0.2207 0.0094 4 HIS A CE1 10 N NE2 . HIS A 5 ? 1.1493 1.1371 0.9230 -0.0111 0.2251 0.0136 4 HIS A NE2 11 N N . PRO A 6 ? 0.9493 0.8708 0.7076 0.0753 0.2184 0.0233 5 PRO A N 12 C CA . PRO A 6 ? 0.9481 0.8191 0.6724 0.0801 0.2150 0.0157 5 PRO A CA 13 C C . PRO A 6 ? 0.9342 0.7846 0.6398 0.0671 0.1980 0.0082 5 PRO A C 14 O O . PRO A 6 ? 0.9159 0.7904 0.6377 0.0578 0.1870 0.0089 5 PRO A O 15 C CB . PRO A 6 ? 0.9515 0.8240 0.6864 0.0961 0.2130 0.0196 5 PRO A CB 16 C CG . PRO A 6 ? 0.9302 0.8522 0.7014 0.0952 0.2054 0.0279 5 PRO A CG 17 C CD . PRO A 6 ? 0.9250 0.8820 0.7134 0.0837 0.2115 0.0313 5 PRO A CD 18 N N . PRO A 7 ? 0.9302 0.7370 0.6015 0.0664 0.1963 0.0015 6 PRO A N 19 C CA . PRO A 7 ? 0.9086 0.6960 0.5634 0.0569 0.1805 -0.0038 6 PRO A CA 20 C C . PRO A 7 ? 0.8717 0.6664 0.5380 0.0603 0.1650 -0.0039 6 PRO A C 21 O O . PRO A 7 ? 0.8346 0.6325 0.5093 0.0721 0.1659 -0.0016 6 PRO A O 22 C CB . PRO A 7 ? 0.9405 0.6839 0.5578 0.0589 0.1826 -0.0088 6 PRO A CB 23 C CG . PRO A 7 ? 0.9619 0.6982 0.5757 0.0710 0.1967 -0.0080 6 PRO A CG 24 C CD . PRO A 7 ? 0.9530 0.7274 0.5988 0.0744 0.2089 -0.0011 6 PRO A CD 25 N N . VAL A 8 ? 0.8600 0.6549 0.5254 0.0501 0.1523 -0.0065 7 VAL A N 26 C CA . VAL A 8 ? 0.8260 0.6318 0.5042 0.0511 0.1381 -0.0065 7 VAL A CA 27 C C . VAL A 8 ? 0.8261 0.6022 0.4826 0.0476 0.1259 -0.0115 7 VAL A C 28 O O . VAL A 8 ? 0.8523 0.6137 0.4943 0.0389 0.1257 -0.0137 7 VAL A O 29 C CB . VAL A 8 ? 0.8124 0.6563 0.5165 0.0414 0.1351 -0.0041 7 VAL A CB 30 C CG1 . VAL A 8 ? 0.7966 0.6478 0.5091 0.0401 0.1201 -0.0052 7 VAL A CG1 31 C CG2 . VAL A 8 ? 0.8103 0.6913 0.5407 0.0468 0.1449 0.0030 7 VAL A CG2 32 N N . VAL A 9 ? 0.8157 0.5840 0.4713 0.0546 0.1165 -0.0124 8 VAL A N 33 C CA . VAL A 9 ? 0.8125 0.5598 0.4533 0.0521 0.1034 -0.0159 8 VAL A CA 34 C C . VAL A 9 ? 0.7810 0.5482 0.4419 0.0513 0.0925 -0.0151 8 VAL A C 35 O O . VAL A 9 ? 0.7736 0.5571 0.4506 0.0581 0.0922 -0.0123 8 VAL A O 36 C CB . VAL A 9 ? 0.8323 0.5512 0.4513 0.0592 0.1013 -0.0184 8 VAL A CB 37 C CG1 . VAL A 9 ? 0.8404 0.5452 0.4496 0.0572 0.0865 -0.0206 8 VAL A CG1 38 C CG2 . VAL A 9 ? 0.8613 0.5585 0.4559 0.0584 0.1114 -0.0197 8 VAL A CG2 39 N N . LEU A 10 ? 0.7735 0.5377 0.4323 0.0434 0.0849 -0.0171 9 LEU A N 40 C CA . LEU A 10 ? 0.7606 0.5415 0.4353 0.0407 0.0755 -0.0173 9 LEU A CA 41 C C . LEU A 10 ? 0.7675 0.5287 0.4319 0.0445 0.0642 -0.0190 9 LEU A C 42 O O . LEU A 10 ? 0.7636 0.5015 0.4095 0.0431 0.0617 -0.0203 9 LEU A O 43 C CB . LEU A 10 ? 0.7623 0.5523 0.4415 0.0282 0.0767 -0.0191 9 LEU A CB 44 C CG . LEU A 10 ? 0.7629 0.5733 0.4515 0.0210 0.0877 -0.0180 9 LEU A CG 45 C CD1 . LEU A 10 ? 0.7724 0.5848 0.4603 0.0063 0.0898 -0.0216 9 LEU A CD1 46 C CD2 . LEU A 10 ? 0.7586 0.6051 0.4715 0.0247 0.0885 -0.0137 9 LEU A CD2 47 N N . VAL A 11 ? 0.7566 0.5292 0.4337 0.0493 0.0576 -0.0180 10 VAL A N 48 C CA . VAL A 11 ? 0.7680 0.5265 0.4389 0.0524 0.0471 -0.0193 10 VAL A CA 49 C C . VAL A 11 ? 0.7600 0.5357 0.4468 0.0489 0.0400 -0.0193 10 VAL A C 50 O O . VAL A 11 ? 0.7560 0.5544 0.4600 0.0503 0.0402 -0.0169 10 VAL A O 51 C CB . VAL A 11 ? 0.7910 0.5428 0.4599 0.0608 0.0467 -0.0188 10 VAL A CB 52 C CG1 . VAL A 11 ? 0.7934 0.5307 0.4544 0.0617 0.0357 -0.0207 10 VAL A CG1 53 C CG2 . VAL A 11 ? 0.8192 0.5552 0.4723 0.0640 0.0563 -0.0196 10 VAL A CG2 54 N N . PRO A 12 ? 0.7587 0.5237 0.4394 0.0449 0.0345 -0.0212 11 PRO A N 55 C CA . PRO A 12 ? 0.7462 0.5250 0.4395 0.0406 0.0299 -0.0221 11 PRO A CA 56 C C . PRO A 12 ? 0.7221 0.5029 0.4219 0.0459 0.0210 -0.0213 11 PRO A C 57 O O . PRO A 12 ? 0.7259 0.4949 0.4190 0.0518 0.0177 -0.0205 11 PRO A O 58 C CB . PRO A 12 ? 0.7608 0.5224 0.4430 0.0356 0.0306 -0.0240 11 PRO A CB 59 C CG . PRO A 12 ? 0.7786 0.5171 0.4435 0.0413 0.0287 -0.0223 11 PRO A CG 60 C CD . PRO A 12 ? 0.7837 0.5236 0.4451 0.0448 0.0332 -0.0216 11 PRO A CD 61 N N . GLY A 13 ? 0.7081 0.5033 0.4196 0.0423 0.0177 -0.0219 12 GLY A N 62 C CA . GLY A 13 ? 0.7103 0.5079 0.4284 0.0462 0.0100 -0.0210 12 GLY A CA 63 C C . GLY A 13 ? 0.7189 0.5029 0.4318 0.0453 0.0054 -0.0225 12 GLY A C 64 O O . GLY A 13 ? 0.7438 0.5121 0.4456 0.0438 0.0077 -0.0233 12 GLY A O 65 N N . ASP A 14 ? 0.7409 0.5314 0.4626 0.0469 -0.0003 -0.0220 13 ASP A N 66 C CA . ASP A 14 ? 0.7707 0.5525 0.4915 0.0472 -0.0041 -0.0225 13 ASP A CA 67 C C . ASP A 14 ? 0.7600 0.5392 0.4788 0.0409 0.0020 -0.0254 13 ASP A C 68 O O . ASP A 14 ? 0.7218 0.5143 0.4452 0.0340 0.0066 -0.0281 13 ASP A O 69 C CB . ASP A 14 ? 0.8111 0.6043 0.5438 0.0490 -0.0096 -0.0216 13 ASP A CB 70 C CG . ASP A 14 ? 0.8896 0.6742 0.6227 0.0518 -0.0144 -0.0206 13 ASP A CG 71 O OD1 . ASP A 14 ? 0.9510 0.7215 0.6755 0.0536 -0.0142 -0.0195 13 ASP A OD1 72 O OD2 . ASP A 14 ? 0.9300 0.7233 0.6728 0.0529 -0.0184 -0.0197 13 ASP A OD2 73 N N . LEU A 15 ? 0.7649 0.5268 0.4762 0.0430 0.0027 -0.0245 14 LEU A N 74 C CA . LEU A 15 ? 0.7783 0.5298 0.4842 0.0377 0.0112 -0.0271 14 LEU A CA 75 C C . LEU A 15 ? 0.7675 0.5149 0.4649 0.0313 0.0191 -0.0292 14 LEU A C 76 O O . LEU A 15 ? 0.7572 0.4967 0.4499 0.0242 0.0276 -0.0325 14 LEU A O 77 C CB . LEU A 15 ? 0.7841 0.5460 0.4982 0.0313 0.0143 -0.0316 14 LEU A CB 78 C CG . LEU A 15 ? 0.7857 0.5547 0.5099 0.0361 0.0083 -0.0302 14 LEU A CG 79 C CD1 . LEU A 15 ? 0.7996 0.5768 0.5276 0.0279 0.0136 -0.0356 14 LEU A CD1 80 C CD2 . LEU A 15 ? 0.7873 0.5408 0.5096 0.0449 0.0060 -0.0256 14 LEU A CD2 81 N N . GLY A 16 ? 0.7596 0.5106 0.4542 0.0335 0.0174 -0.0273 15 GLY A N 82 C CA . GLY A 16 ? 0.7430 0.4984 0.4343 0.0270 0.0248 -0.0291 15 GLY A CA 83 C C . GLY A 16 ? 0.7499 0.4847 0.4260 0.0268 0.0311 -0.0277 15 GLY A C 84 O O . GLY A 16 ? 0.7534 0.4920 0.4268 0.0217 0.0375 -0.0288 15 GLY A O 85 N N . ASN A 17 ? 0.7394 0.4540 0.4060 0.0325 0.0295 -0.0244 16 ASN A N 86 C CA . ASN A 17 ? 0.7573 0.4507 0.4083 0.0324 0.0363 -0.0218 16 ASN A CA 87 C C . ASN A 17 ? 0.7769 0.4515 0.4222 0.0376 0.0370 -0.0178 16 ASN A C 88 O O . ASN A 17 ? 0.7572 0.4355 0.4102 0.0435 0.0300 -0.0159 16 ASN A O 89 C CB . ASN A 17 ? 0.7537 0.4426 0.3937 0.0371 0.0341 -0.0186 16 ASN A CB 90 C CG . ASN A 17 ? 0.7467 0.4367 0.3858 0.0456 0.0225 -0.0154 16 ASN A CG 91 O OD1 . ASN A 17 ? 0.7308 0.4316 0.3741 0.0468 0.0188 -0.0171 16 ASN A OD1 92 N ND2 . ASN A 17 ? 0.7492 0.4281 0.3829 0.0514 0.0175 -0.0104 16 ASN A ND2 93 N N . GLN A 18 ? 0.8083 0.4627 0.4408 0.0358 0.0465 -0.0157 17 GLN A N 94 C CA . GLN A 18 ? 0.8347 0.4690 0.4613 0.0426 0.0494 -0.0098 17 GLN A CA 95 C C . GLN A 18 ? 0.8383 0.4726 0.4622 0.0550 0.0376 -0.0011 17 GLN A C 96 O O . GLN A 18 ? 0.8343 0.4750 0.4526 0.0567 0.0303 0.0002 17 GLN A O 97 C CB . GLN A 18 ? 0.8625 0.4729 0.4738 0.0392 0.0625 -0.0076 17 GLN A CB 98 C CG . GLN A 18 ? 0.8731 0.4812 0.4861 0.0250 0.0752 -0.0165 17 GLN A CG 99 C CD . GLN A 18 ? 0.9170 0.4990 0.5141 0.0203 0.0896 -0.0147 17 GLN A CD 100 O OE1 . GLN A 18 ? 0.9411 0.5023 0.5261 0.0299 0.0916 -0.0052 17 GLN A OE1 101 N NE2 . GLN A 18 ? 0.9346 0.5186 0.5316 0.0048 0.0999 -0.0232 17 GLN A NE2 102 N N . LEU A 19 ? 0.8427 0.4705 0.4706 0.0629 0.0365 0.0046 18 LEU A N 103 C CA . LEU A 19 ? 0.8422 0.4703 0.4673 0.0745 0.0266 0.0149 18 LEU A CA 104 C C . LEU A 19 ? 0.8719 0.4793 0.4908 0.0825 0.0350 0.0244 18 LEU A C 105 O O . LEU A 19 ? 0.8709 0.4664 0.4940 0.0807 0.0468 0.0217 18 LEU A O 106 C CB . LEU A 19 ? 0.8182 0.4659 0.4599 0.0783 0.0153 0.0147 18 LEU A CB 107 C CG . LEU A 19 ? 0.8110 0.4779 0.4589 0.0728 0.0062 0.0077 18 LEU A CG 108 C CD1 . LEU A 19 ? 0.8047 0.4879 0.4691 0.0762 -0.0025 0.0080 18 LEU A CD1 109 C CD2 . LEU A 19 ? 0.8148 0.4814 0.4487 0.0734 -0.0007 0.0100 18 LEU A CD2 110 N N . GLU A 20 ? 0.8942 0.4971 0.5025 0.0914 0.0295 0.0359 19 GLU A N 111 C CA . GLU A 20 ? 0.9303 0.5148 0.5328 0.1021 0.0367 0.0484 19 GLU A CA 112 C C . GLU A 20 ? 0.9139 0.5133 0.5238 0.1148 0.0237 0.0606 19 GLU A C 113 O O . GLU A 20 ? 0.9172 0.5365 0.5277 0.1137 0.0086 0.0605 19 GLU A O 114 C CB . GLU A 20 ? 0.9742 0.5391 0.5547 0.1014 0.0437 0.0537 19 GLU A CB 115 C CG . GLU A 20 ? 1.0069 0.5567 0.5808 0.0885 0.0586 0.0430 19 GLU A CG 116 C CD . GLU A 20 ? 1.0557 0.5863 0.6080 0.0871 0.0664 0.0482 19 GLU A CD 117 O OE1 . GLU A 20 ? 1.0968 0.6284 0.6371 0.0951 0.0583 0.0590 19 GLU A OE1 118 O OE2 . GLU A 20 ? 1.0581 0.5737 0.6048 0.0769 0.0807 0.0414 19 GLU A OE2 119 N N . ALA A 21 ? 0.9197 0.5099 0.5355 0.1264 0.0303 0.0712 20 ALA A N 120 C CA . ALA A 21 ? 0.9204 0.5285 0.5463 0.1394 0.0184 0.0848 20 ALA A CA 121 C C . ALA A 21 ? 0.9544 0.5471 0.5734 0.1542 0.0255 0.1030 20 ALA A C 122 O O . ALA A 21 ? 0.9569 0.5209 0.5681 0.1558 0.0433 0.1041 20 ALA A O 123 C CB . ALA A 21 ? 0.9061 0.5294 0.5554 0.1414 0.0167 0.0809 20 ALA A CB 124 N N . LYS A 22 ? 0.9782 0.5912 0.6002 0.1646 0.0116 0.1176 21 LYS A N 125 C CA . LYS A 22 ? 1.0245 0.6303 0.6442 0.1819 0.0159 0.1387 21 LYS A CA 126 C C . LYS A 22 ? 1.0152 0.6513 0.6576 0.1935 0.0042 0.1501 21 LYS A C 127 O O . LYS A 22 ? 1.0010 0.6667 0.6508 0.1869 -0.0133 0.1456 21 LYS A O 128 C CB . LYS A 22 ? 1.0692 0.6735 0.6655 0.1826 0.0088 0.1486 21 LYS A CB 129 C CG . LYS A 22 ? 1.1312 0.7296 0.7237 0.2014 0.0127 0.1727 21 LYS A CG 130 C CD . LYS A 22 ? 1.1816 0.7672 0.7457 0.2002 0.0122 0.1804 21 LYS A CD 131 C CE . LYS A 22 ? 1.2352 0.8167 0.7950 0.2200 0.0154 0.2068 21 LYS A CE 132 N NZ . LYS A 22 ? 1.2721 0.8445 0.8021 0.2177 0.0128 0.2144 21 LYS A NZ 133 N N . LEU A 23 ? 1.0402 0.6686 0.6935 0.2106 0.0149 0.1652 22 LEU A N 134 C CA . LEU A 23 ? 1.0440 0.7009 0.7234 0.2224 0.0075 0.1755 22 LEU A CA 135 C C . LEU A 23 ? 1.0717 0.7417 0.7540 0.2421 0.0029 0.2023 22 LEU A C 136 O O . LEU A 23 ? 1.0939 0.7374 0.7638 0.2530 0.0167 0.2147 22 LEU A O 137 C CB . LEU A 23 ? 1.0473 0.6872 0.7433 0.2272 0.0264 0.1698 22 LEU A CB 138 C CG . LEU A 23 ? 1.0403 0.6628 0.7333 0.2098 0.0358 0.1454 22 LEU A CG 139 C CD1 . LEU A 23 ? 1.0461 0.6516 0.7532 0.2163 0.0552 0.1426 22 LEU A CD1 140 C CD2 . LEU A 23 ? 1.0098 0.6615 0.7095 0.1950 0.0175 0.1314 22 LEU A CD2 141 N N . ASP A 24 ? 1.0659 0.7778 0.7654 0.2461 -0.0159 0.2115 23 ASP A N 142 C CA . ASP A 24 ? 1.1088 0.8431 0.8209 0.2667 -0.0208 0.2386 23 ASP A CA 143 C C . ASP A 24 ? 1.0817 0.8596 0.8236 0.2677 -0.0351 0.2404 23 ASP A C 144 O O . ASP A 24 ? 1.0629 0.8793 0.8076 0.2637 -0.0570 0.2470 23 ASP A O 145 C CB . ASP A 24 ? 1.1427 0.8887 0.8330 0.2673 -0.0351 0.2524 23 ASP A CB 146 C CG . ASP A 24 ? 1.1840 0.9465 0.8835 0.2913 -0.0361 0.2836 23 ASP A CG 147 O OD1 . ASP A 24 ? 1.1863 0.9587 0.9130 0.3077 -0.0286 0.2951 23 ASP A OD1 148 O OD2 . ASP A 24 ? 1.2390 1.0053 0.9184 0.2944 -0.0440 0.2977 23 ASP A OD2 149 N N . LYS A 25 ? 1.0704 0.8411 0.8330 0.2714 -0.0218 0.2333 24 LYS A N 150 C CA . LYS A 25 ? 1.0545 0.8610 0.8441 0.2682 -0.0324 0.2294 24 LYS A CA 151 C C . LYS A 25 ? 1.0714 0.9086 0.8876 0.2902 -0.0345 0.2550 24 LYS A C 152 O O . LYS A 25 ? 1.0969 0.9146 0.9167 0.3101 -0.0171 0.2707 24 LYS A O 153 C CB . LYS A 25 ? 1.0341 0.8180 0.8321 0.2617 -0.0160 0.2098 24 LYS A CB 154 C CG . LYS A 25 ? 1.0199 0.7785 0.7959 0.2404 -0.0139 0.1852 24 LYS A CG 155 C CD . LYS A 25 ? 1.0251 0.7520 0.8027 0.2371 0.0074 0.1698 24 LYS A CD 156 C CE . LYS A 25 ? 1.0001 0.7470 0.8016 0.2339 0.0061 0.1615 24 LYS A CE 157 N NZ . LYS A 25 ? 0.9647 0.7272 0.7633 0.2138 -0.0085 0.1438 24 LYS A NZ 158 N N . PRO A 26 ? 1.0622 0.9477 0.8980 0.2867 -0.0546 0.2598 25 PRO A N 159 C CA . PRO A 26 ? 1.0657 0.9855 0.9318 0.3076 -0.0559 0.2842 25 PRO A CA 160 C C . PRO A 26 ? 1.0527 0.9609 0.9439 0.3193 -0.0350 0.2823 25 PRO A C 161 O O . PRO A 26 ? 1.0588 0.9720 0.9690 0.3430 -0.0235 0.3037 25 PRO A O 162 C CB . PRO A 26 ? 1.0514 1.0251 0.9297 0.2947 -0.0834 0.2848 25 PRO A CB 163 C CG . PRO A 26 ? 1.0310 0.9920 0.8942 0.2684 -0.0891 0.2558 25 PRO A CG 164 C CD . PRO A 26 ? 1.0414 0.9520 0.8732 0.2636 -0.0757 0.2437 25 PRO A CD 165 N N . THR A 27 ? 1.0194 0.9128 0.9104 0.3033 -0.0297 0.2577 26 THR A N 166 C CA . THR A 27 ? 1.0095 0.8913 0.9209 0.3109 -0.0101 0.2527 26 THR A CA 167 C C . THR A 27 ? 1.0122 0.8522 0.9049 0.2944 0.0034 0.2256 26 THR A C 168 O O . THR A 27 ? 0.9875 0.8180 0.8580 0.2752 -0.0061 0.2096 26 THR A O 169 C CB . THR A 27 ? 0.9778 0.9063 0.9205 0.3084 -0.0223 0.2540 26 THR A CB 170 O OG1 . THR A 27 ? 0.9327 0.8737 0.8666 0.2831 -0.0397 0.2339 26 THR A OG1 171 C CG2 . THR A 27 ? 0.9880 0.9653 0.9528 0.3237 -0.0369 0.2816 26 THR A CG2 172 N N . VAL A 28 ? 1.0091 0.8258 0.9113 0.3018 0.0260 0.2208 27 VAL A N 173 C CA . VAL A 28 ? 0.9829 0.7642 0.8696 0.2862 0.0395 0.1958 27 VAL A CA 174 C C . VAL A 28 ? 0.9587 0.7502 0.8668 0.2849 0.0470 0.1873 27 VAL A C 175 O O . VAL A 28 ? 0.9565 0.7721 0.8911 0.3006 0.0493 0.2022 27 VAL A O 176 C CB . VAL A 28 ? 1.0133 0.7423 0.8801 0.2926 0.0650 0.1942 27 VAL A CB 177 C CG1 . VAL A 28 ? 1.0213 0.7329 0.8600 0.2849 0.0586 0.1932 27 VAL A CG1 178 C CG2 . VAL A 28 ? 1.0352 0.7564 0.9174 0.3196 0.0832 0.2161 27 VAL A CG2 179 N N . VAL A 29 ? 0.9308 0.7053 0.8274 0.2665 0.0511 0.1642 28 VAL A N 180 C CA . VAL A 29 ? 0.9179 0.7006 0.8308 0.2628 0.0580 0.1544 28 VAL A CA 181 C C . VAL A 29 ? 0.9548 0.7060 0.8709 0.2752 0.0872 0.1544 28 VAL A C 182 O O . VAL A 29 ? 0.9559 0.7203 0.8918 0.2797 0.0940 0.1540 28 VAL A O 183 C CB . VAL A 29 ? 0.8828 0.6628 0.7828 0.2386 0.0507 0.1309 28 VAL A CB 184 C CG1 . VAL A 29 ? 0.8613 0.6709 0.7593 0.2267 0.0241 0.1302 28 VAL A CG1 185 C CG2 . VAL A 29 ? 0.8883 0.6252 0.7606 0.2284 0.0652 0.1154 28 VAL A CG2 186 N N . HIS A 30 ? 0.9817 0.6909 0.8775 0.2795 0.1050 0.1538 29 HIS A N 187 C CA . HIS A 30 ? 1.0233 0.7005 0.9220 0.2947 0.1344 0.1578 29 HIS A CA 188 C C . HIS A 30 ? 1.0493 0.6915 0.9314 0.3061 0.1480 0.1683 29 HIS A C 189 O O . HIS A 30 ? 1.0704 0.7091 0.9355 0.2998 0.1361 0.1697 29 HIS A O 190 C CB . HIS A 30 ? 1.0435 0.6987 0.9356 0.2818 0.1515 0.1359 29 HIS A CB 191 C CG . HIS A 30 ? 1.0620 0.6868 0.9239 0.2590 0.1550 0.1136 29 HIS A CG 192 N ND1 . HIS A 30 ? 1.1042 0.6815 0.9432 0.2578 0.1771 0.1078 29 HIS A ND1 193 C CD2 . HIS A 30 ? 1.0522 0.6882 0.9043 0.2365 0.1406 0.0957 29 HIS A CD2 194 C CE1 . HIS A 30 ? 1.1025 0.6667 0.9197 0.2345 0.1744 0.0875 29 HIS A CE1 195 N NE2 . HIS A 30 ? 1.0633 0.6629 0.8884 0.2223 0.1526 0.0805 29 HIS A NE2 196 N N . TYR A 31 ? 1.0703 0.6872 0.9586 0.3252 0.1737 0.1783 30 TYR A N 197 C CA . TYR A 31 ? 1.1078 0.6920 0.9844 0.3414 0.1891 0.1937 30 TYR A CA 198 C C . TYR A 31 ? 1.1317 0.6712 0.9736 0.3248 0.1981 0.1782 30 TYR A C 199 O O . TYR A 31 ? 1.1772 0.6980 1.0068 0.3333 0.2019 0.1906 30 TYR A O 200 C CB . TYR A 31 ? 1.1379 0.6997 1.0282 0.3656 0.2185 0.2065 30 TYR A CB 201 C CG . TYR A 31 ? 1.1674 0.6813 1.0418 0.3564 0.2480 0.1855 30 TYR A CG 202 C CD1 . TYR A 31 ? 1.1539 0.6787 1.0355 0.3439 0.2494 0.1679 30 TYR A CD1 203 C CD2 . TYR A 31 ? 1.2197 0.6765 1.0707 0.3596 0.2756 0.1836 30 TYR A CD2 204 C CE1 . TYR A 31 ? 1.1725 0.6540 1.0370 0.3343 0.2764 0.1484 30 TYR A CE1 205 C CE2 . TYR A 31 ? 1.2422 0.6541 1.0763 0.3492 0.3033 0.1633 30 TYR A CE2 206 C CZ . TYR A 31 ? 1.2180 0.6432 1.0583 0.3362 0.3032 0.1455 30 TYR A CZ 207 O OH . TYR A 31 ? 1.2408 0.6223 1.0620 0.3243 0.3305 0.1249 30 TYR A OH 208 N N . LEU A 32 ? 1.1174 0.6397 0.9440 0.3017 0.2032 0.1521 31 LEU A N 209 C CA . LEU A 32 ? 1.1237 0.6071 0.9186 0.2836 0.2116 0.1363 31 LEU A CA 210 C C . LEU A 32 ? 1.0824 0.5874 0.8668 0.2693 0.1851 0.1336 31 LEU A C 211 O O . LEU A 32 ? 1.0832 0.5613 0.8436 0.2555 0.1899 0.1233 31 LEU A O 212 C CB . LEU A 32 ? 1.1346 0.5950 0.9159 0.2623 0.2257 0.1097 31 LEU A CB 213 C CG . LEU A 32 ? 1.1846 0.6102 0.9665 0.2715 0.2576 0.1069 31 LEU A CG 214 C CD1 . LEU A 32 ? 1.1817 0.5978 0.9518 0.2477 0.2647 0.0800 31 LEU A CD1 215 C CD2 . LEU A 32 ? 1.2349 0.6080 0.9987 0.2811 0.2844 0.1137 31 LEU A CD2 216 N N . CYS A 33 ? 1.0507 0.6033 0.8529 0.2725 0.1586 0.1428 32 CYS A N 217 C CA . CYS A 33 ? 1.0345 0.6066 0.8260 0.2603 0.1345 0.1411 32 CYS A CA 218 C C . CYS A 33 ? 1.0675 0.6343 0.8521 0.2751 0.1322 0.1620 32 CYS A C 219 O O . CYS A 33 ? 1.0771 0.6571 0.8782 0.2969 0.1330 0.1838 32 CYS A O 220 C CB . CYS A 33 ? 1.0035 0.6255 0.8136 0.2556 0.1081 0.1412 32 CYS A CB 221 S SG . CYS A 33 ? 1.0098 0.6437 0.8287 0.2385 0.1076 0.1188 32 CYS A SG 222 N N . SER A 34 ? 1.0861 0.6350 0.8464 0.2635 0.1296 0.1564 33 SER A N 223 C CA . SER A 34 ? 1.1120 0.6582 0.8626 0.2751 0.1249 0.1755 33 SER A CA 224 C C . SER A 34 ? 1.1013 0.6967 0.8639 0.2787 0.0958 0.1879 33 SER A C 225 O O . SER A 34 ? 1.0662 0.6868 0.8296 0.2623 0.0770 0.1748 33 SER A O 226 C CB . SER A 34 ? 1.1167 0.6331 0.8382 0.2587 0.1294 0.1635 33 SER A CB 227 O OG . SER A 34 ? 1.1613 0.6706 0.8705 0.2694 0.1274 0.1816 33 SER A OG 228 N N . LYS A 35 ? 1.1718 0.7799 0.9422 0.2996 0.0926 0.2135 34 LYS A N 229 C CA . LYS A 35 ? 1.1840 0.8390 0.9625 0.3023 0.0649 0.2270 34 LYS A CA 230 C C . LYS A 35 ? 1.1902 0.8397 0.9418 0.2930 0.0536 0.2275 34 LYS A C 231 O O . LYS A 35 ? 1.1819 0.8631 0.9309 0.2822 0.0300 0.2247 34 LYS A O 232 C CB . LYS A 35 ? 1.2249 0.9021 1.0249 0.3289 0.0649 0.2561 34 LYS A CB 233 C CG . LYS A 35 ? 1.2639 0.9441 1.0910 0.3413 0.0795 0.2581 34 LYS A CG 234 C CD . LYS A 35 ? 1.3086 1.0216 1.1618 0.3675 0.0760 0.2881 34 LYS A CD 235 C CE . LYS A 35 ? 1.2998 1.0736 1.1696 0.3617 0.0447 0.2939 34 LYS A CE 236 N NZ . LYS A 35 ? 1.3167 1.1284 1.2212 0.3841 0.0437 0.3174 34 LYS A NZ 237 N N . LYS A 36 ? 1.2296 0.8374 0.9601 0.2964 0.0716 0.2302 35 LYS A N 238 C CA . LYS A 36 ? 1.2566 0.8585 0.9624 0.2921 0.0636 0.2358 35 LYS A CA 239 C C . LYS A 36 ? 1.2546 0.8081 0.9351 0.2810 0.0831 0.2221 35 LYS A C 240 O O . LYS A 36 ? 1.2662 0.7841 0.9464 0.2862 0.1074 0.2201 35 LYS A O 241 C CB . LYS A 36 ? 1.3229 0.9344 1.0310 0.3159 0.0621 0.2668 35 LYS A CB 242 C CG . LYS A 36 ? 1.3848 1.0012 1.0683 0.3119 0.0485 0.2752 35 LYS A CG 243 C CD . LYS A 36 ? 1.4566 1.0850 1.1430 0.3365 0.0469 0.3080 35 LYS A CD 244 C CE . LYS A 36 ? 1.4894 1.1324 1.1519 0.3312 0.0287 0.3168 35 LYS A CE 245 N NZ . LYS A 36 ? 1.5484 1.2129 1.2157 0.3550 0.0232 0.3505 35 LYS A NZ 246 N N . THR A 37 ? 1.2435 0.7959 0.9028 0.2648 0.0730 0.2124 36 THR A N 247 C CA . THR A 37 ? 1.2654 0.7755 0.8996 0.2547 0.0901 0.2030 36 THR A CA 248 C C . THR A 37 ? 1.3078 0.8174 0.9200 0.2570 0.0822 0.2164 36 THR A C 249 O O . THR A 37 ? 1.3023 0.8465 0.9140 0.2562 0.0594 0.2224 36 THR A O 250 C CB . THR A 37 ? 1.2291 0.7348 0.8573 0.2297 0.0895 0.1748 36 THR A CB 251 O OG1 . THR A 37 ? 1.1985 0.7360 0.8231 0.2184 0.0658 0.1689 36 THR A OG1 252 C CG2 . THR A 37 ? 1.2146 0.7233 0.8626 0.2261 0.0959 0.1614 36 THR A CG2 253 N N . GLU A 38 ? 1.3681 0.8372 0.9606 0.2593 0.1018 0.2210 37 GLU A N 254 C CA . GLU A 38 ? 1.4205 0.8840 0.9890 0.2612 0.0973 0.2338 37 GLU A CA 255 C C . GLU A 38 ? 1.3659 0.8332 0.9164 0.2384 0.0875 0.2150 37 GLU A C 256 O O . GLU A 38 ? 1.3604 0.8376 0.8933 0.2373 0.0758 0.2230 37 GLU A O 257 C CB . GLU A 38 ? 1.5310 0.9466 1.0841 0.2710 0.1241 0.2452 37 GLU A CB 258 C CG . GLU A 38 ? 1.6143 1.0213 1.1817 0.2976 0.1366 0.2688 37 GLU A CG 259 C CD . GLU A 38 ? 1.6749 1.1117 1.2433 0.3174 0.1203 0.2982 37 GLU A CD 260 O OE1 . GLU A 38 ? 1.6989 1.1112 1.2530 0.3324 0.1330 0.3193 37 GLU A OE1 261 O OE2 . GLU A 38 ? 1.6896 1.1746 1.2722 0.3174 0.0950 0.3005 37 GLU A OE2 262 N N . SER A 39 ? 1.3128 0.7726 0.8671 0.2205 0.0931 0.1907 38 SER A N 263 C CA . SER A 39 ? 1.2775 0.7422 0.8184 0.2000 0.0856 0.1729 38 SER A CA 264 C C . SER A 39 ? 1.1956 0.6813 0.7534 0.1862 0.0772 0.1519 38 SER A C 265 O O . SER A 39 ? 1.1437 0.6391 0.7224 0.1914 0.0775 0.1503 38 SER A O 266 C CB . SER A 39 ? 1.3113 0.7363 0.8322 0.1899 0.1067 0.1658 38 SER A CB 267 O OG . SER A 39 ? 1.3198 0.7136 0.8463 0.1931 0.1294 0.1640 38 SER A OG 268 N N . TYR A 40 ? 1.1443 0.6369 0.6927 0.1691 0.0706 0.1366 39 TYR A N 269 C CA . TYR A 40 ? 1.0777 0.5870 0.6397 0.1552 0.0648 0.1166 39 TYR A CA 270 C C . TYR A 40 ? 1.0636 0.5487 0.6294 0.1466 0.0847 0.1037 39 TYR A C 271 O O . TYR A 40 ? 1.0861 0.5399 0.6377 0.1445 0.1023 0.1050 39 TYR A O 272 C CB . TYR A 40 ? 1.0460 0.5690 0.5969 0.1412 0.0536 0.1056 39 TYR A CB 273 C CG . TYR A 40 ? 1.0420 0.5928 0.5909 0.1456 0.0322 0.1133 39 TYR A CG 274 C CD1 . TYR A 40 ? 1.0637 0.6124 0.5949 0.1540 0.0275 0.1295 39 TYR A CD1 275 C CD2 . TYR A 40 ? 1.0082 0.5872 0.5716 0.1405 0.0171 0.1045 39 TYR A CD2 276 C CE1 . TYR A 40 ? 1.0512 0.6266 0.5786 0.1557 0.0077 0.1358 39 TYR A CE1 277 C CE2 . TYR A 40 ? 1.0104 0.6135 0.5704 0.1420 -0.0015 0.1103 39 TYR A CE2 278 C CZ . TYR A 40 ? 1.0373 0.6392 0.5789 0.1490 -0.0065 0.1254 39 TYR A CZ 279 O OH . TYR A 40 ? 1.0459 0.6731 0.5822 0.1481 -0.0255 0.1301 39 TYR A OH 280 N N . PHE A 41 ? 1.0165 0.5158 0.6004 0.1412 0.0821 0.0917 40 PHE A N 281 C CA . PHE A 41 ? 1.0057 0.4875 0.5923 0.1297 0.0984 0.0770 40 PHE A CA 282 C C . PHE A 41 ? 0.9785 0.4861 0.5752 0.1152 0.0875 0.0601 40 PHE A C 283 O O . PHE A 41 ? 0.9425 0.4783 0.5475 0.1172 0.0694 0.0610 40 PHE A O 284 C CB . PHE A 41 ? 1.0082 0.4777 0.6068 0.1405 0.1100 0.0817 40 PHE A CB 285 C CG . PHE A 41 ? 0.9823 0.4822 0.6026 0.1481 0.0957 0.0836 40 PHE A CG 286 C CD1 . PHE A 41 ? 0.9829 0.5012 0.6107 0.1645 0.0829 0.1009 40 PHE A CD1 287 C CD2 . PHE A 41 ? 0.9591 0.4711 0.5922 0.1380 0.0950 0.0685 40 PHE A CD2 288 C CE1 . PHE A 41 ? 0.9632 0.5110 0.6119 0.1700 0.0701 0.1025 40 PHE A CE1 289 C CE2 . PHE A 41 ? 0.9414 0.4804 0.5941 0.1445 0.0830 0.0704 40 PHE A CE2 290 C CZ . PHE A 41 ? 0.9458 0.5027 0.6070 0.1602 0.0708 0.0871 40 PHE A CZ 291 N N . THR A 42 ? 0.9681 0.4665 0.5637 0.1001 0.0989 0.0451 41 THR A N 292 C CA . THR A 42 ? 0.9285 0.4517 0.5340 0.0872 0.0900 0.0306 41 THR A CA 293 C C . THR A 42 ? 0.9220 0.4613 0.5463 0.0914 0.0846 0.0281 41 THR A C 294 O O . THR A 42 ? 0.9742 0.4985 0.6020 0.0922 0.0974 0.0258 41 THR A O 295 C CB . THR A 42 ? 0.9302 0.4432 0.5293 0.0687 0.1029 0.0164 41 THR A CB 296 O OG1 . THR A 42 ? 0.9278 0.4301 0.5113 0.0639 0.1069 0.0183 41 THR A OG1 297 C CG2 . THR A 42 ? 0.9039 0.4460 0.5152 0.0570 0.0935 0.0035 41 THR A CG2 298 N N . ILE A 43 ? 0.8941 0.4623 0.5292 0.0936 0.0668 0.0284 42 ILE A N 299 C CA . ILE A 43 ? 0.8782 0.4647 0.5316 0.0969 0.0605 0.0263 42 ILE A CA 300 C C . ILE A 43 ? 0.8594 0.4629 0.5199 0.0828 0.0575 0.0116 42 ILE A C 301 O O . ILE A 43 ? 0.8393 0.4527 0.5123 0.0824 0.0572 0.0074 42 ILE A O 302 C CB . ILE A 43 ? 0.8675 0.4747 0.5296 0.1090 0.0436 0.0377 42 ILE A CB 303 C CG1 . ILE A 43 ? 0.8669 0.4861 0.5480 0.1164 0.0420 0.0400 42 ILE A CG1 304 C CG2 . ILE A 43 ? 0.8455 0.4740 0.5064 0.1022 0.0282 0.0331 42 ILE A CG2 305 C CD1 . ILE A 43 ? 0.8696 0.5109 0.5609 0.1275 0.0263 0.0519 42 ILE A CD1 306 N N . TRP A 44 ? 0.8726 0.4805 0.5253 0.0719 0.0559 0.0049 43 TRP A N 307 C CA . TRP A 44 ? 0.8816 0.5043 0.5396 0.0582 0.0560 -0.0075 43 TRP A CA 308 C C . TRP A 44 ? 0.9051 0.5197 0.5509 0.0467 0.0640 -0.0129 43 TRP A C 309 O O . TRP A 44 ? 0.9181 0.5309 0.5554 0.0491 0.0603 -0.0081 43 TRP A O 310 C CB . TRP A 44 ? 0.8759 0.5259 0.5445 0.0592 0.0401 -0.0082 43 TRP A CB 311 C CG . TRP A 44 ? 0.8818 0.5493 0.5572 0.0475 0.0398 -0.0184 43 TRP A CG 312 C CD1 . TRP A 44 ? 0.8787 0.5571 0.5517 0.0395 0.0384 -0.0227 43 TRP A CD1 313 C CD2 . TRP A 44 ? 0.8889 0.5665 0.5744 0.0430 0.0414 -0.0243 43 TRP A CD2 314 N NE1 . TRP A 44 ? 0.8639 0.5607 0.5461 0.0308 0.0381 -0.0298 43 TRP A NE1 315 C CE2 . TRP A 44 ? 0.8801 0.5764 0.5689 0.0321 0.0396 -0.0314 43 TRP A CE2 316 C CE3 . TRP A 44 ? 0.9142 0.5879 0.6066 0.0474 0.0446 -0.0238 43 TRP A CE3 317 C CZ2 . TRP A 44 ? 0.8808 0.5925 0.5778 0.0250 0.0399 -0.0376 43 TRP A CZ2 318 C CZ3 . TRP A 44 ? 0.9023 0.5891 0.6020 0.0399 0.0459 -0.0313 43 TRP A CZ3 319 C CH2 . TRP A 44 ? 0.8857 0.5915 0.5869 0.0284 0.0430 -0.0380 43 TRP A CH2 320 N N . LEU A 45 ? 0.9234 0.5337 0.5673 0.0331 0.0752 -0.0227 44 LEU A N 321 C CA . LEU A 45 ? 0.9347 0.5446 0.5846 0.0278 0.0816 -0.0298 44 LEU A CA 322 C C . LEU A 45 ? 0.9652 0.5413 0.6035 0.0265 0.0997 -0.0303 44 LEU A C 323 O O . LEU A 45 ? 0.9753 0.5357 0.6012 0.0168 0.1103 -0.0336 44 LEU A O 324 C CB . LEU A 45 ? 0.9352 0.5661 0.5889 0.0111 0.0812 -0.0412 44 LEU A CB 325 C CG . LEU A 45 ? 0.9581 0.5883 0.6130 0.0004 0.0896 -0.0510 44 LEU A CG 326 C CD1 . LEU A 45 ? 0.9578 0.5960 0.6241 0.0108 0.0833 -0.0483 44 LEU A CD1 327 C CD2 . LEU A 45 ? 0.9505 0.6061 0.6081 -0.0168 0.0876 -0.0603 44 LEU A CD2 328 N N . ASN A 46 ? 0.9854 0.5497 0.6278 0.0363 0.1044 -0.0267 45 ASN A N 329 C CA . ASN A 46 ? 1.0194 0.5485 0.6510 0.0362 0.1241 -0.0273 45 ASN A CA 330 C C . ASN A 46 ? 1.0170 0.5451 0.6552 0.0350 0.1305 -0.0338 45 ASN A C 331 O O . ASN A 46 ? 0.9920 0.5289 0.6427 0.0492 0.1242 -0.0265 45 ASN A O 332 C CB . ASN A 46 ? 1.0511 0.5612 0.6796 0.0552 0.1261 -0.0114 45 ASN A CB 333 C CG . ASN A 46 ? 1.1046 0.5743 0.7212 0.0575 0.1485 -0.0096 45 ASN A CG 334 O OD1 . ASN A 46 ? 1.1334 0.5874 0.7453 0.0467 0.1632 -0.0208 45 ASN A OD1 335 N ND2 . ASN A 46 ? 1.1373 0.5889 0.7476 0.0719 0.1517 0.0048 45 ASN A ND2 336 N N . LEU A 47 ? 1.0491 0.5684 0.6785 0.0166 0.1428 -0.0478 46 LEU A N 337 C CA . LEU A 47 ? 1.0721 0.5945 0.7052 0.0110 0.1480 -0.0569 46 LEU A CA 338 C C . LEU A 47 ? 1.0920 0.5864 0.7253 0.0255 0.1621 -0.0512 46 LEU A C 339 O O . LEU A 47 ? 1.0634 0.5659 0.7055 0.0297 0.1618 -0.0529 46 LEU A O 340 C CB . LEU A 47 ? 1.0849 0.6026 0.7049 -0.0142 0.1592 -0.0737 46 LEU A CB 341 C CG . LEU A 47 ? 1.0742 0.6285 0.6984 -0.0294 0.1451 -0.0799 46 LEU A CG 342 C CD1 . LEU A 47 ? 1.0920 0.6404 0.7018 -0.0552 0.1572 -0.0948 46 LEU A CD1 343 C CD2 . LEU A 47 ? 1.0353 0.6248 0.6749 -0.0262 0.1294 -0.0799 46 LEU A CD2 344 N N . GLU A 48 ? 1.1378 0.5999 0.7619 0.0347 0.1747 -0.0429 47 GLU A N 345 C CA . GLU A 48 ? 1.2240 0.6578 0.8488 0.0505 0.1903 -0.0355 47 GLU A CA 346 C C . GLU A 48 ? 1.1979 0.6530 0.8431 0.0731 0.1769 -0.0207 47 GLU A C 347 O O . GLU A 48 ? 1.2737 0.7161 0.9253 0.0857 0.1880 -0.0161 47 GLU A O 348 C CB . GLU A 48 ? 1.2870 0.6827 0.8978 0.0570 0.2059 -0.0270 47 GLU A CB 349 C CG . GLU A 48 ? 1.3662 0.7321 0.9553 0.0350 0.2246 -0.0411 47 GLU A CG 350 C CD . GLU A 48 ? 1.4632 0.7922 1.0385 0.0421 0.2389 -0.0310 47 GLU A CD 351 O OE1 . GLU A 48 ? 1.4585 0.7988 1.0375 0.0541 0.2262 -0.0170 47 GLU A OE1 352 O OE2 . GLU A 48 ? 1.5480 0.8350 1.1071 0.0352 0.2639 -0.0370 47 GLU A OE2 353 N N . LEU A 49 ? 1.1202 0.6083 0.7760 0.0774 0.1542 -0.0140 48 LEU A N 354 C CA . LEU A 49 ? 1.0642 0.5754 0.7388 0.0959 0.1400 -0.0005 48 LEU A CA 355 C C . LEU A 49 ? 1.0307 0.5682 0.7197 0.0925 0.1321 -0.0075 48 LEU A C 356 O O . LEU A 49 ? 1.0211 0.5771 0.7276 0.1067 0.1234 0.0022 48 LEU A O 357 C CB . LEU A 49 ? 1.0326 0.5650 0.7094 0.1003 0.1202 0.0084 48 LEU A CB 358 C CG . LEU A 49 ? 1.0471 0.5578 0.7081 0.1017 0.1255 0.0150 48 LEU A CG 359 C CD1 . LEU A 49 ? 1.0227 0.5573 0.6848 0.1036 0.1052 0.0214 48 LEU A CD1 360 C CD2 . LEU A 49 ? 1.0752 0.5588 0.7343 0.1196 0.1394 0.0295 48 LEU A CD2 361 N N . LEU A 50 ? 1.0265 0.5679 0.7085 0.0732 0.1349 -0.0236 49 LEU A N 362 C CA . LEU A 50 ? 1.0030 0.5718 0.6961 0.0676 0.1257 -0.0304 49 LEU A CA 363 C C . LEU A 50 ? 1.0147 0.5688 0.7051 0.0634 0.1428 -0.0394 49 LEU A C 364 O O . LEU A 50 ? 0.9999 0.5745 0.6969 0.0572 0.1375 -0.0459 49 LEU A O 365 C CB . LEU A 50 ? 0.9807 0.5716 0.6697 0.0500 0.1142 -0.0402 49 LEU A CB 366 C CG . LEU A 50 ? 0.9654 0.5645 0.6525 0.0515 0.1018 -0.0339 49 LEU A CG 367 C CD1 . LEU A 50 ? 0.9464 0.5645 0.6294 0.0343 0.0949 -0.0437 49 LEU A CD1 368 C CD2 . LEU A 50 ? 0.9567 0.5759 0.6587 0.0671 0.0852 -0.0213 49 LEU A CD2 369 N N . LEU A 51 ? 1.0421 0.5592 0.7220 0.0673 0.1644 -0.0393 50 LEU A N 370 C CA . LEU A 51 ? 1.0828 0.5810 0.7589 0.0656 0.1834 -0.0471 50 LEU A CA 371 C C . LEU A 51 ? 1.0648 0.5796 0.7622 0.0836 0.1794 -0.0372 50 LEU A C 372 O O . LEU A 51 ? 1.0654 0.5981 0.7792 0.1002 0.1657 -0.0218 50 LEU A O 373 C CB . LEU A 51 ? 1.1511 0.6022 0.8119 0.0689 0.2089 -0.0470 50 LEU A CB 374 C CG . LEU A 51 ? 1.1845 0.6131 0.8237 0.0518 0.2169 -0.0555 50 LEU A CG 375 C CD1 . LEU A 51 ? 1.2150 0.5936 0.8403 0.0582 0.2438 -0.0530 50 LEU A CD1 376 C CD2 . LEU A 51 ? 1.1909 0.6290 0.8173 0.0240 0.2169 -0.0756 50 LEU A CD2 377 N N . PRO A 52 ? 1.0665 0.5772 0.7632 0.0792 0.1910 -0.0462 51 PRO A N 378 C CA . PRO A 52 ? 1.0540 0.5866 0.7722 0.0935 0.1855 -0.0381 51 PRO A CA 379 C C . PRO A 52 ? 1.0381 0.5627 0.7713 0.1190 0.1902 -0.0192 51 PRO A C 380 O O . PRO A 52 ? 1.0085 0.5625 0.7611 0.1309 0.1723 -0.0063 51 PRO A O 381 C CB . PRO A 52 ? 1.0726 0.5912 0.7815 0.0839 0.2038 -0.0519 51 PRO A CB 382 C CG . PRO A 52 ? 1.0838 0.5951 0.7696 0.0582 0.2057 -0.0692 51 PRO A CG 383 C CD . PRO A 52 ? 1.0879 0.5823 0.7643 0.0574 0.2055 -0.0655 51 PRO A CD 384 N N . VAL A 53 ? 1.0701 0.5550 0.7929 0.1265 0.2134 -0.0170 52 VAL A N 385 C CA . VAL A 53 ? 1.0961 0.5704 0.8320 0.1526 0.2206 0.0031 52 VAL A CA 386 C C . VAL A 53 ? 1.0627 0.5606 0.8107 0.1651 0.1989 0.0210 52 VAL A C 387 O O . VAL A 53 ? 1.0706 0.5749 0.8353 0.1867 0.1991 0.0391 52 VAL A O 388 C CB . VAL A 53 ? 1.1640 0.5849 0.8809 0.1552 0.2515 0.0006 52 VAL A CB 389 C CG1 . VAL A 53 ? 1.1696 0.5686 0.8656 0.1442 0.2523 -0.0026 52 VAL A CG1 390 C CG2 . VAL A 53 ? 1.1970 0.6056 0.9298 0.1840 0.2657 0.0204 52 VAL A CG2 391 N N . ILE A 54 ? 1.0308 0.5455 0.7717 0.1516 0.1797 0.0163 53 ILE A N 392 C CA . ILE A 54 ? 1.0222 0.5516 0.7679 0.1609 0.1629 0.0310 53 ILE A CA 393 C C . ILE A 54 ? 0.9677 0.5325 0.7169 0.1492 0.1367 0.0266 53 ILE A C 394 O O . ILE A 54 ? 0.9584 0.5380 0.7109 0.1552 0.1216 0.0372 53 ILE A O 395 C CB . ILE A 54 ? 1.0744 0.5687 0.8006 0.1616 0.1750 0.0342 53 ILE A CB 396 C CG1 . ILE A 54 ? 1.0953 0.5706 0.7985 0.1373 0.1820 0.0146 53 ILE A CG1 397 C CG2 . ILE A 54 ? 1.1285 0.5894 0.8552 0.1797 0.1997 0.0447 53 ILE A CG2 398 C CD1 . ILE A 54 ? 1.1130 0.5578 0.7976 0.1360 0.1914 0.0180 53 ILE A CD1 399 N N . ILE A 55 ? 0.9226 0.5010 0.6705 0.1329 0.1320 0.0117 54 ILE A N 400 C CA . ILE A 55 ? 0.8842 0.4959 0.6378 0.1240 0.1092 0.0087 54 ILE A CA 401 C C . ILE A 55 ? 0.8558 0.4978 0.6302 0.1376 0.0919 0.0229 54 ILE A C 402 O O . ILE A 55 ? 0.8544 0.5169 0.6303 0.1340 0.0735 0.0248 54 ILE A O 403 C CB . ILE A 55 ? 0.8685 0.4918 0.6215 0.1084 0.1093 -0.0064 54 ILE A CB 404 C CG1 . ILE A 55 ? 0.8404 0.4932 0.5965 0.0984 0.0886 -0.0100 54 ILE A CG1 405 C CG2 . ILE A 55 ? 0.8597 0.4915 0.6283 0.1167 0.1149 -0.0042 54 ILE A CG2 406 C CD1 . ILE A 55 ? 0.8711 0.5171 0.6108 0.0858 0.0861 -0.0167 54 ILE A CD1 407 N N . ASP A 56 ? 0.8690 0.5146 0.6595 0.1524 0.0982 0.0325 55 ASP A N 408 C CA . ASP A 56 ? 0.8573 0.5344 0.6689 0.1645 0.0820 0.0468 55 ASP A CA 409 C C . ASP A 56 ? 0.8602 0.5388 0.6685 0.1735 0.0724 0.0607 55 ASP A C 410 O O . ASP A 56 ? 0.8399 0.5461 0.6562 0.1740 0.0529 0.0671 55 ASP A O 411 C CB . ASP A 56 ? 0.8817 0.5641 0.7132 0.1797 0.0924 0.0558 55 ASP A CB 412 C CG . ASP A 56 ? 0.8901 0.5808 0.7283 0.1714 0.0972 0.0442 55 ASP A CG 413 O OD1 . ASP A 56 ? 0.8937 0.6014 0.7299 0.1571 0.0842 0.0346 55 ASP A OD1 414 O OD2 . ASP A 56 ? 0.9293 0.6091 0.7746 0.1799 0.1147 0.0455 55 ASP A OD2 415 N N . CYS A 57 ? 0.8821 0.5303 0.6771 0.1797 0.0867 0.0649 56 CYS A N 416 C CA . CYS A 57 ? 0.8997 0.5451 0.6867 0.1869 0.0795 0.0775 56 CYS A CA 417 C C . CYS A 57 ? 0.8670 0.5200 0.6398 0.1710 0.0641 0.0684 56 CYS A C 418 O O . CYS A 57 ? 0.8614 0.5328 0.6345 0.1733 0.0473 0.0768 56 CYS A O 419 C CB . CYS A 57 ? 0.9487 0.5542 0.7213 0.1947 0.1011 0.0821 56 CYS A CB 420 S SG . CYS A 57 ? 0.9896 0.5766 0.7757 0.2138 0.1255 0.0912 56 CYS A SG 421 N N . TRP A 58 ? 0.8522 0.4913 0.6118 0.1547 0.0704 0.0515 57 TRP A N 422 C CA . TRP A 58 ? 0.8312 0.4766 0.5785 0.1403 0.0587 0.0427 57 TRP A CA 423 C C . TRP A 58 ? 0.8030 0.4822 0.5621 0.1367 0.0383 0.0423 57 TRP A C 424 O O . TRP A 58 ? 0.7848 0.4745 0.5385 0.1348 0.0246 0.0455 57 TRP A O 425 C CB . TRP A 58 ? 0.8213 0.4514 0.5565 0.1238 0.0697 0.0256 57 TRP A CB 426 C CG . TRP A 58 ? 0.8055 0.4437 0.5305 0.1099 0.0597 0.0172 57 TRP A CG 427 C CD1 . TRP A 58 ? 0.8305 0.4560 0.5400 0.1063 0.0603 0.0180 57 TRP A CD1 428 C CD2 . TRP A 58 ? 0.7782 0.4388 0.5081 0.0986 0.0490 0.0077 57 TRP A CD2 429 N NE1 . TRP A 58 ? 0.8036 0.4430 0.5091 0.0939 0.0510 0.0093 57 TRP A NE1 430 C CE2 . TRP A 58 ? 0.7733 0.4340 0.4912 0.0895 0.0441 0.0034 57 TRP A CE2 431 C CE3 . TRP A 58 ? 0.7590 0.4391 0.5022 0.0960 0.0442 0.0032 57 TRP A CE3 432 C CZ2 . TRP A 58 ? 0.7595 0.4392 0.4795 0.0792 0.0349 -0.0043 57 TRP A CZ2 433 C CZ3 . TRP A 58 ? 0.7320 0.4302 0.4760 0.0851 0.0345 -0.0044 57 TRP A CZ3 434 C CH2 . TRP A 58 ? 0.7338 0.4317 0.4667 0.0775 0.0302 -0.0077 57 TRP A CH2 435 N N . ILE A 59 ? 0.7884 0.4830 0.5626 0.1356 0.0374 0.0383 58 ILE A N 436 C CA . ILE A 59 ? 0.7801 0.5049 0.5668 0.1324 0.0201 0.0383 58 ILE A CA 437 C C . ILE A 59 ? 0.7800 0.5220 0.5741 0.1425 0.0066 0.0529 58 ILE A C 438 O O . ILE A 59 ? 0.7659 0.5235 0.5577 0.1367 -0.0087 0.0525 58 ILE A O 439 C CB . ILE A 59 ? 0.7746 0.5124 0.5788 0.1334 0.0236 0.0358 58 ILE A CB 440 C CG1 . ILE A 59 ? 0.7857 0.5118 0.5825 0.1218 0.0350 0.0212 58 ILE A CG1 441 C CG2 . ILE A 59 ? 0.7466 0.5149 0.5648 0.1311 0.0063 0.0380 58 ILE A CG2 442 C CD1 . ILE A 59 ? 0.7979 0.5333 0.5871 0.1074 0.0257 0.0110 58 ILE A CD1 443 N N . ASP A 60 ? 0.8046 0.5440 0.6072 0.1575 0.0130 0.0660 59 ASP A N 444 C CA . ASP A 60 ? 0.8182 0.5788 0.6294 0.1674 -0.0003 0.0816 59 ASP A CA 445 C C . ASP A 60 ? 0.8312 0.5866 0.6232 0.1645 -0.0094 0.0849 59 ASP A C 446 O O . ASP A 60 ? 0.8536 0.6312 0.6481 0.1654 -0.0255 0.0928 59 ASP A O 447 C CB . ASP A 60 ? 0.8360 0.5964 0.6612 0.1862 0.0091 0.0977 59 ASP A CB 448 C CG . ASP A 60 ? 0.8383 0.6327 0.6790 0.1950 -0.0072 0.1139 59 ASP A CG 449 O OD1 . ASP A 60 ? 0.8072 0.6293 0.6601 0.1874 -0.0207 0.1106 59 ASP A OD1 450 O OD2 . ASP A 60 ? 0.8761 0.6704 0.7165 0.2087 -0.0067 0.1304 59 ASP A OD2 451 N N . ASN A 61 ? 0.8248 0.5517 0.5973 0.1602 0.0011 0.0786 60 ASN A N 452 C CA . ASN A 61 ? 0.8373 0.5560 0.5899 0.1574 -0.0048 0.0812 60 ASN A CA 453 C C . ASN A 61 ? 0.8274 0.5496 0.5686 0.1415 -0.0136 0.0677 60 ASN A C 454 O O . ASN A 61 ? 0.8124 0.5401 0.5418 0.1386 -0.0247 0.0704 60 ASN A O 455 C CB . ASN A 61 ? 0.8518 0.5370 0.5891 0.1617 0.0125 0.0833 60 ASN A CB 456 C CG . ASN A 61 ? 0.8673 0.5463 0.6115 0.1803 0.0206 0.1010 60 ASN A CG 457 O OD1 . ASN A 61 ? 0.8713 0.5742 0.6270 0.1906 0.0090 0.1154 60 ASN A OD1 458 N ND2 . ASN A 61 ? 0.8857 0.5328 0.6227 0.1845 0.0411 0.1006 60 ASN A ND2 459 N N . ILE A 62 ? 0.8158 0.5346 0.5594 0.1315 -0.0080 0.0538 61 ILE A N 460 C CA . ILE A 62 ? 0.8200 0.5409 0.5538 0.1181 -0.0138 0.0421 61 ILE A CA 461 C C . ILE A 62 ? 0.7883 0.5334 0.5330 0.1126 -0.0274 0.0383 61 ILE A C 462 O O . ILE A 62 ? 0.7691 0.5168 0.5059 0.1036 -0.0332 0.0310 61 ILE A O 463 C CB . ILE A 62 ? 0.8376 0.5430 0.5657 0.1091 -0.0006 0.0298 61 ILE A CB 464 C CG1 . ILE A 62 ? 0.8487 0.5518 0.5629 0.0988 -0.0040 0.0222 61 ILE A CG1 465 C CG2 . ILE A 62 ? 0.8068 0.5226 0.5495 0.1054 0.0019 0.0226 61 ILE A CG2 466 C CD1 . ILE A 62 ? 0.8763 0.5683 0.5849 0.0892 0.0077 0.0116 61 ILE A CD1 467 N N . ARG A 63 ? 0.7815 0.5433 0.5444 0.1181 -0.0311 0.0435 62 ARG A N 468 C CA . ARG A 63 ? 0.7905 0.5747 0.5636 0.1126 -0.0438 0.0412 62 ARG A CA 469 C C . ARG A 63 ? 0.8033 0.5961 0.5666 0.1101 -0.0578 0.0456 62 ARG A C 470 O O . ARG A 63 ? 0.8217 0.6107 0.5763 0.1165 -0.0596 0.0548 62 ARG A O 471 C CB . ARG A 63 ? 0.7957 0.5977 0.5912 0.1190 -0.0446 0.0472 62 ARG A CB 472 C CG . ARG A 63 ? 0.8370 0.6511 0.6403 0.1305 -0.0499 0.0624 62 ARG A CG 473 C CD . ARG A 63 ? 0.8437 0.6749 0.6714 0.1384 -0.0473 0.0690 62 ARG A CD 474 N NE . ARG A 63 ? 0.8942 0.7351 0.7297 0.1524 -0.0491 0.0857 62 ARG A NE 475 C CZ . ARG A 63 ? 0.9177 0.7871 0.7633 0.1544 -0.0639 0.0963 62 ARG A CZ 476 N NH1 . ARG A 63 ? 0.9217 0.8109 0.7704 0.1421 -0.0777 0.0907 62 ARG A NH1 477 N NH2 . ARG A 63 ? 0.9405 0.8190 0.7931 0.1687 -0.0643 0.1132 62 ARG A NH2 478 N N . LEU A 64 ? 0.7910 0.5933 0.5534 0.1003 -0.0666 0.0386 63 LEU A N 479 C CA . LEU A 64 ? 0.7901 0.6037 0.5449 0.0957 -0.0805 0.0413 63 LEU A CA 480 C C . LEU A 64 ? 0.7786 0.6182 0.5524 0.0956 -0.0903 0.0467 63 LEU A C 481 O O . LEU A 64 ? 0.7715 0.6188 0.5621 0.0950 -0.0869 0.0437 63 LEU A O 482 C CB . LEU A 64 ? 0.7908 0.5964 0.5318 0.0843 -0.0826 0.0301 63 LEU A CB 483 C CG . LEU A 64 ? 0.8044 0.5881 0.5273 0.0827 -0.0739 0.0244 63 LEU A CG 484 C CD1 . LEU A 64 ? 0.8138 0.5931 0.5280 0.0732 -0.0752 0.0145 63 LEU A CD1 485 C CD2 . LEU A 64 ? 0.8291 0.6039 0.5348 0.0867 -0.0751 0.0313 63 LEU A CD2 486 N N . VAL A 65 ? 0.7747 0.6293 0.5456 0.0956 -0.1022 0.0550 64 VAL A N 487 C CA . VAL A 65 ? 0.7785 0.6617 0.5665 0.0929 -0.1133 0.0601 64 VAL A CA 488 C C . VAL A 65 ? 0.7872 0.6735 0.5638 0.0769 -0.1231 0.0505 64 VAL A C 489 O O . VAL A 65 ? 0.8335 0.7099 0.5875 0.0710 -0.1275 0.0476 64 VAL A O 490 C CB . VAL A 65 ? 0.7990 0.7016 0.5917 0.1021 -0.1214 0.0764 64 VAL A CB 491 C CG1 . VAL A 65 ? 0.7998 0.7371 0.6098 0.0968 -0.1350 0.0819 64 VAL A CG1 492 C CG2 . VAL A 65 ? 0.8043 0.7010 0.6094 0.1190 -0.1092 0.0862 64 VAL A CG2 493 N N . TYR A 66 ? 0.7764 0.6739 0.5673 0.0697 -0.1249 0.0453 65 TYR A N 494 C CA . TYR A 66 ? 0.7876 0.6851 0.5680 0.0540 -0.1322 0.0360 65 TYR A CA 495 C C . TYR A 66 ? 0.8114 0.7378 0.5979 0.0470 -0.1471 0.0425 65 TYR A C 496 O O . TYR A 66 ? 0.8152 0.7663 0.6258 0.0503 -0.1502 0.0499 65 TYR A O 497 C CB . TYR A 66 ? 0.7630 0.6537 0.5522 0.0483 -0.1252 0.0265 65 TYR A CB 498 C CG . TYR A 66 ? 0.7701 0.6505 0.5433 0.0335 -0.1286 0.0161 65 TYR A CG 499 C CD1 . TYR A 66 ? 0.7699 0.6242 0.5215 0.0314 -0.1221 0.0081 65 TYR A CD1 500 C CD2 . TYR A 66 ? 0.7835 0.6799 0.5625 0.0213 -0.1373 0.0145 65 TYR A CD2 501 C CE1 . TYR A 66 ? 0.7900 0.6317 0.5258 0.0189 -0.1229 -0.0012 65 TYR A CE1 502 C CE2 . TYR A 66 ? 0.8096 0.6923 0.5714 0.0069 -0.1384 0.0042 65 TYR A CE2 503 C CZ . TYR A 66 ? 0.8025 0.6565 0.5423 0.0065 -0.1307 -0.0035 65 TYR A CZ 504 O OH . TYR A 66 ? 0.8156 0.6530 0.5379 -0.0067 -0.1295 -0.0136 65 TYR A OH 505 N N . ASN A 67 ? 0.8499 0.7744 0.6143 0.0364 -0.1561 0.0394 66 ASN A N 506 C CA . ASN A 67 ? 0.8728 0.8259 0.6393 0.0259 -0.1715 0.0439 66 ASN A CA 507 C C . ASN A 67 ? 0.8886 0.8373 0.6489 0.0068 -0.1738 0.0306 66 ASN A C 508 O O . ASN A 67 ? 0.8872 0.8111 0.6221 -0.0026 -0.1710 0.0195 66 ASN A O 509 C CB . ASN A 67 ? 0.9080 0.8624 0.6510 0.0248 -0.1802 0.0491 66 ASN A CB 510 C CG . ASN A 67 ? 0.9354 0.9246 0.6801 0.0137 -0.1977 0.0554 66 ASN A CG 511 O OD1 . ASN A 67 ? 0.9462 0.9488 0.6983 -0.0010 -0.2033 0.0492 66 ASN A OD1 512 N ND2 . ASN A 67 ? 1.0003 1.0046 0.7370 0.0197 -0.2064 0.0681 66 ASN A ND2 513 N N . LYS A 68 ? 0.8995 0.8708 0.6829 0.0014 -0.1774 0.0321 67 LYS A N 514 C CA . LYS A 68 ? 0.9261 0.8919 0.7066 -0.0165 -0.1774 0.0201 67 LYS A CA 515 C C . LYS A 68 ? 0.9397 0.9089 0.6970 -0.0364 -0.1889 0.0138 67 LYS A C 516 O O . LYS A 68 ? 0.9445 0.8934 0.6864 -0.0515 -0.1852 0.0006 67 LYS A O 517 C CB . LYS A 68 ? 0.9432 0.9369 0.7548 -0.0185 -0.1796 0.0248 67 LYS A CB 518 C CG . LYS A 68 ? 0.9586 0.9505 0.7937 -0.0025 -0.1677 0.0292 67 LYS A CG 519 C CD . LYS A 68 ? 0.9805 1.0046 0.8456 -0.0057 -0.1713 0.0350 67 LYS A CD 520 C CE . LYS A 68 ? 0.9848 1.0056 0.8710 0.0072 -0.1584 0.0375 67 LYS A CE 521 N NZ . LYS A 68 ? 1.0097 1.0269 0.9001 0.0274 -0.1522 0.0462 67 LYS A NZ 522 N N . THR A 69 ? 0.9597 0.9545 0.7139 -0.0364 -0.2021 0.0236 68 THR A N 523 C CA . THR A 69 ? 0.9968 0.9995 0.7273 -0.0565 -0.2147 0.0184 68 THR A CA 524 C C . THR A 69 ? 1.0119 0.9769 0.7051 -0.0603 -0.2087 0.0078 68 THR A C 525 O O . THR A 69 ? 1.0787 1.0253 0.7491 -0.0789 -0.2077 -0.0061 68 THR A O 526 C CB . THR A 69 ? 1.0074 1.0535 0.7463 -0.0548 -0.2317 0.0342 68 THR A CB 527 O OG1 . THR A 69 ? 0.9972 1.0793 0.7735 -0.0498 -0.2355 0.0448 68 THR A OG1 528 C CG2 . THR A 69 ? 1.0457 1.1039 0.7595 -0.0790 -0.2459 0.0280 68 THR A CG2 529 N N . SER A 70 ? 0.9822 0.9342 0.6685 -0.0430 -0.2033 0.0141 69 SER A N 530 C CA . SER A 70 ? 0.9942 0.9116 0.6471 -0.0450 -0.1962 0.0051 69 SER A CA 531 C C . SER A 70 ? 0.9901 0.8706 0.6403 -0.0412 -0.1786 -0.0062 69 SER A C 532 O O . SER A 70 ? 1.0038 0.8548 0.6275 -0.0446 -0.1711 -0.0153 69 SER A O 533 C CB . SER A 70 ? 0.9990 0.9175 0.6446 -0.0292 -0.1972 0.0170 69 SER A CB 534 O OG . SER A 70 ? 0.9948 0.9134 0.6648 -0.0089 -0.1885 0.0259 69 SER A OG 535 N N . ARG A 71 ? 0.9659 0.8493 0.6431 -0.0341 -0.1718 -0.0051 70 ARG A N 536 C CA . ARG A 71 ? 0.9469 0.8012 0.6252 -0.0277 -0.1557 -0.0125 70 ARG A CA 537 C C . ARG A 71 ? 0.9281 0.7623 0.5939 -0.0144 -0.1471 -0.0109 70 ARG A C 538 O O . ARG A 71 ? 0.9333 0.7395 0.5818 -0.0156 -0.1368 -0.0197 70 ARG A O 539 C CB . ARG A 71 ? 0.9528 0.7834 0.6141 -0.0436 -0.1500 -0.0269 70 ARG A CB 540 C CG . ARG A 71 ? 0.9544 0.8013 0.6266 -0.0593 -0.1567 -0.0300 70 ARG A CG 541 C CD . ARG A 71 ? 0.9362 0.7973 0.6414 -0.0511 -0.1530 -0.0243 70 ARG A CD 542 N NE . ARG A 71 ? 0.9259 0.7599 0.6327 -0.0440 -0.1374 -0.0295 70 ARG A NE 543 C CZ . ARG A 71 ? 0.9320 0.7510 0.6390 -0.0527 -0.1299 -0.0369 70 ARG A CZ 544 N NH1 . ARG A 71 ? 0.9617 0.7875 0.6670 -0.0708 -0.1356 -0.0419 70 ARG A NH1 545 N NH2 . ARG A 71 ? 0.9317 0.7293 0.6406 -0.0435 -0.1162 -0.0389 70 ARG A NH2 546 N N . ALA A 72 ? 0.9149 0.7638 0.5902 -0.0015 -0.1506 0.0008 71 ALA A N 547 C CA . ALA A 72 ? 0.9152 0.7474 0.5784 0.0098 -0.1433 0.0036 71 ALA A CA 548 C C . ALA A 72 ? 0.8853 0.7300 0.5710 0.0260 -0.1409 0.0153 71 ALA A C 549 O O . ALA A 72 ? 0.8704 0.7404 0.5767 0.0287 -0.1480 0.0237 71 ALA A O 550 C CB . ALA A 72 ? 0.9225 0.7535 0.5586 0.0045 -0.1510 0.0053 71 ALA A CB 551 N N . THR A 73 ? 0.8843 0.7110 0.5659 0.0364 -0.1299 0.0158 72 THR A N 552 C CA . THR A 73 ? 0.8617 0.6944 0.5603 0.0507 -0.1253 0.0257 72 THR A CA 553 C C . THR A 73 ? 0.8718 0.7067 0.5583 0.0574 -0.1295 0.0362 72 THR A C 554 O O . THR A 73 ? 0.8762 0.7014 0.5382 0.0519 -0.1323 0.0340 72 THR A O 555 C CB . THR A 73 ? 0.8454 0.6584 0.5468 0.0569 -0.1105 0.0205 72 THR A CB 556 O OG1 . THR A 73 ? 0.8642 0.6557 0.5425 0.0540 -0.1049 0.0143 72 THR A OG1 557 C CG2 . THR A 73 ? 0.8315 0.6463 0.5482 0.0531 -0.1064 0.0134 72 THR A CG2 558 N N . GLN A 74 ? 0.8723 0.7194 0.5757 0.0697 -0.1288 0.0483 73 GLN A N 559 C CA . GLN A 74 ? 0.8874 0.7346 0.5816 0.0792 -0.1302 0.0608 73 GLN A CA 560 C C . GLN A 74 ? 0.8585 0.6973 0.5674 0.0939 -0.1175 0.0674 73 GLN A C 561 O O . GLN A 74 ? 0.8397 0.6799 0.5679 0.0962 -0.1109 0.0637 73 GLN A O 562 C CB . GLN A 74 ? 0.9256 0.8031 0.6235 0.0783 -0.1461 0.0726 73 GLN A CB 563 C CG . GLN A 74 ? 0.9559 0.8616 0.6827 0.0782 -0.1521 0.0762 73 GLN A CG 564 C CD . GLN A 74 ? 0.9826 0.9215 0.7108 0.0707 -0.1700 0.0840 73 GLN A CD 565 O OE1 . GLN A 74 ? 0.9918 0.9318 0.7014 0.0545 -0.1789 0.0753 73 GLN A OE1 566 N NE2 . GLN A 74 ? 0.9947 0.9620 0.7457 0.0819 -0.1749 0.1001 73 GLN A NE2 567 N N . PHE A 75 ? 0.8581 0.6854 0.5556 0.1032 -0.1129 0.0765 74 PHE A N 568 C CA . PHE A 75 ? 0.8534 0.6695 0.5623 0.1166 -0.0995 0.0830 74 PHE A CA 569 C C . PHE A 75 ? 0.8516 0.6922 0.5835 0.1281 -0.1039 0.0980 74 PHE A C 570 O O . PHE A 75 ? 0.8602 0.7265 0.5944 0.1268 -0.1185 0.1066 74 PHE A O 571 C CB . PHE A 75 ? 0.8670 0.6597 0.5552 0.1223 -0.0912 0.0879 74 PHE A CB 572 C CG . PHE A 75 ? 0.8704 0.6426 0.5358 0.1115 -0.0874 0.0752 74 PHE A CG 573 C CD1 . PHE A 75 ? 0.8683 0.6345 0.5368 0.1021 -0.0833 0.0599 74 PHE A CD1 574 C CD2 . PHE A 75 ? 0.8876 0.6466 0.5286 0.1120 -0.0868 0.0796 74 PHE A CD2 575 C CE1 . PHE A 75 ? 0.8750 0.6242 0.5247 0.0940 -0.0787 0.0498 74 PHE A CE1 576 C CE2 . PHE A 75 ? 0.8857 0.6265 0.5069 0.1030 -0.0818 0.0684 74 PHE A CE2 577 C CZ . PHE A 75 ? 0.8723 0.6087 0.4988 0.0944 -0.0775 0.0536 74 PHE A CZ 578 N N . PRO A 76 ? 0.8474 0.6812 0.5964 0.1389 -0.0910 0.1013 75 PRO A N 579 C CA . PRO A 76 ? 0.8547 0.7104 0.6259 0.1525 -0.0928 0.1174 75 PRO A CA 580 C C . PRO A 76 ? 0.8950 0.7572 0.6577 0.1633 -0.0980 0.1357 75 PRO A C 581 O O . PRO A 76 ? 0.8942 0.7347 0.6333 0.1628 -0.0945 0.1357 75 PRO A O 582 C CB . PRO A 76 ? 0.8497 0.6855 0.6326 0.1620 -0.0734 0.1159 75 PRO A CB 583 C CG . PRO A 76 ? 0.8252 0.6410 0.5989 0.1493 -0.0664 0.0967 75 PRO A CG 584 C CD . PRO A 76 ? 0.8316 0.6403 0.5813 0.1381 -0.0745 0.0900 75 PRO A CD 585 N N . ASP A 77 ? 0.9308 0.8242 0.7129 0.1730 -0.1064 0.1520 76 ASP A N 586 C CA . ASP A 77 ? 0.9773 0.8829 0.7534 0.1844 -0.1129 0.1723 76 ASP A CA 587 C C . ASP A 77 ? 0.9797 0.8504 0.7445 0.1984 -0.0948 0.1792 76 ASP A C 588 O O . ASP A 77 ? 0.9779 0.8303 0.7552 0.2077 -0.0774 0.1783 76 ASP A O 589 C CB . ASP A 77 ? 1.0202 0.9656 0.8256 0.1964 -0.1207 0.1907 76 ASP A CB 590 C CG . ASP A 77 ? 1.0419 1.0260 0.8575 0.1811 -0.1405 0.1862 76 ASP A CG 591 O OD1 . ASP A 77 ? 1.0606 1.0445 0.8547 0.1631 -0.1521 0.1745 76 ASP A OD1 592 O OD2 . ASP A 77 ? 1.0711 1.0855 0.9163 0.1870 -0.1433 0.1943 76 ASP A OD2 593 N N . GLY A 78 ? 0.9693 0.8296 0.7090 0.1986 -0.0981 0.1855 77 GLY A N 594 C CA . GLY A 78 ? 0.9810 0.8079 0.7072 0.2110 -0.0813 0.1937 77 GLY A CA 595 C C . GLY A 78 ? 0.9635 0.7491 0.6755 0.2028 -0.0641 0.1752 77 GLY A C 596 O O . GLY A 78 ? 0.9938 0.7490 0.6989 0.2122 -0.0465 0.1798 77 GLY A O 597 N N . VAL A 79 ? 0.9310 0.7155 0.6387 0.1852 -0.0683 0.1548 78 VAL A N 598 C CA . VAL A 79 ? 0.9131 0.6646 0.6080 0.1762 -0.0540 0.1378 78 VAL A CA 599 C C . VAL A 79 ? 0.9064 0.6526 0.5762 0.1619 -0.0619 0.1280 78 VAL A C 600 O O . VAL A 79 ? 0.8802 0.6479 0.5483 0.1523 -0.0776 0.1236 78 VAL A O 601 C CB . VAL A 79 ? 0.8890 0.6412 0.6015 0.1693 -0.0485 0.1225 78 VAL A CB 602 C CG1 . VAL A 79 ? 0.8861 0.6101 0.5851 0.1583 -0.0361 0.1055 78 VAL A CG1 603 C CG2 . VAL A 79 ? 0.8967 0.6499 0.6318 0.1835 -0.0376 0.1312 78 VAL A CG2 604 N N . ASP A 80 ? 0.9231 0.6399 0.5730 0.1604 -0.0500 0.1250 79 ASP A N 605 C CA . ASP A 80 ? 0.9330 0.6408 0.5611 0.1463 -0.0529 0.1126 79 ASP A CA 606 C C . ASP A 80 ? 0.9202 0.6049 0.5470 0.1384 -0.0378 0.0968 79 ASP A C 607 O O . ASP A 80 ? 0.9295 0.5940 0.5588 0.1438 -0.0223 0.0984 79 ASP A O 608 C CB . ASP A 80 ? 0.9606 0.6585 0.5630 0.1491 -0.0542 0.1230 79 ASP A CB 609 C CG . ASP A 80 ? 0.9842 0.6761 0.5640 0.1347 -0.0582 0.1105 79 ASP A CG 610 O OD1 . ASP A 80 ? 0.9917 0.7002 0.5739 0.1246 -0.0695 0.1006 79 ASP A OD1 611 O OD2 . ASP A 80 ? 1.0164 0.6857 0.5761 0.1333 -0.0485 0.1103 79 ASP A OD2 612 N N . VAL A 81 ? 0.8967 0.5848 0.5189 0.1253 -0.0420 0.0820 80 VAL A N 613 C CA . VAL A 81 ? 0.8945 0.5672 0.5164 0.1168 -0.0299 0.0677 80 VAL A CA 614 C C . VAL A 81 ? 0.9059 0.5706 0.5068 0.1075 -0.0304 0.0605 80 VAL A C 615 O O . VAL A 81 ? 0.9370 0.6137 0.5314 0.1023 -0.0420 0.0577 80 VAL A O 616 C CB . VAL A 81 ? 0.8732 0.5603 0.5150 0.1112 -0.0326 0.0569 80 VAL A CB 617 C CG1 . VAL A 81 ? 0.8702 0.5460 0.5112 0.1021 -0.0216 0.0434 80 VAL A CG1 618 C CG2 . VAL A 81 ? 0.8720 0.5665 0.5346 0.1203 -0.0304 0.0632 80 VAL A CG2 619 N N . ARG A 82 ? 0.9236 0.5674 0.5136 0.1047 -0.0168 0.0573 81 ARG A N 620 C CA . ARG A 82 ? 0.9352 0.5711 0.5063 0.0966 -0.0149 0.0509 81 ARG A CA 621 C C . ARG A 82 ? 0.9135 0.5419 0.4893 0.0882 -0.0027 0.0387 81 ARG A C 622 O O . ARG A 82 ? 0.8951 0.5194 0.4836 0.0881 0.0059 0.0362 81 ARG A O 623 C CB . ARG A 82 ? 0.9823 0.6024 0.5309 0.1009 -0.0111 0.0615 81 ARG A CB 624 C CG . ARG A 82 ? 1.0328 0.6298 0.5782 0.1026 0.0061 0.0638 81 ARG A CG 625 C CD . ARG A 82 ? 1.0883 0.6694 0.6122 0.1089 0.0098 0.0772 81 ARG A CD 626 N NE . ARG A 82 ? 1.1354 0.6911 0.6557 0.1095 0.0282 0.0790 81 ARG A NE 627 C CZ . ARG A 82 ? 1.1756 0.7116 0.6791 0.1161 0.0360 0.0916 81 ARG A CZ 628 N NH1 . ARG A 82 ? 1.1924 0.7340 0.6810 0.1233 0.0259 0.1047 81 ARG A NH1 629 N NH2 . ARG A 82 ? 1.1907 0.7015 0.6914 0.1147 0.0544 0.0914 81 ARG A NH2 630 N N . VAL A 83 ? 0.8980 0.5256 0.4631 0.0809 -0.0018 0.0314 82 VAL A N 631 C CA . VAL A 83 ? 0.8735 0.4997 0.4438 0.0728 0.0083 0.0210 82 VAL A CA 632 C C . VAL A 83 ? 0.8874 0.4955 0.4405 0.0701 0.0204 0.0227 82 VAL A C 633 O O . VAL A 83 ? 0.8938 0.4967 0.4289 0.0696 0.0190 0.0245 82 VAL A O 634 C CB . VAL A 83 ? 0.8473 0.4860 0.4195 0.0679 0.0028 0.0126 82 VAL A CB 635 C CG1 . VAL A 83 ? 0.8424 0.4838 0.4218 0.0610 0.0132 0.0042 82 VAL A CG1 636 C CG2 . VAL A 83 ? 0.8151 0.4700 0.4028 0.0697 -0.0086 0.0112 82 VAL A CG2 637 N N . PRO A 84 ? 0.8996 0.4968 0.4567 0.0674 0.0329 0.0218 83 PRO A N 638 C CA . PRO A 84 ? 0.9150 0.4952 0.4568 0.0629 0.0458 0.0226 83 PRO A CA 639 C C . PRO A 84 ? 0.9074 0.4966 0.4518 0.0532 0.0513 0.0127 83 PRO A C 640 O O . PRO A 84 ? 0.8704 0.4779 0.4310 0.0500 0.0472 0.0053 83 PRO A O 641 C CB . PRO A 84 ? 0.9239 0.4896 0.4708 0.0618 0.0576 0.0238 83 PRO A CB 642 C CG . PRO A 84 ? 0.8926 0.4741 0.4611 0.0599 0.0536 0.0168 83 PRO A CG 643 C CD . PRO A 84 ? 0.8827 0.4820 0.4573 0.0666 0.0372 0.0188 83 PRO A CD 644 N N . GLY A 85 ? 0.9312 0.5086 0.4605 0.0493 0.0610 0.0136 84 GLY A N 645 C CA . GLY A 85 ? 0.9256 0.5112 0.4600 0.0397 0.0702 0.0056 84 GLY A CA 646 C C . GLY A 85 ? 0.9083 0.5086 0.4436 0.0396 0.0658 0.0011 84 GLY A C 647 O O . GLY A 85 ? 0.9095 0.5240 0.4566 0.0335 0.0718 -0.0049 84 GLY A O 648 N N . PHE A 86 ? 0.9159 0.5135 0.4391 0.0461 0.0562 0.0042 85 PHE A N 649 C CA . PHE A 86 ? 0.9095 0.5154 0.4300 0.0460 0.0544 -0.0005 85 PHE A CA 650 C C . PHE A 86 ? 0.9163 0.5149 0.4245 0.0418 0.0677 -0.0014 85 PHE A C 651 O O . PHE A 86 ? 0.9490 0.5304 0.4374 0.0419 0.0725 0.0039 85 PHE A O 652 C CB . PHE A 86 ? 0.9087 0.5106 0.4147 0.0511 0.0423 0.0017 85 PHE A CB 653 C CG . PHE A 86 ? 0.9092 0.5169 0.4134 0.0505 0.0417 -0.0047 85 PHE A CG 654 C CD1 . PHE A 86 ? 0.8929 0.5151 0.4156 0.0514 0.0357 -0.0095 85 PHE A CD1 655 C CD2 . PHE A 86 ? 0.9252 0.5220 0.4088 0.0491 0.0492 -0.0061 85 PHE A CD2 656 C CE1 . PHE A 86 ? 0.8849 0.5088 0.4053 0.0516 0.0374 -0.0149 85 PHE A CE1 657 C CE2 . PHE A 86 ? 0.9179 0.5166 0.3991 0.0491 0.0514 -0.0123 85 PHE A CE2 658 C CZ . PHE A 86 ? 0.9008 0.5122 0.4005 0.0506 0.0458 -0.0166 85 PHE A CZ 659 N N . GLY A 87 ? 0.9087 0.5215 0.4293 0.0389 0.0740 -0.0071 86 GLY A N 660 C CA . GLY A 87 ? 0.9244 0.5342 0.4373 0.0350 0.0877 -0.0079 86 GLY A CA 661 C C . GLY A 87 ? 0.9405 0.5563 0.4655 0.0268 0.0983 -0.0083 86 GLY A C 662 O O . GLY A 87 ? 0.9603 0.5800 0.4852 0.0222 0.1102 -0.0094 86 GLY A O 663 N N . LYS A 88 ? 0.9737 0.5904 0.5091 0.0241 0.0947 -0.0080 87 LYS A N 664 C CA . LYS A 88 ? 0.9872 0.6078 0.5327 0.0139 0.1044 -0.0100 87 LYS A CA 665 C C . LYS A 88 ? 0.9568 0.6033 0.5282 0.0103 0.0995 -0.0153 87 LYS A C 666 O O . LYS A 88 ? 0.9684 0.6279 0.5491 0.0169 0.0898 -0.0164 87 LYS A O 667 C CB . LYS A 88 ? 1.0231 0.6194 0.5563 0.0132 0.1067 -0.0056 87 LYS A CB 668 C CG . LYS A 88 ? 1.0597 0.6307 0.5662 0.0192 0.1085 0.0021 87 LYS A CG 669 C CD . LYS A 88 ? 1.0871 0.6524 0.5819 0.0134 0.1220 0.0024 87 LYS A CD 670 C CE . LYS A 88 ? 1.1411 0.6807 0.6069 0.0192 0.1237 0.0111 87 LYS A CE 671 N NZ . LYS A 88 ? 1.1564 0.6919 0.6087 0.0153 0.1355 0.0111 87 LYS A NZ 672 N N . THR A 89 ? 0.9537 0.6078 0.5355 -0.0009 0.1065 -0.0187 88 THR A N 673 C CA . THR A 89 ? 0.9295 0.6099 0.5338 -0.0058 0.1018 -0.0236 88 THR A CA 674 C C . THR A 89 ? 0.9357 0.6073 0.5417 -0.0114 0.1011 -0.0262 88 THR A C 675 O O . THR A 89 ? 0.9119 0.6018 0.5331 -0.0136 0.0951 -0.0298 88 THR A O 676 C CB . THR A 89 ? 0.9210 0.6292 0.5405 -0.0163 0.1097 -0.0266 88 THR A CB 677 O OG1 . THR A 89 ? 0.9492 0.6461 0.5605 -0.0286 0.1224 -0.0280 88 THR A OG1 678 C CG2 . THR A 89 ? 0.9206 0.6408 0.5427 -0.0084 0.1109 -0.0238 88 THR A CG2 679 N N . PHE A 90 ? 0.9642 0.6067 0.5539 -0.0131 0.1082 -0.0240 89 PHE A N 680 C CA . PHE A 90 ? 0.9676 0.5985 0.5580 -0.0196 0.1119 -0.0272 89 PHE A CA 681 C C . PHE A 90 ? 0.9421 0.5775 0.5413 -0.0114 0.1002 -0.0273 89 PHE A C 682 O O . PHE A 90 ? 0.9365 0.5783 0.5446 -0.0190 0.1012 -0.0330 89 PHE A O 683 C CB . PHE A 90 ? 0.9990 0.5935 0.5694 -0.0198 0.1229 -0.0228 89 PHE A CB 684 C CG . PHE A 90 ? 1.0282 0.6023 0.5853 -0.0034 0.1162 -0.0132 89 PHE A CG 685 C CD1 . PHE A 90 ? 1.0443 0.6075 0.6027 0.0046 0.1113 -0.0103 89 PHE A CD1 686 C CD2 . PHE A 90 ? 1.0440 0.6108 0.5867 0.0035 0.1153 -0.0067 89 PHE A CD2 687 C CE1 . PHE A 90 ? 1.0598 0.6092 0.6078 0.0194 0.1044 -0.0002 89 PHE A CE1 688 C CE2 . PHE A 90 ? 1.0506 0.6022 0.5802 0.0171 0.1080 0.0024 89 PHE A CE2 689 C CZ . PHE A 90 ? 1.0622 0.6068 0.5954 0.0251 0.1020 0.0062 89 PHE A CZ 690 N N . SER A 91 ? 0.9271 0.5604 0.5234 0.0026 0.0894 -0.0216 90 SER A N 691 C CA . SER A 91 ? 0.9196 0.5547 0.5231 0.0109 0.0790 -0.0204 90 SER A CA 692 C C . SER A 91 ? 0.8840 0.5485 0.5063 0.0097 0.0704 -0.0251 90 SER A C 693 O O . SER A 91 ? 0.8896 0.5579 0.5198 0.0138 0.0635 -0.0255 90 SER A O 694 C CB . SER A 91 ? 0.9344 0.5580 0.5274 0.0248 0.0701 -0.0122 90 SER A CB 695 O OG . SER A 91 ? 0.9370 0.5738 0.5301 0.0286 0.0632 -0.0121 90 SER A OG 696 N N . LEU A 92 ? 0.8675 0.5529 0.4973 0.0050 0.0714 -0.0276 91 LEU A N 697 C CA . LEU A 92 ? 0.8570 0.5716 0.5053 0.0025 0.0657 -0.0311 91 LEU A CA 698 C C . LEU A 92 ? 0.8573 0.5906 0.5150 -0.0124 0.0727 -0.0368 91 LEU A C 699 O O . LEU A 92 ? 0.8205 0.5784 0.4927 -0.0158 0.0679 -0.0392 91 LEU A O 700 C CB . LEU A 92 ? 0.8571 0.5862 0.5111 0.0112 0.0592 -0.0283 91 LEU A CB 701 C CG . LEU A 92 ? 0.8740 0.5988 0.5193 0.0141 0.0644 -0.0258 91 LEU A CG 702 C CD1 . LEU A 92 ? 0.8956 0.6394 0.5495 0.0039 0.0739 -0.0278 91 LEU A CD1 703 C CD2 . LEU A 92 ? 0.8566 0.5877 0.5047 0.0244 0.0575 -0.0236 91 LEU A CD2 704 N N . GLU A 93 ? 0.8904 0.6138 0.5398 -0.0227 0.0840 -0.0388 92 GLU A N 705 C CA . GLU A 93 ? 0.9142 0.6559 0.5712 -0.0402 0.0908 -0.0452 92 GLU A CA 706 C C . GLU A 93 ? 0.9469 0.6798 0.6025 -0.0474 0.0917 -0.0509 92 GLU A C 707 O O . GLU A 93 ? 0.9285 0.6852 0.5946 -0.0575 0.0896 -0.0560 92 GLU A O 708 C CB . GLU A 93 ? 0.9451 0.6752 0.5921 -0.0509 0.1040 -0.0464 92 GLU A CB 709 C CG . GLU A 93 ? 0.9464 0.6947 0.5989 -0.0488 0.1060 -0.0426 92 GLU A CG 710 C CD . GLU A 93 ? 0.9740 0.7118 0.6172 -0.0607 0.1199 -0.0438 92 GLU A CD 711 O OE1 . GLU A 93 ? 1.0004 0.7553 0.6507 -0.0784 0.1261 -0.0494 92 GLU A OE1 712 O OE2 . GLU A 93 ? 0.9634 0.6769 0.5916 -0.0535 0.1247 -0.0392 92 GLU A OE2 713 N N . PHE A 94 ? 0.9871 0.6857 0.6289 -0.0415 0.0952 -0.0494 93 PHE A N 714 C CA . PHE A 94 ? 0.9865 0.6694 0.6245 -0.0460 0.0990 -0.0541 93 PHE A CA 715 C C . PHE A 94 ? 0.9770 0.6426 0.6126 -0.0281 0.0919 -0.0477 93 PHE A C 716 O O . PHE A 94 ? 0.9914 0.6368 0.6171 -0.0169 0.0920 -0.0403 93 PHE A O 717 C CB . PHE A 94 ? 1.0351 0.6903 0.6583 -0.0584 0.1152 -0.0583 93 PHE A CB 718 C CG . PHE A 94 ? 1.0553 0.7297 0.6819 -0.0805 0.1224 -0.0670 93 PHE A CG 719 C CD1 . PHE A 94 ? 1.0625 0.7537 0.6949 -0.0943 0.1221 -0.0759 93 PHE A CD1 720 C CD2 . PHE A 94 ? 1.0595 0.7367 0.6829 -0.0885 0.1297 -0.0663 93 PHE A CD2 721 C CE1 . PHE A 94 ? 1.0606 0.7734 0.6959 -0.1166 0.1276 -0.0840 93 PHE A CE1 722 C CE2 . PHE A 94 ? 1.0738 0.7728 0.7020 -0.1102 0.1359 -0.0740 93 PHE A CE2 723 C CZ . PHE A 94 ? 1.0660 0.7839 0.7002 -0.1247 0.1343 -0.0828 93 PHE A CZ 724 N N . LEU A 95 ? 0.9770 0.6531 0.6219 -0.0257 0.0854 -0.0499 94 LEU A N 725 C CA . LEU A 95 ? 0.9786 0.6433 0.6243 -0.0098 0.0782 -0.0438 94 LEU A CA 726 C C . LEU A 95 ? 1.0496 0.6807 0.6841 -0.0071 0.0889 -0.0423 94 LEU A C 727 O O . LEU A 95 ? 1.0390 0.6550 0.6701 0.0073 0.0859 -0.0338 94 LEU A O 728 C CB . LEU A 95 ? 0.9552 0.6422 0.6149 -0.0083 0.0690 -0.0462 94 LEU A CB 729 C CG . LEU A 95 ? 0.9333 0.6525 0.6052 -0.0082 0.0588 -0.0456 94 LEU A CG 730 C CD1 . LEU A 95 ? 0.9047 0.6438 0.5891 -0.0075 0.0513 -0.0475 94 LEU A CD1 731 C CD2 . LEU A 95 ? 0.9343 0.6507 0.6043 0.0046 0.0516 -0.0381 94 LEU A CD2 732 N N . ASP A 96 ? 1.1424 0.7625 0.7709 -0.0215 0.1019 -0.0505 95 ASP A N 733 C CA . ASP A 96 ? 1.2274 0.8115 0.8438 -0.0207 0.1163 -0.0503 95 ASP A CA 734 C C . ASP A 96 ? 1.2736 0.8364 0.8756 -0.0276 0.1284 -0.0494 95 ASP A C 735 O O . ASP A 96 ? 1.2977 0.8696 0.8979 -0.0452 0.1342 -0.0575 95 ASP A O 736 C CB . ASP A 96 ? 1.2633 0.8449 0.8795 -0.0345 0.1253 -0.0617 95 ASP A CB 737 C CG . ASP A 96 ? 1.3347 0.8758 0.9391 -0.0312 0.1418 -0.0614 95 ASP A CG 738 O OD1 . ASP A 96 ? 1.3512 0.8636 0.9441 -0.0256 0.1513 -0.0548 95 ASP A OD1 739 O OD2 . ASP A 96 ? 1.3655 0.9025 0.9716 -0.0338 0.1465 -0.0675 95 ASP A OD2 740 N N . PRO A 97 ? 1.3161 0.8515 0.9078 -0.0143 0.1327 -0.0389 96 PRO A N 741 C CA . PRO A 97 ? 1.3638 0.8773 0.9404 -0.0201 0.1450 -0.0369 96 PRO A CA 742 C C . PRO A 97 ? 1.4182 0.9066 0.9839 -0.0377 0.1650 -0.0463 96 PRO A C 743 O O . PRO A 97 ? 1.4626 0.9372 1.0172 -0.0474 0.1758 -0.0471 96 PRO A O 744 C CB . PRO A 97 ? 1.3832 0.8740 0.9514 0.0000 0.1442 -0.0220 96 PRO A CB 745 C CG . PRO A 97 ? 1.3771 0.8686 0.9547 0.0131 0.1384 -0.0182 96 PRO A CG 746 C CD . PRO A 97 ? 1.3358 0.8609 0.9294 0.0062 0.1270 -0.0277 96 PRO A CD 747 N N . SER A 98 ? 1.4618 0.9440 1.0296 -0.0432 0.1708 -0.0542 97 SER A N 748 C CA . SER A 98 ? 1.5146 0.9783 1.0718 -0.0653 0.1890 -0.0671 97 SER A CA 749 C C . SER A 98 ? 1.5338 1.0308 1.0963 -0.0880 0.1852 -0.0782 97 SER A C 750 O O . SER A 98 ? 1.5254 1.0116 1.0783 -0.1096 0.1993 -0.0888 97 SER A O 751 C CB . SER A 98 ? 1.5141 0.9651 1.0711 -0.0664 0.1959 -0.0740 97 SER A CB 752 O OG . SER A 98 ? 1.4884 0.9771 1.0589 -0.0738 0.1829 -0.0820 97 SER A OG 753 N N . LYS A 99 ? 1.5468 1.0843 1.1248 -0.0830 0.1669 -0.0753 98 LYS A N 754 C CA . LYS A 99 ? 1.5222 1.0978 1.1095 -0.0997 0.1611 -0.0819 98 LYS A CA 755 C C . LYS A 99 ? 1.5056 1.1009 1.0972 -0.1182 0.1614 -0.0946 98 LYS A C 756 O O . LYS A 99 ? 1.4540 1.0751 1.0493 -0.1381 0.1621 -0.1020 98 LYS A O 757 C CB . LYS A 99 ? 1.5489 1.1160 1.1273 -0.1122 0.1723 -0.0826 98 LYS A CB 758 C CG . LYS A 99 ? 1.5580 1.1161 1.1332 -0.0948 0.1688 -0.0697 98 LYS A CG 759 C CD . LYS A 99 ? 1.5778 1.1347 1.1466 -0.1079 0.1788 -0.0705 98 LYS A CD 760 C CE . LYS A 99 ? 1.5873 1.1330 1.1498 -0.0906 0.1762 -0.0579 98 LYS A CE 761 N NZ . LYS A 99 ? 1.6146 1.1545 1.1689 -0.1028 0.1882 -0.0581 98 LYS A NZ 762 N N . SER A 100 ? 1.5179 1.1035 1.1096 -0.1114 0.1605 -0.0964 99 SER A N 763 C CA . SER A 100 ? 1.5453 1.1504 1.1399 -0.1272 0.1593 -0.1078 99 SER A CA 764 C C . SER A 100 ? 1.5133 1.1712 1.1264 -0.1285 0.1412 -0.1065 99 SER A C 765 O O . SER A 100 ? 1.5016 1.1760 1.1269 -0.1105 0.1280 -0.0960 99 SER A O 766 C CB . SER A 100 ? 1.5834 1.1669 1.1748 -0.1167 0.1623 -0.1086 99 SER A CB 767 O OG . SER A 100 ? 1.5732 1.1717 1.1787 -0.0939 0.1467 -0.0980 99 SER A OG 768 N N . SER A 101 ? 1.5019 1.1858 1.1163 -0.1500 0.1410 -0.1168 100 SER A N 769 C CA . SER A 101 ? 1.4423 1.1784 1.0744 -0.1524 0.1252 -0.1145 100 SER A CA 770 C C . SER A 101 ? 1.3914 1.1405 1.0352 -0.1327 0.1113 -0.1074 100 SER A C 771 O O . SER A 101 ? 1.3027 1.0862 0.9623 -0.1244 0.0980 -0.1001 100 SER A O 772 C CB . SER A 101 ? 1.4445 1.2067 1.0739 -0.1805 0.1278 -0.1266 100 SER A CB 773 O OG . SER A 101 ? 1.5030 1.2463 1.1199 -0.1884 0.1344 -0.1363 100 SER A OG 774 N N . VAL A 102 ? 1.4167 1.1369 1.0529 -0.1248 0.1160 -0.1092 101 VAL A N 775 C CA . VAL A 102 ? 1.4044 1.1325 1.0509 -0.1063 0.1046 -0.1026 101 VAL A CA 776 C C . VAL A 102 ? 1.3427 1.0765 1.0005 -0.0848 0.0935 -0.0896 101 VAL A C 777 O O . VAL A 102 ? 1.3480 1.1046 1.0185 -0.0740 0.0808 -0.0837 101 VAL A O 778 C CB . VAL A 102 ? 1.4459 1.1379 1.0829 -0.0992 0.1138 -0.1052 101 VAL A CB 779 C CG1 . VAL A 102 ? 1.4263 1.1315 1.0757 -0.0826 0.1019 -0.0988 101 VAL A CG1 780 C CG2 . VAL A 102 ? 1.4767 1.1563 1.0987 -0.1214 0.1278 -0.1196 101 VAL A CG2 781 N N . GLY A 103 ? 1.2764 0.9890 0.9279 -0.0798 0.0990 -0.0853 102 GLY A N 782 C CA . GLY A 103 ? 1.2123 0.9274 0.8705 -0.0614 0.0896 -0.0742 102 GLY A CA 783 C C . GLY A 103 ? 1.1343 0.8725 0.7982 -0.0654 0.0865 -0.0715 102 GLY A C 784 O O . GLY A 103 ? 1.1037 0.8386 0.7690 -0.0522 0.0819 -0.0636 102 GLY A O 785 N N . SER A 104 ? 1.0822 0.8449 0.7495 -0.0836 0.0891 -0.0778 103 SER A N 786 C CA . SER A 104 ? 1.0307 0.8176 0.7057 -0.0867 0.0875 -0.0744 103 SER A CA 787 C C . SER A 104 ? 0.9584 0.7758 0.6499 -0.0733 0.0740 -0.0666 103 SER A C 788 O O . SER A 104 ? 0.9389 0.7822 0.6402 -0.0757 0.0670 -0.0674 103 SER A O 789 C CB . SER A 104 ? 1.0480 0.8573 0.7239 -0.1107 0.0935 -0.0824 103 SER A CB 790 O OG . SER A 104 ? 1.0428 0.8754 0.7275 -0.1130 0.0936 -0.0780 103 SER A OG 791 N N . TYR A 105 ? 0.9119 0.7250 0.6051 -0.0595 0.0715 -0.0590 104 TYR A N 792 C CA . TYR A 105 ? 0.8450 0.6769 0.5506 -0.0446 0.0608 -0.0516 104 TYR A CA 793 C C . TYR A 105 ? 0.8466 0.6993 0.5604 -0.0430 0.0623 -0.0467 104 TYR A C 794 O O . TYR A 105 ? 0.8429 0.7313 0.5709 -0.0485 0.0601 -0.0453 104 TYR A O 795 C CB . TYR A 105 ? 0.8262 0.6300 0.5247 -0.0280 0.0562 -0.0476 104 TYR A CB 796 C CG . TYR A 105 ? 0.7886 0.6045 0.4967 -0.0136 0.0462 -0.0413 104 TYR A CG 797 C CD1 . TYR A 105 ? 0.7579 0.6011 0.4798 -0.0133 0.0395 -0.0402 104 TYR A CD1 798 C CD2 . TYR A 105 ? 0.7911 0.5893 0.4926 -0.0009 0.0439 -0.0365 104 TYR A CD2 799 C CE1 . TYR A 105 ? 0.7508 0.6010 0.4804 -0.0002 0.0321 -0.0343 104 TYR A CE1 800 C CE2 . TYR A 105 ? 0.7719 0.5775 0.4801 0.0104 0.0363 -0.0320 104 TYR A CE2 801 C CZ . TYR A 105 ? 0.7533 0.5836 0.4758 0.0110 0.0310 -0.0308 104 TYR A CZ 802 O OH . TYR A 105 ? 0.7265 0.5603 0.4545 0.0221 0.0252 -0.0263 104 TYR A OH 803 N N . PHE A 106 ? 0.8423 0.6745 0.5472 -0.0358 0.0667 -0.0436 105 PHE A N 804 C CA . PHE A 106 ? 0.8268 0.6764 0.5383 -0.0347 0.0709 -0.0395 105 PHE A CA 805 C C . PHE A 106 ? 0.8377 0.6926 0.5468 -0.0516 0.0816 -0.0434 105 PHE A C 806 O O . PHE A 106 ? 0.8377 0.7087 0.5533 -0.0521 0.0866 -0.0400 105 PHE A O 807 C CB . PHE A 106 ? 0.8365 0.6628 0.5381 -0.0197 0.0713 -0.0345 105 PHE A CB 808 C CG . PHE A 106 ? 0.8197 0.6551 0.5296 -0.0049 0.0633 -0.0294 105 PHE A CG 809 C CD1 . PHE A 106 ? 0.8195 0.6799 0.5427 0.0000 0.0652 -0.0246 105 PHE A CD1 810 C CD2 . PHE A 106 ? 0.8309 0.6493 0.5356 0.0040 0.0551 -0.0290 105 PHE A CD2 811 C CE1 . PHE A 106 ? 0.8115 0.6759 0.5409 0.0135 0.0600 -0.0199 105 PHE A CE1 812 C CE2 . PHE A 106 ? 0.8337 0.6580 0.5449 0.0159 0.0490 -0.0250 105 PHE A CE2 813 C CZ . PHE A 106 ? 0.8162 0.6616 0.5388 0.0207 0.0519 -0.0207 105 PHE A CZ 814 N N . HIS A 107 ? 0.8398 0.6805 0.5395 -0.0658 0.0865 -0.0507 106 HIS A N 815 C CA . HIS A 107 ? 0.8695 0.7086 0.5638 -0.0833 0.0983 -0.0553 106 HIS A CA 816 C C . HIS A 107 ? 0.8668 0.7510 0.5786 -0.0952 0.0995 -0.0548 106 HIS A C 817 O O . HIS A 107 ? 0.8900 0.7788 0.6024 -0.1002 0.1077 -0.0533 106 HIS A O 818 C CB . HIS A 107 ? 0.8939 0.7104 0.5752 -0.0981 0.1045 -0.0644 106 HIS A CB 819 C CG . HIS A 107 ? 0.9310 0.7420 0.6049 -0.1181 0.1179 -0.0701 106 HIS A CG 820 N ND1 . HIS A 107 ? 0.9651 0.7523 0.6280 -0.1163 0.1276 -0.0672 106 HIS A ND1 821 C CD2 . HIS A 107 ? 0.9495 0.7756 0.6242 -0.1418 0.1235 -0.0789 106 HIS A CD2 822 C CE1 . HIS A 107 ? 0.9897 0.7768 0.6481 -0.1375 0.1393 -0.0737 106 HIS A CE1 823 N NE2 . HIS A 107 ? 0.9909 0.8014 0.6561 -0.1540 0.1369 -0.0814 106 HIS A NE2 824 N N . THR A 108 ? 0.8452 0.7652 0.5720 -0.0993 0.0911 -0.0549 107 THR A N 825 C CA . THR A 108 ? 0.8360 0.8044 0.5811 -0.1110 0.0911 -0.0530 107 THR A CA 826 C C . THR A 108 ? 0.8202 0.8063 0.5788 -0.0958 0.0919 -0.0426 107 THR A C 827 O O . THR A 108 ? 0.8138 0.8239 0.5818 -0.1042 0.0984 -0.0407 107 THR A O 828 C CB . THR A 108 ? 0.8289 0.8338 0.5868 -0.1158 0.0806 -0.0530 107 THR A CB 829 O OG1 . THR A 108 ? 0.8431 0.8255 0.5861 -0.1267 0.0806 -0.0629 107 THR A OG1 830 C CG2 . THR A 108 ? 0.8207 0.8783 0.5960 -0.1324 0.0806 -0.0517 107 THR A CG2 831 N N . MET A 109 ? 0.8002 0.7738 0.5592 -0.0740 0.0861 -0.0363 108 MET A N 832 C CA . MET A 109 ? 0.8104 0.7942 0.5792 -0.0583 0.0886 -0.0273 108 MET A CA 833 C C . MET A 109 ? 0.8284 0.7871 0.5846 -0.0587 0.1003 -0.0280 108 MET A C 834 O O . MET A 109 ? 0.8153 0.7957 0.5826 -0.0580 0.1073 -0.0230 108 MET A O 835 C CB . MET A 109 ? 0.8058 0.7743 0.5733 -0.0371 0.0812 -0.0224 108 MET A CB 836 C CG . MET A 109 ? 0.8114 0.7884 0.5878 -0.0208 0.0853 -0.0137 108 MET A CG 837 S SD . MET A 109 ? 0.8249 0.7814 0.5977 0.0012 0.0782 -0.0094 108 MET A SD 838 C CE . MET A 109 ? 0.8117 0.8091 0.6066 0.0018 0.0685 -0.0041 108 MET A CE 839 N N . VAL A 110 ? 0.8415 0.7562 0.5750 -0.0598 0.1030 -0.0333 109 VAL A N 840 C CA . VAL A 110 ? 0.8620 0.7507 0.5807 -0.0605 0.1140 -0.0333 109 VAL A CA 841 C C . VAL A 110 ? 0.8885 0.7947 0.6118 -0.0811 0.1243 -0.0367 109 VAL A C 842 O O . VAL A 110 ? 0.9025 0.8118 0.6265 -0.0813 0.1339 -0.0336 109 VAL A O 843 C CB . VAL A 110 ? 0.8722 0.7116 0.5658 -0.0564 0.1142 -0.0363 109 VAL A CB 844 C CG1 . VAL A 110 ? 0.8947 0.7082 0.5716 -0.0590 0.1263 -0.0356 109 VAL A CG1 845 C CG2 . VAL A 110 ? 0.8618 0.6868 0.5513 -0.0371 0.1045 -0.0324 109 VAL A CG2 846 N N . GLU A 111 ? 0.8987 0.8153 0.6240 -0.0994 0.1233 -0.0436 110 GLU A N 847 C CA . GLU A 111 ? 0.9282 0.8663 0.6593 -0.1219 0.1324 -0.0477 110 GLU A CA 848 C C . GLU A 111 ? 0.9080 0.8964 0.6642 -0.1208 0.1330 -0.0403 110 GLU A C 849 O O . GLU A 111 ? 0.9067 0.9046 0.6661 -0.1303 0.1437 -0.0397 110 GLU A O 850 C CB . GLU A 111 ? 0.9537 0.9011 0.6840 -0.1426 0.1296 -0.0570 110 GLU A CB 851 C CG . GLU A 111 ? 0.9969 0.8933 0.7019 -0.1490 0.1355 -0.0651 110 GLU A CG 852 C CD . GLU A 111 ? 1.0638 0.9347 0.7546 -0.1623 0.1513 -0.0685 110 GLU A CD 853 O OE1 . GLU A 111 ? 1.1140 1.0073 0.8104 -0.1853 0.1581 -0.0739 110 GLU A OE1 854 O OE2 . GLU A 111 ? 1.0950 0.9240 0.7683 -0.1505 0.1569 -0.0654 110 GLU A OE2 855 N N . SER A 112 ? 0.8912 0.9119 0.6657 -0.1094 0.1225 -0.0342 111 SER A N 856 C CA . SER A 112 ? 0.8815 0.9514 0.6823 -0.1043 0.1235 -0.0246 111 SER A CA 857 C C . SER A 112 ? 0.8757 0.9310 0.6747 -0.0881 0.1330 -0.0181 111 SER A C 858 O O . SER A 112 ? 0.8596 0.9422 0.6723 -0.0928 0.1422 -0.0138 111 SER A O 859 C CB . SER A 112 ? 0.8692 0.9716 0.6882 -0.0923 0.1111 -0.0176 111 SER A CB 860 O OG . SER A 112 ? 0.8927 1.0176 0.7151 -0.1101 0.1032 -0.0232 111 SER A OG 861 N N . LEU A 113 ? 0.8768 0.8911 0.6589 -0.0699 0.1312 -0.0174 112 LEU A N 862 C CA . LEU A 113 ? 0.8953 0.8897 0.6700 -0.0550 0.1404 -0.0127 112 LEU A CA 863 C C . LEU A 113 ? 0.9005 0.8797 0.6633 -0.0678 0.1540 -0.0160 112 LEU A C 864 O O . LEU A 113 ? 0.8899 0.8832 0.6608 -0.0645 0.1646 -0.0109 112 LEU A O 865 C CB . LEU A 113 ? 0.9105 0.8606 0.6642 -0.0381 0.1352 -0.0136 112 LEU A CB 866 C CG . LEU A 113 ? 0.9023 0.8629 0.6666 -0.0225 0.1244 -0.0092 112 LEU A CG 867 C CD1 . LEU A 113 ? 0.9023 0.8186 0.6442 -0.0106 0.1188 -0.0118 112 LEU A CD1 868 C CD2 . LEU A 113 ? 0.9059 0.8957 0.6902 -0.0089 0.1298 0.0000 112 LEU A CD2 869 N N . VAL A 114 ? 0.8931 0.8438 0.6373 -0.0824 0.1548 -0.0240 113 VAL A N 870 C CA . VAL A 114 ? 0.9121 0.8443 0.6430 -0.0958 0.1684 -0.0270 113 VAL A CA 871 C C . VAL A 114 ? 0.9180 0.8966 0.6713 -0.1133 0.1759 -0.0263 113 VAL A C 872 O O . VAL A 114 ? 0.9465 0.9268 0.6997 -0.1168 0.1886 -0.0239 113 VAL A O 873 C CB . VAL A 114 ? 0.9279 0.8176 0.6343 -0.1069 0.1693 -0.0348 113 VAL A CB 874 C CG1 . VAL A 114 ? 0.9324 0.8069 0.6274 -0.1239 0.1848 -0.0377 113 VAL A CG1 875 C CG2 . VAL A 114 ? 0.9290 0.7745 0.6136 -0.0884 0.1639 -0.0332 113 VAL A CG2 876 N N . GLY A 115 ? 0.9157 0.9340 0.6880 -0.1252 0.1678 -0.0281 114 GLY A N 877 C CA . GLY A 115 ? 0.9132 0.9847 0.7102 -0.1417 0.1722 -0.0261 114 GLY A CA 878 C C . GLY A 115 ? 0.9093 1.0151 0.7287 -0.1261 0.1770 -0.0145 114 GLY A C 879 O O . GLY A 115 ? 0.9339 1.0732 0.7694 -0.1376 0.1862 -0.0117 114 GLY A O 880 N N . TRP A 116 ? 0.8966 0.9937 0.7173 -0.1003 0.1720 -0.0078 115 TRP A N 881 C CA . TRP A 116 ? 0.8872 1.0085 0.7263 -0.0822 0.1789 0.0031 115 TRP A CA 882 C C . TRP A 116 ? 0.9058 0.9889 0.7259 -0.0733 0.1933 0.0034 115 TRP A C 883 O O . TRP A 116 ? 0.8920 0.9884 0.7236 -0.0581 0.2019 0.0115 115 TRP A O 884 C CB . TRP A 116 ? 0.8743 1.0034 0.7234 -0.0594 0.1691 0.0102 115 TRP A CB 885 C CG . TRP A 116 ? 0.8639 1.0302 0.7303 -0.0658 0.1551 0.0114 115 TRP A CG 886 C CD1 . TRP A 116 ? 0.8673 1.0789 0.7508 -0.0874 0.1517 0.0103 115 TRP A CD1 887 C CD2 . TRP A 116 ? 0.8618 1.0241 0.7291 -0.0515 0.1426 0.0139 115 TRP A CD2 888 N NE1 . TRP A 116 ? 0.8616 1.0973 0.7550 -0.0871 0.1374 0.0120 115 TRP A NE1 889 C CE2 . TRP A 116 ? 0.8523 1.0580 0.7366 -0.0647 0.1321 0.0146 115 TRP A CE2 890 C CE3 . TRP A 116 ? 0.8682 0.9944 0.7225 -0.0302 0.1396 0.0152 115 TRP A CE3 891 C CZ2 . TRP A 116 ? 0.8411 1.0544 0.7299 -0.0559 0.1191 0.0174 115 TRP A CZ2 892 C CZ3 . TRP A 116 ? 0.8534 0.9869 0.7133 -0.0222 0.1270 0.0176 115 TRP A CZ3 893 C CH2 . TRP A 116 ? 0.8391 1.0153 0.7160 -0.0344 0.1172 0.0191 115 TRP A CH2 894 N N . GLY A 117 ? 0.9218 0.9570 0.7122 -0.0819 0.1965 -0.0046 116 GLY A N 895 C CA . GLY A 117 ? 0.9247 0.9242 0.6941 -0.0764 0.2101 -0.0043 116 GLY A CA 896 C C . GLY A 117 ? 0.9308 0.8759 0.6696 -0.0609 0.2066 -0.0064 116 GLY A C 897 O O . GLY A 117 ? 0.9684 0.8843 0.6876 -0.0552 0.2172 -0.0055 116 GLY A O 898 N N . TYR A 118 ? 0.8978 0.8299 0.6311 -0.0549 0.1919 -0.0089 117 TYR A N 899 C CA . TYR A 118 ? 0.8847 0.7687 0.5899 -0.0423 0.1868 -0.0109 117 TYR A CA 900 C C . TYR A 118 ? 0.8936 0.7395 0.5732 -0.0542 0.1887 -0.0162 117 TYR A C 901 O O . TYR A 118 ? 0.8972 0.7518 0.5812 -0.0727 0.1918 -0.0199 117 TYR A O 902 C CB . TYR A 118 ? 0.8677 0.7541 0.5786 -0.0312 0.1713 -0.0109 117 TYR A CB 903 C CG . TYR A 118 ? 0.8475 0.7551 0.5748 -0.0139 0.1711 -0.0047 117 TYR A CG 904 C CD1 . TYR A 118 ? 0.8388 0.7958 0.5978 -0.0143 0.1712 0.0007 117 TYR A CD1 905 C CD2 . TYR A 118 ? 0.8659 0.7440 0.5764 0.0025 0.1713 -0.0038 117 TYR A CD2 906 C CE1 . TYR A 118 ? 0.8385 0.8129 0.6129 0.0033 0.1728 0.0079 117 TYR A CE1 907 C CE2 . TYR A 118 ? 0.8681 0.7606 0.5919 0.0183 0.1735 0.0014 117 TYR A CE2 908 C CZ . TYR A 118 ? 0.8530 0.7926 0.6092 0.0198 0.1748 0.0079 117 TYR A CZ 909 O OH . TYR A 118 ? 0.8272 0.7794 0.5971 0.0373 0.1786 0.0146 117 TYR A OH 910 N N . THR A 119 ? 0.9068 0.7107 0.5592 -0.0438 0.1875 -0.0159 118 THR A N 911 C CA . THR A 119 ? 0.9275 0.6912 0.5532 -0.0503 0.1896 -0.0181 118 THR A CA 912 C C . THR A 119 ? 0.9352 0.6712 0.5455 -0.0389 0.1762 -0.0184 118 THR A C 913 O O . THR A 119 ? 0.9411 0.6675 0.5429 -0.0242 0.1716 -0.0161 118 THR A O 914 C CB . THR A 119 ? 0.9500 0.6903 0.5548 -0.0493 0.2036 -0.0150 118 THR A CB 915 O OG1 . THR A 119 ? 0.9468 0.7161 0.5685 -0.0595 0.2168 -0.0143 118 THR A OG1 916 C CG2 . THR A 119 ? 0.9687 0.6686 0.5467 -0.0557 0.2070 -0.0152 118 THR A CG2 917 N N . ARG A 120 ? 0.9511 0.6754 0.5582 -0.0463 0.1708 -0.0216 119 ARG A N 918 C CA . ARG A 120 ? 0.9584 0.6592 0.5535 -0.0363 0.1584 -0.0212 119 ARG A CA 919 C C . ARG A 120 ? 0.9966 0.6643 0.5648 -0.0250 0.1588 -0.0166 119 ARG A C 920 O O . ARG A 120 ? 1.0319 0.6781 0.5824 -0.0296 0.1694 -0.0142 119 ARG A O 921 C CB . ARG A 120 ? 0.9784 0.6645 0.5699 -0.0467 0.1581 -0.0245 119 ARG A CB 922 C CG . ARG A 120 ? 0.9650 0.6811 0.5792 -0.0581 0.1543 -0.0303 119 ARG A CG 923 C CD . ARG A 120 ? 0.9870 0.6819 0.5930 -0.0694 0.1575 -0.0347 119 ARG A CD 924 N NE . ARG A 120 ? 0.9807 0.7006 0.6042 -0.0785 0.1512 -0.0408 119 ARG A NE 925 C CZ . ARG A 120 ? 0.9887 0.7387 0.6273 -0.0960 0.1557 -0.0459 119 ARG A CZ 926 N NH1 . ARG A 120 ? 1.0094 0.7691 0.6497 -0.1069 0.1672 -0.0457 119 ARG A NH1 927 N NH2 . ARG A 120 ? 0.9783 0.7507 0.6301 -0.1036 0.1485 -0.0511 119 ARG A NH2 928 N N . GLY A 121 ? 0.9848 0.6482 0.5486 -0.0114 0.1475 -0.0151 120 GLY A N 929 C CA . GLY A 121 ? 0.9861 0.6199 0.5228 -0.0023 0.1455 -0.0110 120 GLY A CA 930 C C . GLY A 121 ? 0.9962 0.6277 0.5215 0.0018 0.1540 -0.0096 120 GLY A C 931 O O . GLY A 121 ? 1.0017 0.6107 0.5024 0.0085 0.1524 -0.0068 120 GLY A O 932 N N . GLU A 122 ? 0.9791 0.6349 0.5219 -0.0024 0.1638 -0.0113 121 GLU A N 933 C CA . GLU A 122 ? 0.9792 0.6360 0.5151 0.0021 0.1743 -0.0103 121 GLU A CA 934 C C . GLU A 122 ? 0.9641 0.6461 0.5210 0.0103 0.1712 -0.0119 121 GLU A C 935 O O . GLU A 122 ? 0.9621 0.6338 0.5103 0.0200 0.1628 -0.0128 121 GLU A O 936 C CB . GLU A 122 ? 0.9863 0.6497 0.5249 -0.0084 0.1910 -0.0092 121 GLU A CB 937 C CG . GLU A 122 ? 1.0160 0.6489 0.5300 -0.0153 0.1964 -0.0066 121 GLU A CG 938 C CD . GLU A 122 ? 1.0457 0.6823 0.5600 -0.0263 0.2143 -0.0054 121 GLU A CD 939 O OE1 . GLU A 122 ? 1.0647 0.7276 0.5963 -0.0270 0.2230 -0.0061 121 GLU A OE1 940 O OE2 . GLU A 122 ? 1.0646 0.6777 0.5620 -0.0339 0.2206 -0.0031 121 GLU A OE2 941 N N . ASP A 123 ? 0.9434 0.6586 0.5276 0.0064 0.1779 -0.0116 122 ASP A N 942 C CA . ASP A 123 ? 0.9245 0.6637 0.5290 0.0163 0.1771 -0.0108 122 ASP A CA 943 C C . ASP A 123 ? 0.8947 0.6550 0.5212 0.0171 0.1632 -0.0115 122 ASP A C 944 O O . ASP A 123 ? 0.8712 0.6517 0.5156 0.0259 0.1618 -0.0096 122 ASP A O 945 C CB . ASP A 123 ? 0.9368 0.7035 0.5598 0.0157 0.1928 -0.0077 122 ASP A CB 946 C CG . ASP A 123 ? 0.9325 0.7273 0.5755 0.0006 0.1968 -0.0070 122 ASP A CG 947 O OD1 . ASP A 123 ? 0.9356 0.7234 0.5748 -0.0103 0.1896 -0.0099 122 ASP A OD1 948 O OD2 . ASP A 123 ? 0.9338 0.7581 0.5964 -0.0007 0.2083 -0.0036 122 ASP A OD2 949 N N . VAL A 124 ? 0.8840 0.6389 0.5088 0.0083 0.1545 -0.0137 123 VAL A N 950 C CA . VAL A 124 ? 0.8534 0.6176 0.4902 0.0102 0.1402 -0.0151 123 VAL A CA 951 C C . VAL A 124 ? 0.8549 0.5862 0.4694 0.0110 0.1310 -0.0169 123 VAL A C 952 O O . VAL A 124 ? 0.8707 0.5846 0.4720 0.0032 0.1343 -0.0172 123 VAL A O 953 C CB . VAL A 124 ? 0.8302 0.6276 0.4920 -0.0013 0.1385 -0.0160 123 VAL A CB 954 C CG1 . VAL A 124 ? 0.8350 0.6226 0.4886 -0.0170 0.1439 -0.0189 123 VAL A CG1 955 C CG2 . VAL A 124 ? 0.8093 0.6152 0.4814 0.0018 0.1243 -0.0172 123 VAL A CG2 956 N N . ARG A 125 ? 0.8459 0.5685 0.4562 0.0209 0.1206 -0.0171 124 ARG A N 957 C CA . ARG A 125 ? 0.8613 0.5578 0.4532 0.0229 0.1107 -0.0175 124 ARG A CA 958 C C . ARG A 125 ? 0.8479 0.5527 0.4519 0.0272 0.0974 -0.0186 124 ARG A C 959 O O . ARG A 125 ? 0.8255 0.5478 0.4445 0.0325 0.0953 -0.0187 124 ARG A O 960 C CB . ARG A 125 ? 0.8926 0.5634 0.4581 0.0297 0.1117 -0.0164 124 ARG A CB 961 C CG . ARG A 125 ? 0.9347 0.5944 0.4848 0.0260 0.1255 -0.0149 124 ARG A CG 962 C CD . ARG A 125 ? 0.9696 0.6011 0.4884 0.0309 0.1249 -0.0137 124 ARG A CD 963 N NE . ARG A 125 ? 1.0015 0.6250 0.5064 0.0288 0.1398 -0.0127 124 ARG A NE 964 C CZ . ARG A 125 ? 1.0219 0.6214 0.4967 0.0309 0.1425 -0.0115 124 ARG A CZ 965 N NH1 . ARG A 125 ? 1.0292 0.6121 0.4848 0.0345 0.1303 -0.0107 124 ARG A NH1 966 N NH2 . ARG A 125 ? 1.0506 0.6446 0.5144 0.0287 0.1575 -0.0107 124 ARG A NH2 967 N N . GLY A 126 ? 0.8526 0.5445 0.4504 0.0256 0.0895 -0.0186 125 GLY A N 968 C CA . GLY A 126 ? 0.8297 0.5261 0.4361 0.0300 0.0769 -0.0193 125 GLY A CA 969 C C . GLY A 126 ? 0.8429 0.5215 0.4331 0.0380 0.0686 -0.0182 125 GLY A C 970 O O . GLY A 126 ? 0.8660 0.5240 0.4341 0.0392 0.0701 -0.0162 125 GLY A O 971 N N . ALA A 127 ? 0.8154 0.5031 0.4162 0.0426 0.0597 -0.0194 126 ALA A N 972 C CA . ALA A 127 ? 0.8129 0.4874 0.4011 0.0479 0.0503 -0.0192 126 ALA A CA 973 C C . ALA A 127 ? 0.7937 0.4735 0.3928 0.0486 0.0390 -0.0186 126 ALA A C 974 O O . ALA A 127 ? 0.7936 0.4821 0.4029 0.0515 0.0326 -0.0200 126 ALA A O 975 C CB . ALA A 127 ? 0.8158 0.4926 0.4046 0.0524 0.0521 -0.0216 126 ALA A CB 976 N N . PRO A 128 ? 0.8000 0.4736 0.3971 0.0464 0.0378 -0.0162 127 PRO A N 977 C CA . PRO A 128 ? 0.7895 0.4663 0.3958 0.0481 0.0286 -0.0151 127 PRO A CA 978 C C . PRO A 128 ? 0.7989 0.4687 0.3959 0.0532 0.0174 -0.0128 127 PRO A C 979 O O . PRO A 128 ? 0.8212 0.4789 0.3991 0.0544 0.0165 -0.0113 127 PRO A O 980 C CB . PRO A 128 ? 0.7982 0.4639 0.3997 0.0455 0.0336 -0.0123 127 PRO A CB 981 C CG . PRO A 128 ? 0.8181 0.4679 0.3994 0.0451 0.0403 -0.0097 127 PRO A CG 982 C CD . PRO A 128 ? 0.8165 0.4763 0.4006 0.0430 0.0461 -0.0137 127 PRO A CD 983 N N . TYR A 129 ? 0.7890 0.4677 0.3990 0.0551 0.0089 -0.0125 128 TYR A N 984 C CA . TYR A 129 ? 0.7942 0.4714 0.3993 0.0582 -0.0023 -0.0105 128 TYR A CA 985 C C . TYR A 129 ? 0.7829 0.4679 0.4025 0.0605 -0.0088 -0.0078 128 TYR A C 986 O O . TYR A 129 ? 0.7714 0.4620 0.4042 0.0593 -0.0040 -0.0088 128 TYR A O 987 C CB . TYR A 129 ? 0.7881 0.4700 0.3948 0.0576 -0.0048 -0.0152 128 TYR A CB 988 C CG . TYR A 129 ? 0.7728 0.4701 0.4006 0.0573 -0.0024 -0.0181 128 TYR A CG 989 C CD1 . TYR A 129 ? 0.7760 0.4799 0.4103 0.0560 0.0074 -0.0199 128 TYR A CD1 990 C CD2 . TYR A 129 ? 0.7579 0.4650 0.3993 0.0582 -0.0100 -0.0182 128 TYR A CD2 991 C CE1 . TYR A 129 ? 0.7626 0.4837 0.4158 0.0561 0.0087 -0.0210 128 TYR A CE1 992 C CE2 . TYR A 129 ? 0.7426 0.4639 0.4016 0.0582 -0.0079 -0.0198 128 TYR A CE2 993 C CZ . TYR A 129 ? 0.7448 0.4736 0.4094 0.0574 0.0011 -0.0208 128 TYR A CZ 994 O OH . TYR A 129 ? 0.7182 0.4643 0.4001 0.0577 0.0024 -0.0207 128 TYR A OH 995 N N . ASP A 130 ? 0.7937 0.4799 0.4105 0.0631 -0.0193 -0.0044 129 ASP A N 996 C CA . ASP A 130 ? 0.8010 0.4967 0.4330 0.0662 -0.0255 -0.0012 129 ASP A CA 997 C C . ASP A 130 ? 0.7822 0.4912 0.4307 0.0640 -0.0279 -0.0064 129 ASP A C 998 O O . ASP A 130 ? 0.7966 0.5099 0.4448 0.0627 -0.0351 -0.0079 129 ASP A O 999 C CB . ASP A 130 ? 0.8111 0.5079 0.4359 0.0694 -0.0364 0.0054 129 ASP A CB 1000 C CG . ASP A 130 ? 0.8115 0.5190 0.4535 0.0742 -0.0413 0.0107 129 ASP A CG 1001 O OD1 . ASP A 130 ? 0.8058 0.5194 0.4643 0.0739 -0.0372 0.0074 129 ASP A OD1 1002 O OD2 . ASP A 130 ? 0.8220 0.5334 0.4610 0.0783 -0.0491 0.0187 129 ASP A OD2 1003 N N . TRP A 131 ? 0.7582 0.4732 0.4196 0.0626 -0.0211 -0.0092 130 TRP A N 1004 C CA . TRP A 131 ? 0.7446 0.4729 0.4207 0.0607 -0.0215 -0.0132 130 TRP A CA 1005 C C . TRP A 131 ? 0.7442 0.4823 0.4335 0.0624 -0.0292 -0.0116 130 TRP A C 1006 O O . TRP A 131 ? 0.7166 0.4651 0.4174 0.0612 -0.0300 -0.0139 130 TRP A O 1007 C CB . TRP A 131 ? 0.7326 0.4675 0.4171 0.0573 -0.0126 -0.0161 130 TRP A CB 1008 C CG . TRP A 131 ? 0.7379 0.4653 0.4200 0.0562 -0.0067 -0.0151 130 TRP A CG 1009 C CD1 . TRP A 131 ? 0.7453 0.4620 0.4168 0.0535 0.0014 -0.0153 130 TRP A CD1 1010 C CD2 . TRP A 131 ? 0.7430 0.4702 0.4327 0.0579 -0.0068 -0.0136 130 TRP A CD2 1011 N NE1 . TRP A 131 ? 0.7560 0.4641 0.4273 0.0530 0.0067 -0.0143 130 TRP A NE1 1012 C CE2 . TRP A 131 ? 0.7529 0.4668 0.4352 0.0562 0.0022 -0.0132 130 TRP A CE2 1013 C CE3 . TRP A 131 ? 0.7356 0.4717 0.4377 0.0606 -0.0123 -0.0124 130 TRP A CE3 1014 C CZ2 . TRP A 131 ? 0.7604 0.4675 0.4464 0.0578 0.0067 -0.0120 130 TRP A CZ2 1015 C CZ3 . TRP A 131 ? 0.7248 0.4567 0.4317 0.0625 -0.0083 -0.0110 130 TRP A CZ3 1016 C CH2 . TRP A 131 ? 0.7496 0.4661 0.4481 0.0615 0.0015 -0.0109 130 TRP A CH2 1017 N N . ARG A 132 ? 0.7613 0.4975 0.4498 0.0658 -0.0343 -0.0067 131 ARG A N 1018 C CA . ARG A 132 ? 0.7569 0.5042 0.4583 0.0675 -0.0419 -0.0043 131 ARG A CA 1019 C C . ARG A 132 ? 0.7582 0.5086 0.4557 0.0646 -0.0506 -0.0055 131 ARG A C 1020 O O . ARG A 132 ? 0.7671 0.5279 0.4762 0.0635 -0.0558 -0.0056 131 ARG A O 1021 C CB . ARG A 132 ? 0.7702 0.5162 0.4727 0.0732 -0.0441 0.0030 131 ARG A CB 1022 C CG . ARG A 132 ? 0.7678 0.5057 0.4722 0.0759 -0.0336 0.0039 131 ARG A CG 1023 C CD . ARG A 132 ? 0.7750 0.5083 0.4789 0.0838 -0.0340 0.0130 131 ARG A CD 1024 N NE . ARG A 132 ? 0.7918 0.5192 0.4799 0.0856 -0.0393 0.0184 131 ARG A NE 1025 C CZ . ARG A 132 ? 0.8129 0.5404 0.4988 0.0931 -0.0432 0.0288 131 ARG A CZ 1026 N NH1 . ARG A 132 ? 0.8072 0.5395 0.5072 0.1008 -0.0412 0.0354 131 ARG A NH1 1027 N NH2 . ARG A 132 ? 0.8302 0.5536 0.4990 0.0934 -0.0486 0.0334 131 ARG A NH2 1028 N N . ARG A 133 ? 0.7674 0.5077 0.4474 0.0625 -0.0511 -0.0070 132 ARG A N 1029 C CA . ARG A 133 ? 0.7815 0.5203 0.4530 0.0578 -0.0575 -0.0097 132 ARG A CA 1030 C C . ARG A 133 ? 0.7824 0.5146 0.4507 0.0551 -0.0508 -0.0159 132 ARG A C 1031 O O . ARG A 133 ? 0.7848 0.5143 0.4540 0.0570 -0.0420 -0.0173 132 ARG A O 1032 C CB . ARG A 133 ? 0.8080 0.5395 0.4597 0.0566 -0.0628 -0.0071 132 ARG A CB 1033 C CG . ARG A 133 ? 0.8199 0.5634 0.4777 0.0592 -0.0725 0.0006 132 ARG A CG 1034 C CD . ARG A 133 ? 0.8560 0.5941 0.4956 0.0608 -0.0760 0.0065 132 ARG A CD 1035 N NE . ARG A 133 ? 0.8776 0.6315 0.5212 0.0615 -0.0881 0.0142 132 ARG A NE 1036 C CZ . ARG A 133 ? 0.8935 0.6491 0.5239 0.0637 -0.0941 0.0223 132 ARG A CZ 1037 N NH1 . ARG A 133 ? 0.9184 0.6579 0.5294 0.0654 -0.0881 0.0232 132 ARG A NH1 1038 N NH2 . ARG A 133 ? 0.9014 0.6767 0.5389 0.0644 -0.1059 0.0303 132 ARG A NH2 1039 N N . ALA A 134 ? 0.7968 0.5272 0.4622 0.0505 -0.0547 -0.0193 133 ALA A N 1040 C CA . ALA A 134 ? 0.8072 0.5277 0.4672 0.0488 -0.0475 -0.0245 133 ALA A CA 1041 C C . ALA A 134 ? 0.8307 0.5345 0.4659 0.0455 -0.0459 -0.0279 133 ALA A C 1042 O O . ALA A 134 ? 0.8606 0.5633 0.4836 0.0435 -0.0525 -0.0259 133 ALA A O 1043 C CB . ALA A 134 ? 0.8055 0.5288 0.4738 0.0450 -0.0506 -0.0266 133 ALA A CB 1044 N N . PRO A 135 ? 0.8309 0.5217 0.4580 0.0453 -0.0365 -0.0325 134 PRO A N 1045 C CA . PRO A 135 ? 0.8569 0.5301 0.4589 0.0425 -0.0324 -0.0364 134 PRO A CA 1046 C C . PRO A 135 ? 0.8691 0.5352 0.4512 0.0334 -0.0416 -0.0396 134 PRO A C 1047 O O . PRO A 135 ? 0.8981 0.5544 0.4585 0.0309 -0.0414 -0.0408 134 PRO A O 1048 C CB . PRO A 135 ? 0.8748 0.5361 0.4758 0.0448 -0.0195 -0.0403 134 PRO A CB 1049 C CG . PRO A 135 ? 0.8449 0.5223 0.4711 0.0518 -0.0158 -0.0356 134 PRO A CG 1050 C CD . PRO A 135 ? 0.8267 0.5193 0.4675 0.0498 -0.0272 -0.0327 134 PRO A CD 1051 N N . ASN A 136 ? 0.8713 0.5440 0.4607 0.0278 -0.0496 -0.0408 135 ASN A N 1052 C CA . ASN A 136 ? 0.8905 0.5612 0.4629 0.0170 -0.0597 -0.0440 135 ASN A CA 1053 C C . ASN A 136 ? 0.9117 0.5946 0.4778 0.0171 -0.0707 -0.0375 135 ASN A C 1054 O O . ASN A 136 ? 0.9596 0.6403 0.5052 0.0084 -0.0782 -0.0394 135 ASN A O 1055 C CB . ASN A 136 ? 0.8808 0.5605 0.4662 0.0103 -0.0664 -0.0456 135 ASN A CB 1056 C CG . ASN A 136 ? 0.8555 0.5587 0.4692 0.0166 -0.0727 -0.0377 135 ASN A CG 1057 O OD1 . ASN A 136 ? 0.8681 0.5759 0.4957 0.0264 -0.0669 -0.0335 135 ASN A OD1 1058 N ND2 . ASN A 136 ? 0.8473 0.5658 0.4691 0.0102 -0.0839 -0.0360 135 ASN A ND2 1059 N N . GLU A 137 ? 0.9074 0.6027 0.4901 0.0266 -0.0713 -0.0295 136 GLU A N 1060 C CA . GLU A 137 ? 0.9193 0.6242 0.4972 0.0293 -0.0795 -0.0212 136 GLU A CA 1061 C C . GLU A 137 ? 0.9094 0.6042 0.4787 0.0364 -0.0708 -0.0182 136 GLU A C 1062 O O . GLU A 137 ? 0.9071 0.6083 0.4785 0.0419 -0.0738 -0.0098 136 GLU A O 1063 C CB . GLU A 137 ? 0.9241 0.6508 0.5270 0.0339 -0.0875 -0.0134 136 GLU A CB 1064 C CG . GLU A 137 ? 0.9515 0.6904 0.5634 0.0259 -0.0964 -0.0159 136 GLU A CG 1065 C CD . GLU A 137 ? 0.9704 0.7330 0.6057 0.0305 -0.1047 -0.0070 136 GLU A CD 1066 O OE1 . GLU A 137 ? 1.0629 0.8398 0.6945 0.0285 -0.1160 -0.0006 136 GLU A OE1 1067 O OE2 . GLU A 137 ? 0.9354 0.7036 0.5924 0.0362 -0.0999 -0.0058 136 GLU A OE2 1068 N N . ASN A 138 ? 0.9207 0.5992 0.4801 0.0361 -0.0589 -0.0245 137 ASN A N 1069 C CA . ASN A 138 ? 0.9196 0.5885 0.4699 0.0410 -0.0495 -0.0224 137 ASN A CA 1070 C C . ASN A 138 ? 0.9486 0.5985 0.4722 0.0363 -0.0423 -0.0289 137 ASN A C 1071 O O . ASN A 138 ? 0.9777 0.6180 0.4979 0.0397 -0.0298 -0.0307 137 ASN A O 1072 C CB . ASN A 138 ? 0.9017 0.5747 0.4733 0.0474 -0.0396 -0.0220 137 ASN A CB 1073 C CG . ASN A 138 ? 0.8860 0.5705 0.4736 0.0526 -0.0424 -0.0147 137 ASN A CG 1074 O OD1 . ASN A 138 ? 0.8846 0.5677 0.4634 0.0546 -0.0459 -0.0084 137 ASN A OD1 1075 N ND2 . ASN A 138 ? 0.8641 0.5589 0.4743 0.0551 -0.0398 -0.0151 137 ASN A ND2 1076 N N . GLY A 139 ? 0.9726 0.6179 0.4763 0.0278 -0.0500 -0.0324 138 GLY A N 1077 C CA . GLY A 139 ? 0.9742 0.5992 0.4475 0.0217 -0.0433 -0.0395 138 GLY A CA 1078 C C . GLY A 139 ? 0.9845 0.6006 0.4421 0.0257 -0.0360 -0.0358 138 GLY A C 1079 O O . GLY A 139 ? 1.0045 0.6051 0.4520 0.0269 -0.0220 -0.0407 138 GLY A O 1080 N N . PRO A 140 ? 0.9741 0.5998 0.4301 0.0287 -0.0441 -0.0261 139 PRO A N 1081 C CA . PRO A 140 ? 0.9854 0.6011 0.4254 0.0322 -0.0366 -0.0216 139 PRO A CA 1082 C C . PRO A 140 ? 0.9664 0.5778 0.4213 0.0388 -0.0213 -0.0222 139 PRO A C 1083 O O . PRO A 140 ? 0.9889 0.5872 0.4283 0.0390 -0.0100 -0.0238 139 PRO A O 1084 C CB . PRO A 140 ? 0.9715 0.6002 0.4147 0.0363 -0.0478 -0.0092 139 PRO A CB 1085 C CG . PRO A 140 ? 0.9750 0.6189 0.4223 0.0312 -0.0634 -0.0088 139 PRO A CG 1086 C CD . PRO A 140 ? 0.9634 0.6081 0.4288 0.0286 -0.0601 -0.0182 139 PRO A CD 1087 N N . TYR A 141 ? 0.9281 0.5519 0.4125 0.0434 -0.0210 -0.0210 140 TYR A N 1088 C CA . TYR A 141 ? 0.9100 0.5345 0.4106 0.0477 -0.0079 -0.0222 140 TYR A CA 1089 C C . TYR A 141 ? 0.9202 0.5340 0.4132 0.0466 0.0042 -0.0298 140 TYR A C 1090 O O . TYR A 141 ? 0.9219 0.5307 0.4119 0.0485 0.0165 -0.0297 140 TYR A O 1091 C CB . TYR A 141 ? 0.8615 0.5025 0.3930 0.0509 -0.0108 -0.0211 140 TYR A CB 1092 C CG . TYR A 141 ? 0.8238 0.4704 0.3727 0.0535 0.0010 -0.0229 140 TYR A CG 1093 C CD1 . TYR A 141 ? 0.8056 0.4540 0.3591 0.0547 0.0082 -0.0196 140 TYR A CD1 1094 C CD2 . TYR A 141 ? 0.8160 0.4670 0.3767 0.0544 0.0051 -0.0274 140 TYR A CD2 1095 C CE1 . TYR A 141 ? 0.7962 0.4541 0.3661 0.0554 0.0179 -0.0211 140 TYR A CE1 1096 C CE2 . TYR A 141 ? 0.8042 0.4650 0.3821 0.0572 0.0148 -0.0274 140 TYR A CE2 1097 C CZ . TYR A 141 ? 0.7993 0.4655 0.3821 0.0570 0.0206 -0.0244 140 TYR A CZ 1098 O OH . TYR A 141 ? 0.7679 0.4483 0.3684 0.0581 0.0292 -0.0242 140 TYR A OH 1099 N N . PHE A 142 ? 0.9402 0.5500 0.4304 0.0435 0.0022 -0.0359 141 PHE A N 1100 C CA . PHE A 142 ? 0.9667 0.5637 0.4504 0.0440 0.0159 -0.0426 141 PHE A CA 1101 C C . PHE A 142 ? 1.0134 0.5911 0.4656 0.0408 0.0239 -0.0458 141 PHE A C 1102 O O . PHE A 142 ? 1.0394 0.6089 0.4889 0.0441 0.0392 -0.0482 141 PHE A O 1103 C CB . PHE A 142 ? 0.9538 0.5470 0.4408 0.0413 0.0136 -0.0484 141 PHE A CB 1104 C CG . PHE A 142 ? 0.9263 0.5377 0.4444 0.0452 0.0087 -0.0452 141 PHE A CG 1105 C CD1 . PHE A 142 ? 0.8957 0.5171 0.4359 0.0525 0.0183 -0.0426 141 PHE A CD1 1106 C CD2 . PHE A 142 ? 0.9125 0.5337 0.4379 0.0415 -0.0055 -0.0438 141 PHE A CD2 1107 C CE1 . PHE A 142 ? 0.8739 0.5128 0.4405 0.0554 0.0137 -0.0394 141 PHE A CE1 1108 C CE2 . PHE A 142 ? 0.8807 0.5181 0.4332 0.0449 -0.0090 -0.0409 141 PHE A CE2 1109 C CZ . PHE A 142 ? 0.8688 0.5141 0.4407 0.0517 0.0004 -0.0389 141 PHE A CZ 1110 N N . LEU A 143 ? 1.0561 0.6283 0.4847 0.0346 0.0138 -0.0451 142 LEU A N 1111 C CA . LEU A 143 ? 1.1006 0.6558 0.4969 0.0310 0.0204 -0.0470 142 LEU A CA 1112 C C . LEU A 143 ? 1.0767 0.6334 0.4768 0.0367 0.0302 -0.0408 142 LEU A C 1113 O O . LEU A 143 ? 1.1060 0.6502 0.4930 0.0374 0.0448 -0.0437 142 LEU A O 1114 C CB . LEU A 143 ? 1.1527 0.7071 0.5243 0.0233 0.0054 -0.0451 142 LEU A CB 1115 C CG . LEU A 143 ? 1.1993 0.7497 0.5582 0.0134 -0.0034 -0.0529 142 LEU A CG 1116 C CD1 . LEU A 143 ? 1.2055 0.7671 0.5501 0.0069 -0.0221 -0.0473 142 LEU A CD1 1117 C CD2 . LEU A 143 ? 1.2431 0.7681 0.5735 0.0071 0.0097 -0.0645 142 LEU A CD2 1118 N N . ALA A 144 ? 1.0285 0.5997 0.4463 0.0402 0.0232 -0.0324 143 ALA A N 1119 C CA . ALA A 144 ? 1.0074 0.5794 0.4294 0.0437 0.0324 -0.0268 143 ALA A CA 1120 C C . ALA A 144 ? 0.9814 0.5590 0.4240 0.0473 0.0470 -0.0297 143 ALA A C 1121 O O . ALA A 144 ? 1.0024 0.5752 0.4396 0.0479 0.0599 -0.0288 143 ALA A O 1122 C CB . ALA A 144 ? 0.9704 0.5539 0.4070 0.0462 0.0231 -0.0181 143 ALA A CB 1123 N N . LEU A 145 ? 0.9352 0.5246 0.4017 0.0497 0.0451 -0.0323 144 LEU A N 1124 C CA . LEU A 145 ? 0.9183 0.5173 0.4059 0.0539 0.0577 -0.0335 144 LEU A CA 1125 C C . LEU A 145 ? 0.9534 0.5380 0.4255 0.0553 0.0725 -0.0383 144 LEU A C 1126 O O . LEU A 145 ? 0.9223 0.5110 0.4007 0.0580 0.0862 -0.0369 144 LEU A O 1127 C CB . LEU A 145 ? 0.8824 0.4957 0.3952 0.0566 0.0519 -0.0343 144 LEU A CB 1128 C CG . LEU A 145 ? 0.8608 0.4885 0.3977 0.0620 0.0628 -0.0337 144 LEU A CG 1129 C CD1 . LEU A 145 ? 0.8516 0.4961 0.4045 0.0615 0.0676 -0.0291 144 LEU A CD1 1130 C CD2 . LEU A 145 ? 0.8392 0.4783 0.3963 0.0644 0.0559 -0.0338 144 LEU A CD2 1131 N N . ARG A 146 ? 0.9987 0.5663 0.4499 0.0526 0.0705 -0.0443 145 ARG A N 1132 C CA . ARG A 146 ? 1.0446 0.5933 0.4764 0.0534 0.0860 -0.0500 145 ARG A CA 1133 C C . ARG A 146 ? 1.0706 0.6097 0.4811 0.0515 0.0949 -0.0485 145 ARG A C 1134 O O . ARG A 146 ? 1.0899 0.6262 0.5016 0.0555 0.1117 -0.0491 145 ARG A O 1135 C CB . ARG A 146 ? 1.0904 0.6194 0.4977 0.0474 0.0811 -0.0579 145 ARG A CB 1136 C CG . ARG A 146 ? 1.1493 0.6527 0.5302 0.0464 0.0978 -0.0658 145 ARG A CG 1137 C CD . ARG A 146 ? 1.1831 0.6692 0.5447 0.0386 0.0918 -0.0746 145 ARG A CD 1138 N NE . ARG A 146 ? 1.2850 0.7422 0.6070 0.0316 0.1018 -0.0838 145 ARG A NE 1139 C CZ . ARG A 146 ? 1.3688 0.8028 0.6796 0.0330 0.1195 -0.0921 145 ARG A CZ 1140 N NH1 . ARG A 146 ? 1.3779 0.8142 0.7152 0.0426 0.1296 -0.0910 145 ARG A NH1 1141 N NH2 . ARG A 146 ? 1.3904 0.7970 0.6611 0.0247 0.1281 -0.1013 145 ARG A NH2 1142 N N . GLU A 147 ? 1.0922 0.6273 0.4841 0.0461 0.0840 -0.0456 146 GLU A N 1143 C CA . GLU A 147 ? 1.1431 0.6683 0.5133 0.0442 0.0919 -0.0428 146 GLU A CA 1144 C C . GLU A 147 ? 1.0883 0.6273 0.4806 0.0480 0.1024 -0.0372 146 GLU A C 1145 O O . GLU A 147 ? 1.0932 0.6252 0.4753 0.0483 0.1174 -0.0372 146 GLU A O 1146 C CB . GLU A 147 ? 1.2240 0.7455 0.5735 0.0392 0.0773 -0.0378 146 GLU A CB 1147 C CG . GLU A 147 ? 1.3317 0.8392 0.6497 0.0323 0.0684 -0.0431 146 GLU A CG 1148 C CD . GLU A 147 ? 1.4543 0.9636 0.7542 0.0288 0.0534 -0.0353 146 GLU A CD 1149 O OE1 . GLU A 147 ? 1.5442 1.0684 0.8654 0.0326 0.0441 -0.0269 146 GLU A OE1 1150 O OE2 . GLU A 147 ? 1.5476 1.0437 0.8119 0.0225 0.0515 -0.0368 146 GLU A OE2 1151 N N . MET A 148 ? 1.0396 0.5982 0.4610 0.0497 0.0947 -0.0327 147 MET A N 1152 C CA . MET A 148 ? 1.0113 0.5848 0.4540 0.0505 0.1034 -0.0281 147 MET A CA 1153 C C . MET A 148 ? 1.0007 0.5844 0.4607 0.0549 0.1189 -0.0303 147 MET A C 1154 O O . MET A 148 ? 1.0085 0.5964 0.4712 0.0544 0.1321 -0.0282 147 MET A O 1155 C CB . MET A 148 ? 0.9834 0.5746 0.4516 0.0501 0.0923 -0.0245 147 MET A CB 1156 C CG . MET A 148 ? 0.9780 0.5844 0.4663 0.0480 0.1007 -0.0211 147 MET A CG 1157 S SD . MET A 148 ? 0.9677 0.5876 0.4772 0.0455 0.0889 -0.0179 147 MET A SD 1158 C CE . MET A 148 ? 0.9246 0.5646 0.4608 0.0497 0.0820 -0.0211 147 MET A CE 1159 N N . ILE A 149 ? 0.9792 0.5669 0.4507 0.0595 0.1179 -0.0337 148 ILE A N 1160 C CA . ILE A 149 ? 0.9681 0.5652 0.4562 0.0662 0.1331 -0.0340 148 ILE A CA 1161 C C . ILE A 149 ? 1.0018 0.5796 0.4659 0.0673 0.1500 -0.0369 148 ILE A C 1162 O O . ILE A 149 ? 0.9938 0.5827 0.4701 0.0706 0.1651 -0.0341 148 ILE A O 1163 C CB . ILE A 149 ? 0.9499 0.5498 0.4514 0.0717 0.1295 -0.0363 148 ILE A CB 1164 C CG1 . ILE A 149 ? 0.9063 0.5316 0.4375 0.0716 0.1168 -0.0321 148 ILE A CG1 1165 C CG2 . ILE A 149 ? 0.9512 0.5538 0.4634 0.0807 0.1476 -0.0359 148 ILE A CG2 1166 C CD1 . ILE A 149 ? 0.8969 0.5236 0.4387 0.0755 0.1099 -0.0336 148 ILE A CD1 1167 N N . GLU A 150 ? 1.0431 0.5938 0.4729 0.0637 0.1477 -0.0425 149 GLU A N 1168 C CA . GLU A 150 ? 1.0810 0.6100 0.4826 0.0635 0.1641 -0.0463 149 GLU A CA 1169 C C . GLU A 150 ? 1.0823 0.6151 0.4788 0.0604 0.1719 -0.0414 149 GLU A C 1170 O O . GLU A 150 ? 1.0787 0.6104 0.4742 0.0635 0.1907 -0.0411 149 GLU A O 1171 C CB . GLU A 150 ? 1.1241 0.6250 0.4869 0.0572 0.1573 -0.0536 149 GLU A CB 1172 C CG . GLU A 150 ? 1.1539 0.6455 0.5175 0.0590 0.1555 -0.0603 149 GLU A CG 1173 C CD . GLU A 150 ? 1.2250 0.6921 0.5510 0.0496 0.1464 -0.0682 149 GLU A CD 1174 O OE1 . GLU A 150 ? 1.3067 0.7654 0.6049 0.0423 0.1406 -0.0677 149 GLU A OE1 1175 O OE2 . GLU A 150 ? 1.2257 0.6825 0.5494 0.0487 0.1452 -0.0747 149 GLU A OE2 1176 N N . GLU A 151 ? 1.0756 0.6124 0.4695 0.0547 0.1585 -0.0370 150 GLU A N 1177 C CA . GLU A 151 ? 1.0822 0.6205 0.4712 0.0508 0.1654 -0.0317 150 GLU A CA 1178 C C . GLU A 151 ? 1.0458 0.6094 0.4685 0.0530 0.1774 -0.0280 150 GLU A C 1179 O O . GLU A 151 ? 1.0688 0.6325 0.4879 0.0519 0.1930 -0.0262 150 GLU A O 1180 C CB . GLU A 151 ? 1.0804 0.6180 0.4644 0.0458 0.1492 -0.0266 150 GLU A CB 1181 C CG . GLU A 151 ? 1.0945 0.6334 0.4777 0.0415 0.1558 -0.0203 150 GLU A CG 1182 C CD . GLU A 151 ? 1.0971 0.6353 0.4803 0.0387 0.1411 -0.0146 150 GLU A CD 1183 O OE1 . GLU A 151 ? 1.1047 0.6390 0.4812 0.0401 0.1255 -0.0149 150 GLU A OE1 1184 O OE2 . GLU A 151 ? 1.0765 0.6173 0.4661 0.0351 0.1462 -0.0096 150 GLU A OE2 1185 N N . MET A 152 ? 1.0008 0.5878 0.4560 0.0553 0.1697 -0.0266 151 MET A N 1186 C CA . MET A 152 ? 0.9741 0.5904 0.4626 0.0557 0.1780 -0.0226 151 MET A CA 1187 C C . MET A 152 ? 0.9764 0.5995 0.4734 0.0632 0.1965 -0.0228 151 MET A C 1188 O O . MET A 152 ? 0.9672 0.6073 0.4785 0.0622 0.2095 -0.0192 151 MET A O 1189 C CB . MET A 152 ? 0.9371 0.5768 0.4554 0.0562 0.1648 -0.0212 151 MET A CB 1190 C CG . MET A 152 ? 0.9302 0.5665 0.4450 0.0490 0.1502 -0.0200 151 MET A CG 1191 S SD . MET A 152 ? 0.8895 0.5497 0.4351 0.0496 0.1351 -0.0195 151 MET A SD 1192 C CE . MET A 152 ? 0.8763 0.5695 0.4519 0.0431 0.1436 -0.0162 151 MET A CE 1193 N N . TYR A 153 ? 0.9938 0.6027 0.4818 0.0706 0.1986 -0.0269 152 TYR A N 1194 C CA . TYR A 153 ? 1.0117 0.6196 0.5030 0.0798 0.2185 -0.0273 152 TYR A CA 1195 C C . TYR A 153 ? 1.0382 0.6321 0.5075 0.0772 0.2351 -0.0279 152 TYR A C 1196 O O . TYR A 153 ? 1.0462 0.6568 0.5324 0.0815 0.2525 -0.0239 152 TYR A O 1197 C CB . TYR A 153 ? 1.0226 0.6056 0.4967 0.0855 0.2183 -0.0337 152 TYR A CB 1198 C CG . TYR A 153 ? 1.0452 0.6144 0.5116 0.0946 0.2409 -0.0359 152 TYR A CG 1199 C CD1 . TYR A 153 ? 1.0353 0.6219 0.5316 0.1070 0.2516 -0.0315 152 TYR A CD1 1200 C CD2 . TYR A 153 ? 1.0898 0.6276 0.5180 0.0914 0.2525 -0.0421 152 TYR A CD2 1201 C CE1 . TYR A 153 ? 1.0618 0.6335 0.5515 0.1170 0.2745 -0.0328 152 TYR A CE1 1202 C CE2 . TYR A 153 ? 1.1027 0.6249 0.5223 0.0999 0.2754 -0.0449 152 TYR A CE2 1203 C CZ . TYR A 153 ? 1.0969 0.6354 0.5480 0.1132 0.2869 -0.0402 152 TYR A CZ 1204 O OH . TYR A 153 ? 1.1233 0.6449 0.5668 0.1233 0.3115 -0.0422 152 TYR A OH 1205 N N . GLN A 154 ? 1.0703 0.6351 0.5017 0.0702 0.2298 -0.0321 153 GLN A N 1206 C CA . GLN A 154 ? 1.1038 0.6513 0.5081 0.0669 0.2448 -0.0328 153 GLN A CA 1207 C C . GLN A 154 ? 1.0829 0.6494 0.5016 0.0611 0.2501 -0.0262 153 GLN A C 1208 O O . GLN A 154 ? 1.0971 0.6659 0.5150 0.0620 0.2691 -0.0246 153 GLN A O 1209 C CB . GLN A 154 ? 1.1480 0.6629 0.5078 0.0601 0.2355 -0.0374 153 GLN A CB 1210 C CG . GLN A 154 ? 1.1774 0.6687 0.5149 0.0630 0.2360 -0.0459 153 GLN A CG 1211 C CD . GLN A 154 ? 1.2178 0.6967 0.5464 0.0693 0.2609 -0.0498 153 GLN A CD 1212 O OE1 . GLN A 154 ? 1.2405 0.7229 0.5686 0.0700 0.2777 -0.0466 153 GLN A OE1 1213 N NE2 . GLN A 154 ? 1.2369 0.7002 0.5585 0.0740 0.2647 -0.0567 153 GLN A NE2 1214 N N . LEU A 155 ? 1.0647 0.6420 0.4940 0.0544 0.2344 -0.0229 154 LEU A N 1215 C CA . LEU A 155 ? 1.0538 0.6445 0.4933 0.0463 0.2388 -0.0177 154 LEU A CA 1216 C C . LEU A 155 ? 1.0272 0.6544 0.5064 0.0475 0.2492 -0.0140 154 LEU A C 1217 O O . LEU A 155 ? 1.0295 0.6657 0.5132 0.0431 0.2638 -0.0111 154 LEU A O 1218 C CB . LEU A 155 ? 1.0352 0.6251 0.4753 0.0392 0.2205 -0.0156 154 LEU A CB 1219 C CG . LEU A 155 ? 1.0639 0.6226 0.4661 0.0360 0.2110 -0.0154 154 LEU A CG 1220 C CD1 . LEU A 155 ? 1.0489 0.6111 0.4591 0.0302 0.1980 -0.0113 154 LEU A CD1 1221 C CD2 . LEU A 155 ? 1.0946 0.6321 0.4650 0.0331 0.2255 -0.0140 154 LEU A CD2 1222 N N . TYR A 156 ? 1.0132 0.6633 0.5216 0.0531 0.2418 -0.0136 155 TYR A N 1223 C CA . TYR A 156 ? 0.9999 0.6914 0.5488 0.0529 0.2476 -0.0086 155 TYR A CA 1224 C C . TYR A 156 ? 1.0187 0.7254 0.5853 0.0658 0.2623 -0.0062 155 TYR A C 1225 O O . TYR A 156 ? 1.0102 0.7554 0.6123 0.0677 0.2672 -0.0005 155 TYR A O 1226 C CB . TYR A 156 ? 0.9631 0.6755 0.5350 0.0486 0.2295 -0.0078 155 TYR A CB 1227 C CG . TYR A 156 ? 0.9662 0.6578 0.5177 0.0380 0.2176 -0.0098 155 TYR A CG 1228 C CD1 . TYR A 156 ? 0.9809 0.6672 0.5230 0.0273 0.2254 -0.0083 155 TYR A CD1 1229 C CD2 . TYR A 156 ? 0.9574 0.6326 0.4977 0.0395 0.2003 -0.0125 155 TYR A CD2 1230 C CE1 . TYR A 156 ? 0.9818 0.6459 0.5041 0.0196 0.2167 -0.0088 155 TYR A CE1 1231 C CE2 . TYR A 156 ? 0.9584 0.6146 0.4806 0.0320 0.1910 -0.0127 155 TYR A CE2 1232 C CZ . TYR A 156 ? 0.9659 0.6157 0.4789 0.0228 0.1996 -0.0105 155 TYR A CZ 1233 O OH . TYR A 156 ? 0.9701 0.5992 0.4652 0.0171 0.1923 -0.0092 155 TYR A OH 1234 N N . GLY A 157 ? 1.0453 0.7222 0.5869 0.0746 0.2701 -0.0103 156 GLY A N 1235 C CA . GLY A 157 ? 1.0568 0.7397 0.6084 0.0872 0.2903 -0.0081 156 GLY A CA 1236 C C . GLY A 157 ? 1.0365 0.7379 0.6162 0.1005 0.2899 -0.0046 156 GLY A C 1237 O O . GLY A 157 ? 1.0475 0.7658 0.6471 0.1118 0.3074 0.0007 156 GLY A O 1238 N N . GLY A 158 ? 1.0112 0.7095 0.5929 0.1001 0.2711 -0.0068 157 GLY A N 1239 C CA . GLY A 158 ? 1.0086 0.7153 0.6095 0.1132 0.2713 -0.0039 157 GLY A CA 1240 C C . GLY A 158 ? 1.0016 0.6991 0.5984 0.1105 0.2500 -0.0076 157 GLY A C 1241 O O . GLY A 158 ? 0.9785 0.6681 0.5620 0.0988 0.2338 -0.0114 157 GLY A O 1242 N N . PRO A 159 ? 0.9994 0.6988 0.6096 0.1221 0.2506 -0.0054 158 PRO A N 1243 C CA . PRO A 159 ? 0.9883 0.6799 0.5967 0.1205 0.2320 -0.0083 158 PRO A CA 1244 C C . PRO A 159 ? 0.9527 0.6778 0.5857 0.1125 0.2137 -0.0041 158 PRO A C 1245 O O . PRO A 159 ? 0.9406 0.7022 0.6003 0.1111 0.2169 0.0028 158 PRO A O 1246 C CB . PRO A 159 ? 0.9898 0.6811 0.6124 0.1362 0.2422 -0.0043 158 PRO A CB 1247 C CG . PRO A 159 ? 0.9914 0.7096 0.6388 0.1466 0.2618 0.0049 158 PRO A CG 1248 C CD . PRO A 159 ? 1.0049 0.7137 0.6333 0.1384 0.2708 0.0009 158 PRO A CD 1249 N N . VAL A 160 ? 0.9436 0.6563 0.5667 0.1068 0.1955 -0.0087 159 VAL A N 1250 C CA . VAL A 160 ? 0.9388 0.6734 0.5762 0.0971 0.1783 -0.0072 159 VAL A CA 1251 C C . VAL A 160 ? 0.8988 0.6599 0.5651 0.1029 0.1702 -0.0016 159 VAL A C 1252 O O . VAL A 160 ? 0.8984 0.6497 0.5658 0.1130 0.1727 -0.0008 159 VAL A O 1253 C CB . VAL A 160 ? 0.9662 0.6746 0.5769 0.0868 0.1632 -0.0142 159 VAL A CB 1254 C CG1 . VAL A 160 ? 0.9938 0.6699 0.5700 0.0836 0.1708 -0.0194 159 VAL A CG1 1255 C CG2 . VAL A 160 ? 0.9772 0.6735 0.5842 0.0893 0.1503 -0.0171 159 VAL A CG2 1256 N N . VAL A 161 ? 0.8621 0.6557 0.5501 0.0956 0.1616 0.0021 160 VAL A N 1257 C CA . VAL A 161 ? 0.8414 0.6614 0.5539 0.0982 0.1515 0.0071 160 VAL A CA 1258 C C . VAL A 161 ? 0.8273 0.6350 0.5289 0.0887 0.1338 0.0012 160 VAL A C 1259 O O . VAL A 161 ? 0.8241 0.6302 0.5181 0.0770 0.1287 -0.0023 160 VAL A O 1260 C CB . VAL A 161 ? 0.8221 0.6902 0.5663 0.0954 0.1534 0.0151 160 VAL A CB 1261 C CG1 . VAL A 161 ? 0.8032 0.6977 0.5680 0.0951 0.1403 0.0194 160 VAL A CG1 1262 C CG2 . VAL A 161 ? 0.8343 0.7198 0.5945 0.1078 0.1711 0.0234 160 VAL A CG2 1263 N N . LEU A 162 ? 0.8161 0.6134 0.5165 0.0941 0.1259 0.0004 161 LEU A N 1264 C CA . LEU A 162 ? 0.7961 0.5858 0.4906 0.0869 0.1095 -0.0037 161 LEU A CA 1265 C C . LEU A 162 ? 0.7660 0.5913 0.4871 0.0847 0.1019 0.0013 161 LEU A C 1266 O O . LEU A 162 ? 0.7508 0.5966 0.4911 0.0936 0.1053 0.0084 161 LEU A O 1267 C CB . LEU A 162 ? 0.8149 0.5772 0.4951 0.0924 0.1053 -0.0072 161 LEU A CB 1268 C CG . LEU A 162 ? 0.8499 0.5755 0.5000 0.0928 0.1114 -0.0135 161 LEU A CG 1269 C CD1 . LEU A 162 ? 0.8626 0.5655 0.5020 0.0973 0.1089 -0.0169 161 LEU A CD1 1270 C CD2 . LEU A 162 ? 0.8689 0.5801 0.4988 0.0824 0.1036 -0.0184 161 LEU A CD2 1271 N N . VAL A 163 ? 0.7413 0.5732 0.4624 0.0732 0.0923 -0.0017 162 VAL A N 1272 C CA . VAL A 163 ? 0.7206 0.5835 0.4624 0.0686 0.0844 0.0013 162 VAL A CA 1273 C C . VAL A 163 ? 0.7148 0.5611 0.4469 0.0642 0.0717 -0.0037 162 VAL A C 1274 O O . VAL A 163 ? 0.7399 0.5672 0.4563 0.0567 0.0687 -0.0091 162 VAL A O 1275 C CB . VAL A 163 ? 0.7099 0.5982 0.4615 0.0565 0.0868 0.0014 162 VAL A CB 1276 C CG1 . VAL A 163 ? 0.6872 0.6086 0.4579 0.0502 0.0785 0.0037 162 VAL A CG1 1277 C CG2 . VAL A 163 ? 0.7200 0.6251 0.4811 0.0603 0.1002 0.0065 162 VAL A CG2 1278 N N . ALA A 164 ? 0.7040 0.5571 0.4455 0.0694 0.0650 -0.0011 163 ALA A N 1279 C CA . ALA A 164 ? 0.7022 0.5401 0.4359 0.0665 0.0536 -0.0053 163 ALA A CA 1280 C C . ALA A 164 ? 0.6802 0.5444 0.4311 0.0631 0.0464 -0.0028 163 ALA A C 1281 O O . ALA A 164 ? 0.6616 0.5530 0.4301 0.0672 0.0486 0.0038 163 ALA A O 1282 C CB . ALA A 164 ? 0.7076 0.5210 0.4309 0.0750 0.0524 -0.0061 163 ALA A CB 1283 N N . HIS A 165 ? 0.6927 0.5493 0.4380 0.0558 0.0383 -0.0076 164 HIS A N 1284 C CA . HIS A 165 ? 0.6835 0.5614 0.4412 0.0511 0.0319 -0.0067 164 HIS A CA 1285 C C . HIS A 165 ? 0.6773 0.5400 0.4310 0.0543 0.0238 -0.0082 164 HIS A C 1286 O O . HIS A 165 ? 0.6619 0.4990 0.4016 0.0540 0.0210 -0.0125 164 HIS A O 1287 C CB . HIS A 165 ? 0.6935 0.5786 0.4495 0.0376 0.0318 -0.0116 164 HIS A CB 1288 C CG . HIS A 165 ? 0.6992 0.6055 0.4651 0.0311 0.0262 -0.0120 164 HIS A CG 1289 N ND1 . HIS A 165 ? 0.6995 0.5927 0.4583 0.0251 0.0218 -0.0176 164 HIS A ND1 1290 C CD2 . HIS A 165 ? 0.6900 0.6299 0.4717 0.0301 0.0245 -0.0068 164 HIS A CD2 1291 C CE1 . HIS A 165 ? 0.7050 0.6212 0.4731 0.0197 0.0182 -0.0171 164 HIS A CE1 1292 N NE2 . HIS A 165 ? 0.6906 0.6363 0.4723 0.0223 0.0190 -0.0104 164 HIS A NE2 1293 N N . SER A 166 ? 0.6699 0.5506 0.4364 0.0572 0.0202 -0.0039 165 SER A N 1294 C CA . SER A 166 ? 0.6715 0.5436 0.4372 0.0583 0.0127 -0.0050 165 SER A CA 1295 C C . SER A 166 ? 0.6715 0.5145 0.4255 0.0647 0.0116 -0.0067 165 SER A C 1296 O O . SER A 166 ? 0.7077 0.5440 0.4601 0.0718 0.0169 -0.0040 165 SER A O 1297 C CB . SER A 166 ? 0.6805 0.5508 0.4421 0.0483 0.0087 -0.0109 165 SER A CB 1298 O OG . SER A 166 ? 0.6766 0.5451 0.4409 0.0489 0.0024 -0.0113 165 SER A OG 1299 N N . MET A 167 ? 0.6713 0.4978 0.4170 0.0618 0.0055 -0.0110 166 MET A N 1300 C CA . MET A 167 ? 0.6966 0.4991 0.4306 0.0653 0.0029 -0.0129 166 MET A CA 1301 C C . MET A 167 ? 0.7130 0.4987 0.4326 0.0669 0.0085 -0.0147 166 MET A C 1302 O O . MET A 167 ? 0.7198 0.4882 0.4293 0.0698 0.0087 -0.0160 166 MET A O 1303 C CB . MET A 167 ? 0.7029 0.4959 0.4320 0.0615 -0.0046 -0.0160 166 MET A CB 1304 C CG . MET A 167 ? 0.7263 0.5009 0.4454 0.0632 -0.0095 -0.0174 166 MET A CG 1305 S SD . MET A 167 ? 0.7417 0.5123 0.4599 0.0604 -0.0184 -0.0184 166 MET A SD 1306 C CE . MET A 167 ? 0.7452 0.5039 0.4492 0.0587 -0.0160 -0.0193 166 MET A CE 1307 N N . GLY A 168 ? 0.7169 0.5073 0.4343 0.0638 0.0137 -0.0152 167 GLY A N 1308 C CA . GLY A 168 ? 0.7465 0.5226 0.4504 0.0654 0.0205 -0.0163 167 GLY A CA 1309 C C . GLY A 168 ? 0.7569 0.5319 0.4629 0.0728 0.0278 -0.0138 167 GLY A C 1310 O O . GLY A 168 ? 0.7568 0.5129 0.4480 0.0750 0.0330 -0.0159 167 GLY A O 1311 N N . ASN A 169 ? 0.7411 0.5355 0.4645 0.0771 0.0293 -0.0088 168 ASN A N 1312 C CA . ASN A 169 ? 0.7522 0.5440 0.4788 0.0862 0.0376 -0.0048 168 ASN A CA 1313 C C . ASN A 169 ? 0.7774 0.5424 0.4913 0.0886 0.0365 -0.0081 168 ASN A C 1314 O O . ASN A 169 ? 0.8099 0.5578 0.5147 0.0937 0.0457 -0.0087 168 ASN A O 1315 C CB . ASN A 169 ? 0.7301 0.5507 0.4789 0.0911 0.0388 0.0033 168 ASN A CB 1316 C CG . ASN A 169 ? 0.7203 0.5700 0.4816 0.0884 0.0421 0.0070 168 ASN A CG 1317 O OD1 . ASN A 169 ? 0.7519 0.6057 0.5150 0.0927 0.0518 0.0098 168 ASN A OD1 1318 N ND2 . ASN A 169 ? 0.7045 0.5745 0.4740 0.0803 0.0348 0.0066 168 ASN A ND2 1319 N N . MET A 170 ? 0.7839 0.5452 0.4969 0.0839 0.0260 -0.0106 169 MET A N 1320 C CA . MET A 170 ? 0.7950 0.5339 0.4966 0.0832 0.0234 -0.0143 169 MET A CA 1321 C C . MET A 170 ? 0.7924 0.5084 0.4707 0.0782 0.0222 -0.0210 169 MET A C 1322 O O . MET A 170 ? 0.8303 0.5245 0.4939 0.0780 0.0262 -0.0249 169 MET A O 1323 C CB . MET A 170 ? 0.7973 0.5431 0.5069 0.0793 0.0126 -0.0142 169 MET A CB 1324 C CG . MET A 170 ? 0.8092 0.5730 0.5377 0.0842 0.0141 -0.0076 169 MET A CG 1325 S SD . MET A 170 ? 0.8759 0.6226 0.6028 0.0918 0.0240 -0.0047 169 MET A SD 1326 C CE . MET A 170 ? 0.8703 0.5996 0.5892 0.0840 0.0152 -0.0104 169 MET A CE 1327 N N . TYR A 171 ? 0.7633 0.4833 0.4370 0.0737 0.0174 -0.0222 170 TYR A N 1328 C CA . TYR A 171 ? 0.7801 0.4813 0.4313 0.0700 0.0174 -0.0266 170 TYR A CA 1329 C C . TYR A 171 ? 0.7878 0.4769 0.4282 0.0738 0.0307 -0.0277 170 TYR A C 1330 O O . TYR A 171 ? 0.8131 0.4801 0.4326 0.0716 0.0330 -0.0326 170 TYR A O 1331 C CB . TYR A 171 ? 0.7658 0.4737 0.4157 0.0663 0.0128 -0.0256 170 TYR A CB 1332 C CG . TYR A 171 ? 0.7715 0.4756 0.4161 0.0622 0.0008 -0.0263 170 TYR A CG 1333 C CD1 . TYR A 171 ? 0.7541 0.4701 0.4140 0.0618 -0.0067 -0.0248 170 TYR A CD1 1334 C CD2 . TYR A 171 ? 0.7903 0.4804 0.4147 0.0592 -0.0027 -0.0275 170 TYR A CD2 1335 C CE1 . TYR A 171 ? 0.7573 0.4722 0.4146 0.0591 -0.0170 -0.0243 170 TYR A CE1 1336 C CE2 . TYR A 171 ? 0.7937 0.4841 0.4153 0.0566 -0.0139 -0.0262 170 TYR A CE2 1337 C CZ . TYR A 171 ? 0.7779 0.4810 0.4169 0.0569 -0.0207 -0.0245 170 TYR A CZ 1338 O OH . TYR A 171 ? 0.7889 0.4944 0.4268 0.0553 -0.0311 -0.0222 170 TYR A OH 1339 N N . THR A 172 ? 0.7610 0.4658 0.4157 0.0789 0.0395 -0.0233 171 THR A N 1340 C CA . THR A 172 ? 0.7790 0.4761 0.4274 0.0840 0.0537 -0.0230 171 THR A CA 1341 C C . THR A 172 ? 0.7964 0.4769 0.4406 0.0899 0.0620 -0.0240 171 THR A C 1342 O O . THR A 172 ? 0.8065 0.4641 0.4315 0.0907 0.0716 -0.0283 171 THR A O 1343 C CB . THR A 172 ? 0.7604 0.4844 0.4290 0.0879 0.0605 -0.0167 171 THR A CB 1344 O OG1 . THR A 172 ? 0.7502 0.4841 0.4190 0.0806 0.0547 -0.0174 171 THR A OG1 1345 C CG2 . THR A 172 ? 0.7772 0.4958 0.4416 0.0941 0.0763 -0.0154 171 THR A CG2 1346 N N . LEU A 173 ? 0.7908 0.4803 0.4510 0.0936 0.0596 -0.0202 172 LEU A N 1347 C CA . LEU A 173 ? 0.8128 0.4827 0.4683 0.0987 0.0683 -0.0209 172 LEU A CA 1348 C C . LEU A 173 ? 0.8316 0.4705 0.4605 0.0901 0.0649 -0.0307 172 LEU A C 1349 O O . LEU A 173 ? 0.8493 0.4623 0.4611 0.0913 0.0765 -0.0353 172 LEU A O 1350 C CB . LEU A 173 ? 0.8025 0.4876 0.4791 0.1033 0.0651 -0.0143 172 LEU A CB 1351 C CG . LEU A 173 ? 0.8273 0.4910 0.5008 0.1092 0.0754 -0.0137 172 LEU A CG 1352 C CD1 . LEU A 173 ? 0.8502 0.5027 0.5207 0.1198 0.0945 -0.0109 172 LEU A CD1 1353 C CD2 . LEU A 173 ? 0.8106 0.4923 0.5057 0.1141 0.0720 -0.0053 172 LEU A CD2 1354 N N . TYR A 174 ? 0.8338 0.4761 0.4586 0.0808 0.0494 -0.0339 173 TYR A N 1355 C CA . TYR A 174 ? 0.8635 0.4831 0.4638 0.0709 0.0435 -0.0424 173 TYR A CA 1356 C C . TYR A 174 ? 0.8990 0.4994 0.4739 0.0686 0.0512 -0.0477 173 TYR A C 1357 O O . TYR A 174 ? 0.9083 0.4822 0.4609 0.0644 0.0580 -0.0549 173 TYR A O 1358 C CB . TYR A 174 ? 0.8458 0.4788 0.4487 0.0633 0.0258 -0.0423 173 TYR A CB 1359 C CG . TYR A 174 ? 0.8652 0.4827 0.4452 0.0524 0.0170 -0.0492 173 TYR A CG 1360 C CD1 . TYR A 174 ? 0.8760 0.4862 0.4542 0.0460 0.0122 -0.0529 173 TYR A CD1 1361 C CD2 . TYR A 174 ? 0.8948 0.5074 0.4553 0.0477 0.0129 -0.0513 173 TYR A CD2 1362 C CE1 . TYR A 174 ? 0.9073 0.5080 0.4653 0.0342 0.0029 -0.0590 173 TYR A CE1 1363 C CE2 . TYR A 174 ? 0.9202 0.5232 0.4597 0.0372 0.0034 -0.0564 173 TYR A CE2 1364 C CZ . TYR A 174 ? 0.9258 0.5242 0.4645 0.0299 -0.0019 -0.0604 173 TYR A CZ 1365 O OH . TYR A 174 ? 0.9425 0.5355 0.4612 0.0179 -0.0123 -0.0653 173 TYR A OH 1366 N N . PHE A 175 ? 0.8954 0.5081 0.4723 0.0704 0.0512 -0.0445 174 PHE A N 1367 C CA . PHE A 175 ? 0.9124 0.5092 0.4659 0.0685 0.0588 -0.0484 174 PHE A CA 1368 C C . PHE A 175 ? 0.9653 0.5435 0.5113 0.0749 0.0781 -0.0507 174 PHE A C 1369 O O . PHE A 175 ? 1.0272 0.5781 0.5451 0.0700 0.0845 -0.0585 174 PHE A O 1370 C CB . PHE A 175 ? 0.8978 0.5127 0.4596 0.0703 0.0578 -0.0432 174 PHE A CB 1371 C CG . PHE A 175 ? 0.9236 0.5246 0.4640 0.0695 0.0676 -0.0457 174 PHE A CG 1372 C CD1 . PHE A 175 ? 0.9502 0.5334 0.4613 0.0613 0.0621 -0.0508 174 PHE A CD1 1373 C CD2 . PHE A 175 ? 0.9174 0.5254 0.4673 0.0767 0.0822 -0.0421 174 PHE A CD2 1374 C CE1 . PHE A 175 ? 0.9790 0.5489 0.4685 0.0603 0.0716 -0.0527 174 PHE A CE1 1375 C CE2 . PHE A 175 ? 0.9507 0.5458 0.4809 0.0758 0.0924 -0.0443 174 PHE A CE2 1376 C CZ . PHE A 175 ? 0.9765 0.5512 0.4755 0.0676 0.0874 -0.0498 174 PHE A CZ 1377 N N . LEU A 176 ? 0.9437 0.5369 0.5140 0.0859 0.0878 -0.0435 175 LEU A N 1378 C CA . LEU A 176 ? 0.9723 0.5510 0.5398 0.0951 0.1082 -0.0431 175 LEU A CA 1379 C C . LEU A 176 ? 1.0011 0.5500 0.5548 0.0945 0.1156 -0.0490 175 LEU A C 1380 O O . LEU A 176 ? 1.0237 0.5453 0.5577 0.0964 0.1318 -0.0543 175 LEU A O 1381 C CB . LEU A 176 ? 0.9398 0.5472 0.5397 0.1077 0.1155 -0.0318 175 LEU A CB 1382 C CG . LEU A 176 ? 0.9196 0.5536 0.5310 0.1074 0.1132 -0.0271 175 LEU A CG 1383 C CD1 . LEU A 176 ? 0.8913 0.5601 0.5365 0.1167 0.1159 -0.0159 175 LEU A CD1 1384 C CD2 . LEU A 176 ? 0.9406 0.5596 0.5332 0.1079 0.1267 -0.0305 175 LEU A CD2 1385 N N . GLN A 177 ? 0.9954 0.5479 0.5583 0.0912 0.1051 -0.0486 176 GLN A N 1386 C CA . GLN A 177 ? 1.0330 0.5557 0.5815 0.0877 0.1113 -0.0551 176 GLN A CA 1387 C C . GLN A 177 ? 1.0812 0.5731 0.5922 0.0739 0.1110 -0.0683 176 GLN A C 1388 O O . GLN A 177 ? 1.1001 0.5596 0.5918 0.0713 0.1239 -0.0757 176 GLN A O 1389 C CB . GLN A 177 ? 1.0102 0.5445 0.5743 0.0840 0.0979 -0.0526 176 GLN A CB 1390 C CG . GLN A 177 ? 0.9862 0.5412 0.5818 0.0975 0.1027 -0.0405 176 GLN A CG 1391 C CD . GLN A 177 ? 0.9760 0.5392 0.5843 0.0935 0.0912 -0.0385 176 GLN A CD 1392 O OE1 . GLN A 177 ? 0.9725 0.5338 0.5714 0.0807 0.0770 -0.0449 176 GLN A OE1 1393 N NE2 . GLN A 177 ? 0.9734 0.5477 0.6038 0.1047 0.0976 -0.0285 176 GLN A NE2 1394 N N . ARG A 178 ? 1.1071 0.6089 0.6070 0.0649 0.0969 -0.0708 177 ARG A N 1395 C CA . ARG A 178 ? 1.1575 0.6366 0.6219 0.0507 0.0931 -0.0818 177 ARG A CA 1396 C C . ARG A 178 ? 1.1622 0.6257 0.6027 0.0514 0.1055 -0.0857 177 ARG A C 1397 O O . ARG A 178 ? 1.1911 0.6373 0.5996 0.0391 0.1020 -0.0944 177 ARG A O 1398 C CB . ARG A 178 ? 1.1820 0.6808 0.6466 0.0402 0.0695 -0.0811 177 ARG A CB 1399 C CG . ARG A 178 ? 1.2297 0.7358 0.7083 0.0353 0.0584 -0.0809 177 ARG A CG 1400 C CD . ARG A 178 ? 1.2980 0.8283 0.7834 0.0282 0.0364 -0.0777 177 ARG A CD 1401 N NE . ARG A 178 ? 1.4188 0.9474 0.9027 0.0171 0.0262 -0.0820 177 ARG A NE 1402 C CZ . ARG A 178 ? 1.4587 0.9919 0.9633 0.0196 0.0266 -0.0796 177 ARG A CZ 1403 N NH1 . ARG A 178 ? 1.4533 0.9944 0.9819 0.0334 0.0360 -0.0722 177 ARG A NH1 1404 N NH2 . ARG A 178 ? 1.4843 1.0159 0.9855 0.0075 0.0174 -0.0841 177 ARG A NH2 1405 N N . GLN A 179 ? 1.1390 0.6107 0.5946 0.0648 0.1194 -0.0789 178 GLN A N 1406 C CA . GLN A 179 ? 1.1521 0.6078 0.5860 0.0663 0.1341 -0.0824 178 GLN A CA 1407 C C . GLN A 179 ? 1.1616 0.5885 0.5875 0.0738 0.1585 -0.0863 178 GLN A C 1408 O O . GLN A 179 ? 1.1535 0.5863 0.6043 0.0853 0.1665 -0.0796 178 GLN A O 1409 C CB . GLN A 179 ? 1.1307 0.6136 0.5855 0.0757 0.1362 -0.0726 178 GLN A CB 1410 C CG . GLN A 179 ? 1.1142 0.6236 0.5786 0.0703 0.1158 -0.0677 178 GLN A CG 1411 C CD . GLN A 179 ? 1.1409 0.6390 0.5763 0.0560 0.1011 -0.0744 178 GLN A CD 1412 O OE1 . GLN A 179 ? 1.1617 0.6403 0.5660 0.0501 0.1064 -0.0804 178 GLN A OE1 1413 N NE2 . GLN A 179 ? 1.1332 0.6454 0.5789 0.0506 0.0824 -0.0727 178 GLN A NE2 1414 N N . PRO A 180 ? 1.1949 0.5902 0.5855 0.0680 0.1715 -0.0963 179 PRO A N 1415 C CA . PRO A 180 ? 1.2197 0.5840 0.6011 0.0762 0.1981 -0.1002 179 PRO A CA 1416 C C . PRO A 180 ? 1.2028 0.5860 0.6159 0.0967 0.2142 -0.0876 179 PRO A C 1417 O O . PRO A 180 ? 1.1812 0.5937 0.6101 0.1009 0.2090 -0.0798 179 PRO A O 1418 C CB . PRO A 180 ? 1.2539 0.5866 0.5906 0.0653 0.2074 -0.1128 179 PRO A CB 1419 C CG . PRO A 180 ? 1.2512 0.5947 0.5703 0.0483 0.1825 -0.1168 179 PRO A CG 1420 C CD . PRO A 180 ? 1.2040 0.5902 0.5603 0.0539 0.1631 -0.1040 179 PRO A CD 1421 N N . GLN A 181 ? 1.2170 0.5838 0.6392 0.1090 0.2343 -0.0851 180 GLN A N 1422 C CA . GLN A 181 ? 1.1999 0.5868 0.6540 0.1297 0.2506 -0.0715 180 GLN A CA 1423 C C . GLN A 181 ? 1.2098 0.5991 0.6556 0.1337 0.2636 -0.0711 180 GLN A C 1424 O O . GLN A 181 ? 1.1810 0.6055 0.6562 0.1440 0.2643 -0.0592 180 GLN A O 1425 C CB . GLN A 181 ? 1.2291 0.5896 0.6875 0.1429 0.2738 -0.0694 180 GLN A CB 1426 C CG . GLN A 181 ? 1.2230 0.6101 0.7198 0.1664 0.2892 -0.0521 180 GLN A CG 1427 C CD . GLN A 181 ? 1.1792 0.6164 0.7163 0.1712 0.2693 -0.0379 180 GLN A CD 1428 O OE1 . GLN A 181 ? 1.1670 0.6070 0.7115 0.1669 0.2559 -0.0371 180 GLN A OE1 1429 N NE2 . GLN A 181 ? 1.1613 0.6383 0.7241 0.1791 0.2681 -0.0270 180 GLN A NE2 1430 N N . ALA A 182 ? 1.2469 0.5995 0.6519 0.1242 0.2739 -0.0844 181 ALA A N 1431 C CA . ALA A 182 ? 1.2654 0.6168 0.6587 0.1270 0.2876 -0.0849 181 ALA A CA 1432 C C . ALA A 182 ? 1.2304 0.6171 0.6327 0.1203 0.2678 -0.0799 181 ALA A C 1433 O O . ALA A 182 ? 1.2183 0.6248 0.6346 0.1282 0.2769 -0.0725 181 ALA A O 1434 C CB . ALA A 182 ? 1.3160 0.6196 0.6590 0.1153 0.3007 -0.1014 181 ALA A CB 1435 N N . TRP A 183 ? 1.2147 0.6096 0.6103 0.1060 0.2418 -0.0832 182 TRP A N 1436 C CA . TRP A 183 ? 1.1843 0.6097 0.5886 0.1000 0.2232 -0.0780 182 TRP A CA 1437 C C . TRP A 183 ? 1.1430 0.6111 0.5941 0.1119 0.2198 -0.0636 182 TRP A C 1438 O O . TRP A 183 ? 1.1298 0.6207 0.5933 0.1143 0.2214 -0.0573 182 TRP A O 1439 C CB . TRP A 183 ? 1.1816 0.6063 0.5706 0.0843 0.1975 -0.0834 182 TRP A CB 1440 C CG . TRP A 183 ? 1.1681 0.6175 0.5613 0.0786 0.1810 -0.0782 182 TRP A CG 1441 C CD1 . TRP A 183 ? 1.1773 0.6171 0.5408 0.0693 0.1778 -0.0820 182 TRP A CD1 1442 C CD2 . TRP A 183 ? 1.1140 0.6001 0.5420 0.0820 0.1668 -0.0680 182 TRP A CD2 1443 N NE1 . TRP A 183 ? 1.1594 0.6260 0.5379 0.0676 0.1633 -0.0741 182 TRP A NE1 1444 C CE2 . TRP A 183 ? 1.1032 0.5975 0.5206 0.0747 0.1568 -0.0663 182 TRP A CE2 1445 C CE3 . TRP A 183 ? 1.0807 0.5924 0.5462 0.0901 0.1624 -0.0601 182 TRP A CE3 1446 C CZ2 . TRP A 183 ? 1.0777 0.6020 0.5203 0.0749 0.1439 -0.0581 182 TRP A CZ2 1447 C CZ3 . TRP A 183 ? 1.0446 0.5884 0.5342 0.0893 0.1484 -0.0524 182 TRP A CZ3 1448 C CH2 . TRP A 183 ? 1.0467 0.5951 0.5246 0.0815 0.1400 -0.0520 182 TRP A CH2 1449 N N . LYS A 184 ? 1.1059 0.5842 0.5819 0.1188 0.2165 -0.0585 183 LYS A N 1450 C CA . LYS A 184 ? 1.0634 0.5837 0.5819 0.1286 0.2119 -0.0451 183 LYS A CA 1451 C C . LYS A 184 ? 1.0585 0.5934 0.5967 0.1435 0.2335 -0.0362 183 LYS A C 1452 O O . LYS A 184 ? 1.0089 0.5805 0.5731 0.1462 0.2302 -0.0271 183 LYS A O 1453 C CB . LYS A 184 ? 1.0381 0.5650 0.5761 0.1324 0.2036 -0.0412 183 LYS A CB 1454 C CG . LYS A 184 ? 1.0204 0.5441 0.5471 0.1179 0.1802 -0.0475 183 LYS A CG 1455 C CD . LYS A 184 ? 1.0082 0.5385 0.5536 0.1209 0.1726 -0.0438 183 LYS A CD 1456 C CE . LYS A 184 ? 1.0543 0.5483 0.5846 0.1244 0.1879 -0.0491 183 LYS A CE 1457 N NZ . LYS A 184 ? 1.0532 0.5483 0.5948 0.1231 0.1780 -0.0476 183 LYS A NZ 1458 N N . ASP A 185 ? 1.1006 0.6060 0.6253 0.1521 0.2563 -0.0393 184 ASP A N 1459 C CA . ASP A 185 ? 1.1062 0.6231 0.6488 0.1679 0.2798 -0.0305 184 ASP A CA 1460 C C . ASP A 185 ? 1.1055 0.6336 0.6413 0.1629 0.2832 -0.0310 184 ASP A C 1461 O O . ASP A 185 ? 1.0882 0.6483 0.6520 0.1723 0.2923 -0.0202 184 ASP A O 1462 C CB . ASP A 185 ? 1.1567 0.6317 0.6801 0.1775 0.3058 -0.0355 184 ASP A CB 1463 C CG . ASP A 185 ? 1.1797 0.6480 0.7189 0.1880 0.3094 -0.0302 184 ASP A CG 1464 O OD1 . ASP A 185 ? 1.1218 0.6239 0.6917 0.1908 0.2936 -0.0203 184 ASP A OD1 1465 O OD2 . ASP A 185 ? 1.2448 0.6719 0.7641 0.1934 0.3296 -0.0362 184 ASP A OD2 1466 N N . LYS A 186 ? 1.1254 0.6292 0.6247 0.1477 0.2757 -0.0427 185 LYS A N 1467 C CA . LYS A 186 ? 1.1373 0.6477 0.6262 0.1418 0.2786 -0.0433 185 LYS A CA 1468 C C . LYS A 186 ? 1.1076 0.6560 0.6179 0.1344 0.2584 -0.0368 185 LYS A C 1469 O O . LYS A 186 ? 1.1216 0.6957 0.6490 0.1364 0.2646 -0.0299 185 LYS A O 1470 C CB . LYS A 186 ? 1.1914 0.6613 0.6308 0.1283 0.2780 -0.0572 185 LYS A CB 1471 C CG . LYS A 186 ? 1.2160 0.6895 0.6401 0.1211 0.2799 -0.0576 185 LYS A CG 1472 C CD . LYS A 186 ? 1.2741 0.7067 0.6470 0.1095 0.2825 -0.0705 185 LYS A CD 1473 C CE . LYS A 186 ? 1.2891 0.7253 0.6458 0.1025 0.2839 -0.0695 185 LYS A CE 1474 N NZ . LYS A 186 ? 1.3353 0.7362 0.6409 0.0893 0.2814 -0.0807 185 LYS A NZ 1475 N N . TYR A 187 ? 1.0807 0.6318 0.5894 0.1251 0.2353 -0.0392 186 TYR A N 1476 C CA . TYR A 187 ? 1.0445 0.6194 0.5613 0.1151 0.2167 -0.0363 186 TYR A CA 1477 C C . TYR A 187 ? 0.9998 0.6151 0.5568 0.1181 0.2053 -0.0268 186 TYR A C 1478 O O . TYR A 187 ? 0.9747 0.6117 0.5417 0.1108 0.1955 -0.0237 186 TYR A O 1479 C CB . TYR A 187 ? 1.0512 0.6039 0.5378 0.1019 0.1985 -0.0446 186 TYR A CB 1480 C CG . TYR A 187 ? 1.0861 0.6076 0.5314 0.0947 0.2053 -0.0526 186 TYR A CG 1481 C CD1 . TYR A 187 ? 1.0928 0.6193 0.5302 0.0908 0.2097 -0.0502 186 TYR A CD1 1482 C CD2 . TYR A 187 ? 1.1344 0.6209 0.5470 0.0907 0.2078 -0.0626 186 TYR A CD2 1483 C CE1 . TYR A 187 ? 1.1305 0.6290 0.5286 0.0842 0.2160 -0.0567 186 TYR A CE1 1484 C CE2 . TYR A 187 ? 1.1691 0.6281 0.5413 0.0829 0.2137 -0.0701 186 TYR A CE2 1485 C CZ . TYR A 187 ? 1.1670 0.6325 0.5320 0.0802 0.2176 -0.0666 186 TYR A CZ 1486 O OH . TYR A 187 ? 1.1887 0.6277 0.5123 0.0725 0.2233 -0.0733 186 TYR A OH 1487 N N . ILE A 188 ? 0.9973 0.6212 0.5753 0.1279 0.2072 -0.0224 187 ILE A N 1488 C CA . ILE A 188 ? 0.9614 0.6231 0.5745 0.1299 0.1951 -0.0137 187 ILE A CA 1489 C C . ILE A 188 ? 0.9491 0.6414 0.5946 0.1434 0.2097 -0.0022 187 ILE A C 1490 O O . ILE A 188 ? 0.9607 0.6414 0.6087 0.1563 0.2249 0.0004 187 ILE A O 1491 C CB . ILE A 188 ? 0.9601 0.6129 0.5740 0.1300 0.1825 -0.0156 187 ILE A CB 1492 C CG1 . ILE A 188 ? 0.9689 0.5958 0.5529 0.1166 0.1672 -0.0258 187 ILE A CG1 1493 C CG2 . ILE A 188 ? 0.9279 0.6200 0.5762 0.1317 0.1709 -0.0065 187 ILE A CG2 1494 C CD1 . ILE A 188 ? 0.9505 0.5939 0.5361 0.1058 0.1519 -0.0255 187 ILE A CD1 1495 N N . ARG A 189 ? 0.9370 0.6689 0.6076 0.1402 0.2053 0.0048 188 ARG A N 1496 C CA . ARG A 189 ? 0.9357 0.7060 0.6409 0.1516 0.2164 0.0174 188 ARG A CA 1497 C C . ARG A 189 ? 0.9074 0.7035 0.6391 0.1576 0.2063 0.0257 188 ARG A C 1498 O O . ARG A 189 ? 0.9012 0.7088 0.6519 0.1730 0.2175 0.0354 188 ARG A O 1499 C CB . ARG A 189 ? 0.9440 0.7478 0.6638 0.1428 0.2158 0.0208 188 ARG A CB 1500 C CG . ARG A 189 ? 0.9596 0.8088 0.7160 0.1529 0.2271 0.0343 188 ARG A CG 1501 C CD . ARG A 189 ? 0.9976 0.8776 0.7650 0.1401 0.2258 0.0356 188 ARG A CD 1502 N NE . ARG A 189 ? 1.0356 0.9658 0.8404 0.1477 0.2350 0.0491 188 ARG A NE 1503 C CZ . ARG A 189 ? 1.0965 1.0417 0.9105 0.1510 0.2522 0.0537 188 ARG A CZ 1504 N NH1 . ARG A 189 ? 1.1440 1.0555 0.9306 0.1472 0.2635 0.0454 188 ARG A NH1 1505 N NH2 . ARG A 189 ? 1.1084 1.1056 0.9602 0.1580 0.2581 0.0675 188 ARG A NH2 1506 N N . ALA A 190 ? 0.8792 0.6835 0.6116 0.1461 0.1860 0.0225 189 ALA A N 1507 C CA . ALA A 190 ? 0.8559 0.6854 0.6114 0.1498 0.1752 0.0299 189 ALA A CA 1508 C C . ALA A 190 ? 0.8307 0.6525 0.5752 0.1361 0.1548 0.0222 189 ALA A C 1509 O O . ALA A 190 ? 0.8258 0.6327 0.5514 0.1239 0.1487 0.0137 189 ALA A O 1510 C CB . ALA A 190 ? 0.8312 0.7145 0.6216 0.1521 0.1763 0.0422 189 ALA A CB 1511 N N . PHE A 191 ? 0.8008 0.6327 0.5578 0.1393 0.1454 0.0264 190 PHE A N 1512 C CA . PHE A 191 ? 0.7836 0.6124 0.5349 0.1284 0.1269 0.0208 190 PHE A CA 1513 C C . PHE A 191 ? 0.7691 0.6422 0.5493 0.1282 0.1192 0.0301 190 PHE A C 1514 O O . PHE A 191 ? 0.7659 0.6546 0.5636 0.1399 0.1229 0.0400 190 PHE A O 1515 C CB . PHE A 191 ? 0.7906 0.5840 0.5251 0.1321 0.1247 0.0160 190 PHE A CB 1516 C CG . PHE A 191 ? 0.7613 0.5540 0.4942 0.1238 0.1071 0.0123 190 PHE A CG 1517 C CD1 . PHE A 191 ? 0.7468 0.5594 0.4855 0.1125 0.0945 0.0107 190 PHE A CD1 1518 C CD2 . PHE A 191 ? 0.7632 0.5325 0.4875 0.1269 0.1046 0.0099 190 PHE A CD2 1519 C CE1 . PHE A 191 ? 0.7347 0.5454 0.4721 0.1062 0.0803 0.0075 190 PHE A CE1 1520 C CE2 . PHE A 191 ? 0.7575 0.5268 0.4814 0.1197 0.0895 0.0070 190 PHE A CE2 1521 C CZ . PHE A 191 ? 0.7372 0.5275 0.4680 0.1101 0.0775 0.0061 190 PHE A CZ 1522 N N . VAL A 192 ? 0.7672 0.6605 0.5514 0.1146 0.1097 0.0274 191 VAL A N 1523 C CA . VAL A 192 ? 0.7465 0.6811 0.5535 0.1099 0.1008 0.0337 191 VAL A CA 1524 C C . VAL A 192 ? 0.7420 0.6641 0.5400 0.1021 0.0859 0.0274 191 VAL A C 1525 O O . VAL A 192 ? 0.7393 0.6419 0.5204 0.0912 0.0798 0.0179 191 VAL A O 1526 C CB . VAL A 192 ? 0.7445 0.7072 0.5597 0.0974 0.1011 0.0330 191 VAL A CB 1527 C CG1 . VAL A 192 ? 0.7251 0.7289 0.5596 0.0890 0.0907 0.0373 191 VAL A CG1 1528 C CG2 . VAL A 192 ? 0.7586 0.7366 0.5848 0.1052 0.1165 0.0399 191 VAL A CG2 1529 N N . SER A 193 ? 0.7431 0.6767 0.5529 0.1088 0.0813 0.0338 192 SER A N 1530 C CA . SER A 193 ? 0.7439 0.6637 0.5461 0.1044 0.0694 0.0291 192 SER A CA 1531 C C . SER A 193 ? 0.7222 0.6782 0.5400 0.0964 0.0597 0.0325 192 SER A C 1532 O O . SER A 193 ? 0.7128 0.7006 0.5498 0.1028 0.0608 0.0433 192 SER A O 1533 C CB . SER A 193 ? 0.7650 0.6670 0.5665 0.1174 0.0729 0.0335 192 SER A CB 1534 O OG . SER A 193 ? 0.7807 0.6698 0.5756 0.1129 0.0620 0.0292 192 SER A OG 1535 N N . LEU A 194 ? 0.7235 0.6746 0.5321 0.0826 0.0512 0.0237 193 LEU A N 1536 C CA . LEU A 194 ? 0.7011 0.6830 0.5202 0.0720 0.0431 0.0244 193 LEU A CA 1537 C C . LEU A 194 ? 0.6804 0.6500 0.4936 0.0696 0.0335 0.0207 193 LEU A C 1538 O O . LEU A 194 ? 0.6803 0.6219 0.4780 0.0641 0.0298 0.0117 193 LEU A O 1539 C CB . LEU A 194 ? 0.7212 0.7075 0.5345 0.0566 0.0434 0.0168 193 LEU A CB 1540 C CG . LEU A 194 ? 0.7415 0.7367 0.5584 0.0566 0.0536 0.0188 193 LEU A CG 1541 C CD1 . LEU A 194 ? 0.7502 0.7398 0.5569 0.0405 0.0545 0.0099 193 LEU A CD1 1542 C CD2 . LEU A 194 ? 0.7446 0.7853 0.5855 0.0609 0.0566 0.0304 193 LEU A CD2 1543 N N . GLY A 195 ? 0.6724 0.6641 0.4984 0.0741 0.0297 0.0286 194 GLY A N 1544 C CA . GLY A 195 ? 0.6555 0.6396 0.4775 0.0710 0.0211 0.0257 194 GLY A CA 1545 C C . GLY A 195 ? 0.6423 0.5882 0.4519 0.0775 0.0205 0.0217 194 GLY A C 1546 O O . GLY A 195 ? 0.6249 0.5540 0.4251 0.0714 0.0144 0.0145 194 GLY A O 1547 N N . ALA A 196 ? 0.6421 0.5747 0.4518 0.0896 0.0274 0.0265 195 ALA A N 1548 C CA . ALA A 196 ? 0.6480 0.5443 0.4444 0.0939 0.0277 0.0221 195 ALA A CA 1549 C C . ALA A 196 ? 0.6452 0.5394 0.4452 0.0962 0.0223 0.0248 195 ALA A C 1550 O O . ALA A 196 ? 0.6543 0.5659 0.4669 0.1038 0.0248 0.0349 195 ALA A O 1551 C CB . ALA A 196 ? 0.6711 0.5527 0.4649 0.1048 0.0389 0.0256 195 ALA A CB 1552 N N . PRO A 197 ? 0.6533 0.5266 0.4427 0.0904 0.0157 0.0171 196 PRO A N 1553 C CA . PRO A 197 ? 0.6647 0.5333 0.4565 0.0915 0.0112 0.0188 196 PRO A CA 1554 C C . PRO A 197 ? 0.7075 0.5486 0.4921 0.0982 0.0163 0.0191 196 PRO A C 1555 O O . PRO A 197 ? 0.7432 0.5641 0.5189 0.0939 0.0119 0.0131 196 PRO A O 1556 C CB . PRO A 197 ? 0.6462 0.5069 0.4308 0.0817 0.0028 0.0102 196 PRO A CB 1557 C CG . PRO A 197 ? 0.6514 0.4939 0.4229 0.0791 0.0044 0.0036 196 PRO A CG 1558 C CD . PRO A 197 ? 0.6546 0.5091 0.4298 0.0826 0.0122 0.0074 196 PRO A CD 1559 N N . TRP A 198 ? 0.7297 0.5704 0.5182 0.1082 0.0264 0.0260 197 TRP A N 1560 C CA . TRP A 198 ? 0.7577 0.5702 0.5388 0.1145 0.0340 0.0264 197 TRP A CA 1561 C C . TRP A 198 ? 0.7860 0.5968 0.5713 0.1135 0.0295 0.0290 197 TRP A C 1562 O O . TRP A 198 ? 0.7881 0.6246 0.5868 0.1148 0.0258 0.0364 197 TRP A O 1563 C CB . TRP A 198 ? 0.7659 0.5816 0.5543 0.1279 0.0475 0.0362 197 TRP A CB 1564 C CG . TRP A 198 ? 0.7641 0.5912 0.5543 0.1304 0.0533 0.0370 197 TRP A CG 1565 C CD1 . TRP A 198 ? 0.7530 0.6115 0.5603 0.1382 0.0583 0.0479 197 TRP A CD1 1566 C CD2 . TRP A 198 ? 0.7578 0.5669 0.5324 0.1249 0.0549 0.0271 197 TRP A CD2 1567 N NE1 . TRP A 198 ? 0.7542 0.6151 0.5585 0.1374 0.0634 0.0450 197 TRP A NE1 1568 C CE2 . TRP A 198 ? 0.7576 0.5870 0.5411 0.1296 0.0618 0.0322 197 TRP A CE2 1569 C CE3 . TRP A 198 ? 0.7758 0.5559 0.5301 0.1164 0.0509 0.0154 197 TRP A CE3 1570 C CZ2 . TRP A 198 ? 0.7579 0.5767 0.5297 0.1260 0.0658 0.0255 197 TRP A CZ2 1571 C CZ3 . TRP A 198 ? 0.7921 0.5622 0.5338 0.1133 0.0541 0.0093 197 TRP A CZ3 1572 C CH2 . TRP A 198 ? 0.7804 0.5686 0.5305 0.1181 0.0620 0.0142 197 TRP A CH2 1573 N N . GLY A 199 ? 0.8092 0.5911 0.5826 0.1097 0.0294 0.0226 198 GLY A N 1574 C CA . GLY A 199 ? 0.7839 0.5627 0.5611 0.1075 0.0258 0.0245 198 GLY A CA 1575 C C . GLY A 199 ? 0.7413 0.5386 0.5245 0.0991 0.0135 0.0221 198 GLY A C 1576 O O . GLY A 199 ? 0.7322 0.5330 0.5213 0.0982 0.0112 0.0255 198 GLY A O 1577 N N . GLY A 200 ? 0.7254 0.5325 0.5064 0.0932 0.0069 0.0164 199 GLY A N 1578 C CA . GLY A 200 ? 0.7201 0.5392 0.5046 0.0854 -0.0027 0.0129 199 GLY A CA 1579 C C . GLY A 200 ? 0.7098 0.5583 0.5067 0.0861 -0.0042 0.0192 199 GLY A C 1580 O O . GLY A 200 ? 0.7276 0.5905 0.5319 0.0929 0.0008 0.0278 199 GLY A O 1581 N N . VAL A 201 ? 0.6986 0.5566 0.4972 0.0790 -0.0109 0.0153 200 VAL A N 1582 C CA . VAL A 201 ? 0.7003 0.5853 0.5072 0.0768 -0.0125 0.0192 200 VAL A CA 1583 C C . VAL A 201 ? 0.6571 0.5447 0.4672 0.0729 -0.0166 0.0186 200 VAL A C 1584 O O . VAL A 201 ? 0.6289 0.5024 0.4356 0.0691 -0.0199 0.0126 200 VAL A O 1585 C CB . VAL A 201 ? 0.7235 0.6193 0.5277 0.0705 -0.0139 0.0138 200 VAL A CB 1586 C CG1 . VAL A 201 ? 0.7691 0.6634 0.5707 0.0739 -0.0092 0.0146 200 VAL A CG1 1587 C CG2 . VAL A 201 ? 0.7274 0.6085 0.5247 0.0643 -0.0178 0.0050 200 VAL A CG2 1588 N N . ALA A 202 ? 0.6483 0.5560 0.4652 0.0738 -0.0161 0.0256 201 ALA A N 1589 C CA . ALA A 202 ? 0.6559 0.5663 0.4757 0.0707 -0.0184 0.0262 201 ALA A CA 1590 C C . ALA A 202 ? 0.6653 0.5765 0.4822 0.0625 -0.0219 0.0174 201 ALA A C 1591 O O . ALA A 202 ? 0.6638 0.5677 0.4820 0.0602 -0.0235 0.0148 201 ALA A O 1592 C CB . ALA A 202 ? 0.6553 0.5891 0.4809 0.0731 -0.0171 0.0360 201 ALA A CB 1593 N N . LYS A 203 ? 0.6939 0.6134 0.5071 0.0580 -0.0219 0.0129 202 LYS A N 1594 C CA . LYS A 203 ? 0.7277 0.6460 0.5373 0.0506 -0.0226 0.0050 202 LYS A CA 1595 C C . LYS A 203 ? 0.7357 0.6323 0.5431 0.0512 -0.0242 -0.0005 202 LYS A C 1596 O O . LYS A 203 ? 0.7363 0.6303 0.5430 0.0476 -0.0237 -0.0051 202 LYS A O 1597 C CB . LYS A 203 ? 0.7759 0.7051 0.5805 0.0440 -0.0208 0.0006 202 LYS A CB 1598 C CG . LYS A 203 ? 0.8462 0.7593 0.6448 0.0435 -0.0198 -0.0050 202 LYS A CG 1599 C CD . LYS A 203 ? 0.8993 0.8248 0.6939 0.0363 -0.0170 -0.0080 202 LYS A CD 1600 C CE . LYS A 203 ? 0.9313 0.8633 0.7210 0.0259 -0.0147 -0.0145 202 LYS A CE 1601 N NZ . LYS A 203 ? 0.9572 0.9133 0.7455 0.0171 -0.0134 -0.0147 202 LYS A NZ 1602 N N . THR A 204 ? 0.7197 0.6016 0.5256 0.0557 -0.0256 0.0002 203 THR A N 1603 C CA . THR A 204 ? 0.6866 0.5517 0.4906 0.0559 -0.0287 -0.0033 203 THR A CA 1604 C C . THR A 204 ? 0.6565 0.5230 0.4677 0.0549 -0.0306 -0.0025 203 THR A C 1605 O O . THR A 204 ? 0.6542 0.5155 0.4667 0.0541 -0.0326 -0.0052 203 THR A O 1606 C CB . THR A 204 ? 0.6932 0.5435 0.4925 0.0593 -0.0298 -0.0025 203 THR A CB 1607 O OG1 . THR A 204 ? 0.6825 0.5321 0.4759 0.0609 -0.0267 -0.0026 203 THR A OG1 1608 C CG2 . THR A 204 ? 0.6988 0.5359 0.4944 0.0580 -0.0343 -0.0060 203 THR A CG2 1609 N N . LEU A 205 ? 0.6528 0.5276 0.4695 0.0554 -0.0294 0.0020 204 LEU A N 1610 C CA . LEU A 205 ? 0.6490 0.5265 0.4730 0.0539 -0.0302 0.0030 204 LEU A CA 1611 C C . LEU A 205 ? 0.6492 0.5343 0.4748 0.0510 -0.0281 -0.0004 204 LEU A C 1612 O O . LEU A 205 ? 0.6486 0.5313 0.4795 0.0507 -0.0288 -0.0018 204 LEU A O 1613 C CB . LEU A 205 ? 0.6574 0.5406 0.4854 0.0551 -0.0281 0.0095 204 LEU A CB 1614 C CG . LEU A 205 ? 0.6779 0.5458 0.5042 0.0574 -0.0285 0.0115 204 LEU A CG 1615 C CD1 . LEU A 205 ? 0.6826 0.5512 0.5069 0.0625 -0.0242 0.0180 204 LEU A CD1 1616 C CD2 . LEU A 205 ? 0.6893 0.5514 0.5214 0.0543 -0.0298 0.0119 204 LEU A CD2 1617 N N . ARG A 206 ? 0.6462 0.5407 0.4669 0.0484 -0.0249 -0.0019 205 ARG A N 1618 C CA . ARG A 206 ? 0.6764 0.5745 0.4952 0.0443 -0.0208 -0.0067 205 ARG A CA 1619 C C . ARG A 206 ? 0.6523 0.5366 0.4684 0.0453 -0.0200 -0.0116 205 ARG A C 1620 O O . ARG A 206 ? 0.6464 0.5271 0.4652 0.0456 -0.0168 -0.0139 205 ARG A O 1621 C CB . ARG A 206 ? 0.7419 0.6537 0.5537 0.0389 -0.0178 -0.0080 205 ARG A CB 1622 C CG . ARG A 206 ? 0.8155 0.7279 0.6210 0.0322 -0.0119 -0.0151 205 ARG A CG 1623 C CD . ARG A 206 ? 0.9200 0.8472 0.7170 0.0244 -0.0104 -0.0171 205 ARG A CD 1624 N NE . ARG A 206 ? 0.9974 0.9266 0.7864 0.0158 -0.0038 -0.0241 205 ARG A NE 1625 C CZ . ARG A 206 ? 1.0615 0.9770 0.8426 0.0109 0.0025 -0.0326 205 ARG A CZ 1626 N NH1 . ARG A 206 ? 1.1243 1.0247 0.9048 0.0140 0.0026 -0.0345 205 ARG A NH1 1627 N NH2 . ARG A 206 ? 1.1006 1.0160 0.8729 0.0026 0.0100 -0.0394 205 ARG A NH2 1628 N N . VAL A 207 ? 0.6259 0.5026 0.4365 0.0466 -0.0221 -0.0124 206 VAL A N 1629 C CA . VAL A 207 ? 0.6329 0.4958 0.4397 0.0484 -0.0215 -0.0154 206 VAL A CA 1630 C C . VAL A 207 ? 0.6373 0.4953 0.4521 0.0529 -0.0248 -0.0129 206 VAL A C 1631 O O . VAL A 207 ? 0.6616 0.5150 0.4785 0.0549 -0.0215 -0.0139 206 VAL A O 1632 C CB . VAL A 207 ? 0.6309 0.4862 0.4306 0.0497 -0.0241 -0.0152 206 VAL A CB 1633 C CG1 . VAL A 207 ? 0.6404 0.4812 0.4360 0.0527 -0.0247 -0.0162 206 VAL A CG1 1634 C CG2 . VAL A 207 ? 0.6207 0.4829 0.4140 0.0450 -0.0202 -0.0175 206 VAL A CG2 1635 N N . LEU A 208 ? 0.6155 0.4752 0.4353 0.0543 -0.0307 -0.0093 207 LEU A N 1636 C CA . LEU A 208 ? 0.6211 0.4802 0.4492 0.0565 -0.0352 -0.0068 207 LEU A CA 1637 C C . LEU A 208 ? 0.6272 0.4957 0.4667 0.0566 -0.0321 -0.0054 207 LEU A C 1638 O O . LEU A 208 ? 0.6403 0.5100 0.4875 0.0598 -0.0325 -0.0036 207 LEU A O 1639 C CB . LEU A 208 ? 0.6284 0.4854 0.4566 0.0551 -0.0412 -0.0048 207 LEU A CB 1640 C CG . LEU A 208 ? 0.6356 0.4811 0.4522 0.0556 -0.0441 -0.0062 207 LEU A CG 1641 C CD1 . LEU A 208 ? 0.6520 0.4924 0.4658 0.0535 -0.0461 -0.0056 207 LEU A CD1 1642 C CD2 . LEU A 208 ? 0.6455 0.4862 0.4601 0.0573 -0.0487 -0.0058 207 LEU A CD2 1643 N N . ALA A 209 ? 0.6237 0.5000 0.4644 0.0538 -0.0284 -0.0054 208 ALA A N 1644 C CA . ALA A 209 ? 0.6301 0.5150 0.4802 0.0534 -0.0243 -0.0043 208 ALA A CA 1645 C C . ALA A 209 ? 0.6450 0.5273 0.4937 0.0547 -0.0164 -0.0077 208 ALA A C 1646 O O . ALA A 209 ? 0.6428 0.5265 0.5012 0.0585 -0.0140 -0.0061 208 ALA A O 1647 C CB . ALA A 209 ? 0.6363 0.5298 0.4857 0.0499 -0.0222 -0.0027 208 ALA A CB 1648 N N . SER A 210 ? 0.6495 0.5281 0.4864 0.0515 -0.0116 -0.0124 209 SER A N 1649 C CA . SER A 210 ? 0.6767 0.5508 0.5091 0.0501 -0.0015 -0.0173 209 SER A CA 1650 C C . SER A 210 ? 0.7074 0.5680 0.5280 0.0489 0.0026 -0.0222 209 SER A C 1651 O O . SER A 210 ? 0.7320 0.5844 0.5463 0.0467 0.0127 -0.0273 209 SER A O 1652 C CB . SER A 210 ? 0.6757 0.5601 0.5034 0.0434 0.0031 -0.0196 209 SER A CB 1653 O OG . SER A 210 ? 0.6889 0.5817 0.5099 0.0390 -0.0016 -0.0188 209 SER A OG 1654 N N . GLY A 211 ? 0.7133 0.5695 0.5299 0.0500 -0.0037 -0.0209 210 GLY A N 1655 C CA . GLY A 211 ? 0.7286 0.5717 0.5342 0.0485 0.0002 -0.0248 210 GLY A CA 1656 C C . GLY A 211 ? 0.7563 0.6046 0.5508 0.0391 0.0028 -0.0300 210 GLY A C 1657 O O . GLY A 211 ? 0.8209 0.6819 0.6150 0.0337 0.0040 -0.0314 210 GLY A O 1658 N N . ASP A 212 ? 0.7894 0.6298 0.5753 0.0368 0.0036 -0.0323 211 ASP A N 1659 C CA . ASP A 212 ? 0.8108 0.6592 0.5876 0.0269 0.0057 -0.0369 211 ASP A CA 1660 C C . ASP A 212 ? 0.8106 0.6424 0.5763 0.0226 0.0135 -0.0425 211 ASP A C 1661 O O . ASP A 212 ? 0.7597 0.5815 0.5234 0.0265 0.0116 -0.0403 211 ASP A O 1662 C CB . ASP A 212 ? 0.8504 0.7113 0.6301 0.0283 -0.0024 -0.0321 211 ASP A CB 1663 C CG . ASP A 212 ? 0.8990 0.7763 0.6733 0.0188 -0.0013 -0.0345 211 ASP A CG 1664 O OD1 . ASP A 212 ? 0.9395 0.8143 0.7047 0.0094 0.0054 -0.0415 211 ASP A OD1 1665 O OD2 . ASP A 212 ? 0.9556 0.8490 0.7350 0.0206 -0.0067 -0.0290 211 ASP A OD2 1666 N N . ASN A 213 ? 0.8461 0.6731 0.6032 0.0137 0.0232 -0.0500 212 ASN A N 1667 C CA . ASN A 213 ? 0.8758 0.6832 0.6207 0.0079 0.0332 -0.0563 212 ASN A CA 1668 C C . ASN A 213 ? 0.9083 0.7262 0.6437 -0.0065 0.0348 -0.0624 212 ASN A C 1669 O O . ASN A 213 ? 0.9260 0.7278 0.6499 -0.0144 0.0442 -0.0689 212 ASN A O 1670 C CB . ASN A 213 ? 0.8966 0.6848 0.6361 0.0073 0.0461 -0.0615 212 ASN A CB 1671 C CG . ASN A 213 ? 0.9112 0.7094 0.6439 -0.0047 0.0515 -0.0692 212 ASN A CG 1672 O OD1 . ASN A 213 ? 0.9037 0.7253 0.6354 -0.0134 0.0450 -0.0701 212 ASN A OD1 1673 N ND2 . ASN A 213 ? 0.9461 0.7271 0.6737 -0.0050 0.0642 -0.0742 212 ASN A ND2 1674 N N . ASN A 214 ? 0.9330 0.7780 0.6731 -0.0104 0.0264 -0.0598 213 ASN A N 1675 C CA . ASN A 214 ? 0.9959 0.8583 0.7290 -0.0252 0.0273 -0.0646 213 ASN A CA 1676 C C . ASN A 214 ? 1.0075 0.8595 0.7349 -0.0291 0.0306 -0.0667 213 ASN A C 1677 O O . ASN A 214 ? 0.9903 0.8479 0.7088 -0.0442 0.0357 -0.0736 213 ASN A O 1678 C CB . ASN A 214 ? 0.9997 0.8955 0.7418 -0.0250 0.0170 -0.0578 213 ASN A CB 1679 C CG . ASN A 214 ? 1.0260 0.9310 0.7757 -0.0185 0.0104 -0.0506 213 ASN A CG 1680 O OD1 . ASN A 214 ? 1.0571 0.9781 0.8053 -0.0270 0.0103 -0.0514 213 ASN A OD1 1681 N ND2 . ASN A 214 ? 1.0085 0.9040 0.7662 -0.0042 0.0055 -0.0437 213 ASN A ND2 1682 N N . ARG A 215 ? 1.0568 0.8941 0.7885 -0.0165 0.0279 -0.0609 214 ARG A N 1683 C CA . ARG A 215 ? 1.1274 0.9530 0.8531 -0.0189 0.0315 -0.0618 214 ARG A CA 1684 C C . ARG A 215 ? 1.1557 0.9496 0.8697 -0.0214 0.0437 -0.0675 214 ARG A C 1685 O O . ARG A 215 ? 1.1435 0.9264 0.8490 -0.0283 0.0501 -0.0707 214 ARG A O 1686 C CB . ARG A 215 ? 1.2007 1.0247 0.9333 -0.0056 0.0238 -0.0532 214 ARG A CB 1687 C CG . ARG A 215 ? 1.2505 1.1014 0.9926 -0.0036 0.0152 -0.0476 214 ARG A CG 1688 C CD . ARG A 215 ? 1.3019 1.1712 1.0423 -0.0153 0.0176 -0.0501 214 ARG A CD 1689 N NE . ARG A 215 ? 1.3280 1.2285 1.0794 -0.0136 0.0106 -0.0439 214 ARG A NE 1690 C CZ . ARG A 215 ? 1.2810 1.2094 1.0351 -0.0241 0.0106 -0.0443 214 ARG A CZ 1691 N NH1 . ARG A 215 ? 1.2688 1.1980 1.0143 -0.0397 0.0171 -0.0522 214 ARG A NH1 1692 N NH2 . ARG A 215 ? 1.2042 1.1604 0.9696 -0.0193 0.0045 -0.0361 214 ARG A NH2 1693 N N . ILE A 216 ? 1.1753 0.9537 0.8898 -0.0145 0.0477 -0.0674 215 ILE A N 1694 C CA . ILE A 216 ? 1.1623 0.9083 0.8671 -0.0133 0.0608 -0.0707 215 ILE A CA 1695 C C . ILE A 216 ? 1.0941 0.8319 0.7973 -0.0141 0.0691 -0.0754 215 ILE A C 1696 O O . ILE A 216 ? 1.0709 0.8002 0.7819 -0.0005 0.0692 -0.0697 215 ILE A O 1697 C CB . ILE A 216 ? 1.1938 0.9239 0.9018 0.0019 0.0577 -0.0613 215 ILE A CB 1698 C CG1 . ILE A 216 ? 1.2366 0.9328 0.9338 0.0040 0.0720 -0.0623 215 ILE A CG1 1699 C CG2 . ILE A 216 ? 1.1984 0.9377 0.9201 0.0169 0.0469 -0.0524 215 ILE A CG2 1700 C CD1 . ILE A 216 ? 1.2495 0.9336 0.9331 -0.0085 0.0807 -0.0681 215 ILE A CD1 1701 N N . PRO A 217 ? 1.0827 0.8258 0.7755 -0.0314 0.0760 -0.0860 216 PRO A N 1702 C CA . PRO A 217 ? 1.0595 0.7996 0.7483 -0.0356 0.0836 -0.0922 216 PRO A CA 1703 C C . PRO A 217 ? 1.0802 0.7842 0.7620 -0.0299 0.1003 -0.0949 216 PRO A C 1704 O O . PRO A 217 ? 1.0806 0.7802 0.7617 -0.0289 0.1071 -0.0981 216 PRO A O 1705 C CB . PRO A 217 ? 1.0657 0.8198 0.7412 -0.0585 0.0868 -0.1036 216 PRO A CB 1706 C CG . PRO A 217 ? 1.0620 0.8374 0.7414 -0.0635 0.0767 -0.1004 216 PRO A CG 1707 C CD . PRO A 217 ? 1.0793 0.8353 0.7637 -0.0491 0.0761 -0.0927 216 PRO A CD 1708 N N . VAL A 218 ? 1.1531 0.8308 0.8297 -0.0253 0.1079 -0.0929 217 VAL A N 1709 C CA . VAL A 218 ? 1.1893 0.8321 0.8616 -0.0156 0.1241 -0.0920 217 VAL A CA 1710 C C . VAL A 218 ? 1.1340 0.7804 0.8248 0.0071 0.1173 -0.0786 217 VAL A C 1711 O O . VAL A 218 ? 1.1315 0.7554 0.8232 0.0177 0.1300 -0.0758 217 VAL A O 1712 C CB . VAL A 218 ? 1.2469 0.8605 0.9084 -0.0159 0.1341 -0.0913 217 VAL A CB 1713 C CG1 . VAL A 218 ? 1.2945 0.8679 0.9476 -0.0090 0.1555 -0.0923 217 VAL A CG1 1714 C CG2 . VAL A 218 ? 1.2897 0.9073 0.9369 -0.0386 0.1364 -0.1024 217 VAL A CG2 1715 N N . ILE A 219 ? 1.0602 0.7352 0.7656 0.0139 0.0983 -0.0704 218 ILE A N 1716 C CA . ILE A 219 ? 1.0085 0.6926 0.7313 0.0312 0.0905 -0.0593 218 ILE A CA 1717 C C . ILE A 219 ? 0.9649 0.6731 0.6960 0.0281 0.0844 -0.0616 218 ILE A C 1718 O O . ILE A 219 ? 0.9837 0.7147 0.7153 0.0192 0.0742 -0.0641 218 ILE A O 1719 C CB . ILE A 219 ? 1.0134 0.7090 0.7449 0.0406 0.0749 -0.0489 218 ILE A CB 1720 C CG1 . ILE A 219 ? 1.0382 0.7136 0.7576 0.0389 0.0800 -0.0485 218 ILE A CG1 1721 C CG2 . ILE A 219 ? 1.0065 0.7061 0.7539 0.0581 0.0696 -0.0372 218 ILE A CG2 1722 C CD1 . ILE A 219 ? 1.0168 0.7013 0.7405 0.0462 0.0661 -0.0396 218 ILE A CD1 1723 N N . GLY A 220 ? 0.9411 0.6440 0.6802 0.0375 0.0913 -0.0587 219 GLY A N 1724 C CA . GLY A 220 ? 0.9317 0.6558 0.6809 0.0376 0.0865 -0.0585 219 GLY A CA 1725 C C . GLY A 220 ? 0.9065 0.6571 0.6710 0.0435 0.0672 -0.0495 219 GLY A C 1726 O O . GLY A 220 ? 0.8521 0.6020 0.6231 0.0524 0.0597 -0.0417 219 GLY A O 1727 N N . PRO A 221 ? 0.8887 0.6609 0.6561 0.0369 0.0601 -0.0514 220 PRO A N 1728 C CA . PRO A 221 ? 0.8492 0.6431 0.6280 0.0403 0.0437 -0.0443 220 PRO A CA 1729 C C . PRO A 221 ? 0.8307 0.6286 0.6265 0.0540 0.0373 -0.0342 220 PRO A C 1730 O O . PRO A 221 ? 0.7948 0.5991 0.5957 0.0580 0.0256 -0.0284 220 PRO A O 1731 C CB . PRO A 221 ? 0.8529 0.6658 0.6315 0.0321 0.0417 -0.0474 220 PRO A CB 1732 C CG . PRO A 221 ? 0.8719 0.6740 0.6433 0.0280 0.0567 -0.0545 220 PRO A CG 1733 C CD . PRO A 221 ? 0.8914 0.6680 0.6506 0.0261 0.0682 -0.0599 220 PRO A CD 1734 N N . LEU A 222 ? 0.8608 0.6557 0.6650 0.0605 0.0452 -0.0323 221 LEU A N 1735 C CA . LEU A 222 ? 0.8665 0.6711 0.6897 0.0728 0.0382 -0.0218 221 LEU A CA 1736 C C . LEU A 222 ? 0.8622 0.6557 0.6871 0.0825 0.0368 -0.0150 221 LEU A C 1737 O O . LEU A 222 ? 0.8537 0.6586 0.6906 0.0896 0.0260 -0.0063 221 LEU A O 1738 C CB . LEU A 222 ? 0.8773 0.6851 0.7119 0.0783 0.0477 -0.0201 221 LEU A CB 1739 C CG . LEU A 222 ? 0.8996 0.7215 0.7356 0.0708 0.0484 -0.0241 221 LEU A CG 1740 C CD1 . LEU A 222 ? 0.9143 0.7388 0.7636 0.0783 0.0584 -0.0209 221 LEU A CD1 1741 C CD2 . LEU A 222 ? 0.8984 0.7402 0.7411 0.0674 0.0327 -0.0202 221 LEU A CD2 1742 N N . LYS A 223 ? 0.8784 0.6497 0.6900 0.0819 0.0478 -0.0188 222 LYS A N 1743 C CA . LYS A 223 ? 0.8840 0.6423 0.6945 0.0912 0.0479 -0.0117 222 LYS A CA 1744 C C . LYS A 223 ? 0.8579 0.6206 0.6615 0.0870 0.0345 -0.0108 222 LYS A C 1745 O O . LYS A 223 ? 0.8552 0.6241 0.6649 0.0942 0.0247 -0.0023 222 LYS A O 1746 C CB . LYS A 223 ? 0.9166 0.6457 0.7137 0.0916 0.0663 -0.0160 222 LYS A CB 1747 C CG . LYS A 223 ? 0.9638 0.6831 0.7701 0.1034 0.0807 -0.0114 222 LYS A CG 1748 C CD . LYS A 223 ? 0.9842 0.7090 0.8056 0.1205 0.0753 0.0040 222 LYS A CD 1749 C CE . LYS A 223 ? 0.9866 0.7256 0.8294 0.1321 0.0787 0.0120 222 LYS A CE 1750 N NZ . LYS A 223 ? 1.0366 0.7510 0.8770 0.1398 0.1016 0.0113 222 LYS A NZ 1751 N N . ILE A 224 ? 0.8101 0.5715 0.6009 0.0748 0.0343 -0.0196 223 ILE A N 1752 C CA . ILE A 224 ? 0.7889 0.5539 0.5730 0.0709 0.0239 -0.0193 223 ILE A CA 1753 C C . ILE A 224 ? 0.7832 0.5688 0.5775 0.0719 0.0091 -0.0151 223 ILE A C 1754 O O . ILE A 224 ? 0.7647 0.5515 0.5557 0.0726 0.0004 -0.0122 223 ILE A O 1755 C CB . ILE A 224 ? 0.7956 0.5578 0.5659 0.0576 0.0283 -0.0289 223 ILE A CB 1756 C CG1 . ILE A 224 ? 0.8106 0.5699 0.5728 0.0559 0.0222 -0.0276 223 ILE A CG1 1757 C CG2 . ILE A 224 ? 0.7850 0.5669 0.5589 0.0496 0.0242 -0.0332 223 ILE A CG2 1758 C CD1 . ILE A 224 ? 0.7993 0.5651 0.5529 0.0435 0.0230 -0.0349 223 ILE A CD1 1759 N N . ARG A 225 ? 0.7617 0.5615 0.5670 0.0714 0.0073 -0.0149 224 ARG A N 1760 C CA . ARG A 225 ? 0.7172 0.5340 0.5324 0.0719 -0.0049 -0.0109 224 ARG A CA 1761 C C . ARG A 225 ? 0.7155 0.5335 0.5364 0.0796 -0.0133 -0.0028 224 ARG A C 1762 O O . ARG A 225 ? 0.6754 0.5000 0.4961 0.0778 -0.0238 -0.0011 224 ARG A O 1763 C CB . ARG A 225 ? 0.7003 0.5300 0.5274 0.0713 -0.0032 -0.0108 224 ARG A CB 1764 C CG . ARG A 225 ? 0.6780 0.5230 0.5139 0.0695 -0.0138 -0.0077 224 ARG A CG 1765 C CD . ARG A 225 ? 0.6765 0.5332 0.5236 0.0687 -0.0107 -0.0072 224 ARG A CD 1766 N NE . ARG A 225 ? 0.6901 0.5494 0.5501 0.0762 -0.0071 -0.0023 224 ARG A NE 1767 C CZ . ARG A 225 ? 0.6821 0.5513 0.5538 0.0772 -0.0024 -0.0010 224 ARG A CZ 1768 N NH1 . ARG A 225 ? 0.6875 0.5636 0.5579 0.0705 -0.0011 -0.0042 224 ARG A NH1 1769 N NH2 . ARG A 225 ? 0.6820 0.5551 0.5673 0.0854 0.0013 0.0044 224 ARG A NH2 1770 N N . GLU A 226 ? 0.7448 0.5567 0.5701 0.0881 -0.0082 0.0023 225 GLU A N 1771 C CA . GLU A 226 ? 0.7725 0.5893 0.6036 0.0958 -0.0165 0.0116 225 GLU A CA 1772 C C . GLU A 226 ? 0.7416 0.5502 0.5581 0.0936 -0.0231 0.0117 225 GLU A C 1773 O O . GLU A 226 ? 0.7097 0.5275 0.5273 0.0931 -0.0346 0.0154 225 GLU A O 1774 C CB . GLU A 226 ? 0.8482 0.6592 0.6864 0.1074 -0.0079 0.0192 225 GLU A CB 1775 C CG . GLU A 226 ? 0.9211 0.7450 0.7779 0.1121 -0.0032 0.0222 225 GLU A CG 1776 C CD . GLU A 226 ? 1.0406 0.8561 0.9045 0.1253 0.0087 0.0298 225 GLU A CD 1777 O OE1 . GLU A 226 ? 1.1201 0.9406 0.9896 0.1349 0.0036 0.0411 225 GLU A OE1 1778 O OE2 . GLU A 226 ? 1.0662 0.8701 0.9298 0.1262 0.0239 0.0251 225 GLU A OE2 1779 N N . GLN A 227 ? 0.7256 0.5170 0.5276 0.0909 -0.0153 0.0069 226 GLN A N 1780 C CA . GLN A 227 ? 0.7438 0.5269 0.5313 0.0883 -0.0199 0.0064 226 GLN A CA 1781 C C . GLN A 227 ? 0.7352 0.5269 0.5199 0.0803 -0.0276 0.0013 226 GLN A C 1782 O O . GLN A 227 ? 0.7415 0.5339 0.5202 0.0794 -0.0358 0.0029 226 GLN A O 1783 C CB . GLN A 227 ? 0.7494 0.5132 0.5234 0.0857 -0.0080 0.0017 226 GLN A CB 1784 C CG . GLN A 227 ? 0.7455 0.4993 0.5043 0.0835 -0.0102 0.0016 226 GLN A CG 1785 C CD . GLN A 227 ? 0.7433 0.5024 0.4965 0.0742 -0.0129 -0.0055 226 GLN A CD 1786 O OE1 . GLN A 227 ? 0.7330 0.4978 0.4892 0.0679 -0.0086 -0.0118 226 GLN A OE1 1787 N NE2 . GLN A 227 ? 0.7202 0.4784 0.4652 0.0737 -0.0197 -0.0041 226 GLN A NE2 1788 N N . GLN A 228 ? 0.7210 0.5182 0.5090 0.0746 -0.0239 -0.0045 227 GLN A N 1789 C CA . GLN A 228 ? 0.6928 0.4967 0.4783 0.0685 -0.0285 -0.0082 227 GLN A CA 1790 C C . GLN A 228 ? 0.6801 0.4935 0.4725 0.0689 -0.0385 -0.0051 227 GLN A C 1791 O O . GLN A 228 ? 0.6768 0.4885 0.4627 0.0662 -0.0432 -0.0061 227 GLN A O 1792 C CB . GLN A 228 ? 0.6879 0.4986 0.4762 0.0630 -0.0226 -0.0133 227 GLN A CB 1793 C CG . GLN A 228 ? 0.7085 0.5106 0.4870 0.0588 -0.0133 -0.0182 227 GLN A CG 1794 C CD . GLN A 228 ? 0.7241 0.5350 0.5044 0.0522 -0.0074 -0.0232 227 GLN A CD 1795 O OE1 . GLN A 228 ? 0.7480 0.5657 0.5364 0.0529 -0.0063 -0.0229 227 GLN A OE1 1796 N NE2 . GLN A 228 ? 0.7339 0.5458 0.5060 0.0450 -0.0033 -0.0277 227 GLN A NE2 1797 N N . ARG A 229 ? 0.6545 0.4774 0.4599 0.0718 -0.0409 -0.0013 228 ARG A N 1798 C CA . ARG A 229 ? 0.6538 0.4868 0.4662 0.0702 -0.0503 0.0014 228 ARG A CA 1799 C C . ARG A 229 ? 0.6848 0.5143 0.4890 0.0712 -0.0583 0.0047 228 ARG A C 1800 O O . ARG A 229 ? 0.7005 0.5318 0.5009 0.0661 -0.0655 0.0035 228 ARG A O 1801 C CB . ARG A 229 ? 0.6391 0.4857 0.4690 0.0730 -0.0504 0.0054 228 ARG A CB 1802 C CG . ARG A 229 ? 0.6292 0.4816 0.4665 0.0701 -0.0446 0.0023 228 ARG A CG 1803 C CD . ARG A 229 ? 0.6104 0.4759 0.4649 0.0732 -0.0433 0.0064 228 ARG A CD 1804 N NE . ARG A 229 ? 0.6049 0.4762 0.4649 0.0696 -0.0380 0.0036 228 ARG A NE 1805 C CZ . ARG A 229 ? 0.6224 0.5054 0.4970 0.0709 -0.0353 0.0063 228 ARG A CZ 1806 N NH1 . ARG A 229 ? 0.6295 0.5217 0.5170 0.0763 -0.0375 0.0123 228 ARG A NH1 1807 N NH2 . ARG A 229 ? 0.6327 0.5199 0.5094 0.0670 -0.0303 0.0038 228 ARG A NH2 1808 N N . SER A 230 ? 0.6808 0.5048 0.4814 0.0774 -0.0564 0.0090 229 SER A N 1809 C CA . SER A 230 ? 0.6923 0.5160 0.4852 0.0790 -0.0646 0.0141 229 SER A CA 1810 C C . SER A 230 ? 0.7099 0.5206 0.4834 0.0743 -0.0661 0.0096 229 SER A C 1811 O O . SER A 230 ? 0.7345 0.5454 0.4985 0.0721 -0.0741 0.0116 229 SER A O 1812 C CB . SER A 230 ? 0.6875 0.5084 0.4821 0.0886 -0.0610 0.0220 229 SER A CB 1813 O OG . SER A 230 ? 0.7030 0.5054 0.4856 0.0902 -0.0509 0.0191 229 SER A OG 1814 N N . ALA A 231 ? 0.7112 0.5117 0.4785 0.0722 -0.0580 0.0037 230 ALA A N 1815 C CA . ALA A 231 ? 0.7104 0.4995 0.4618 0.0686 -0.0568 -0.0004 230 ALA A CA 1816 C C . ALA A 231 ? 0.7068 0.4980 0.4569 0.0628 -0.0608 -0.0045 230 ALA A C 1817 O O . ALA A 231 ? 0.6913 0.4874 0.4499 0.0609 -0.0576 -0.0071 230 ALA A O 1818 C CB . ALA A 231 ? 0.7096 0.4914 0.4576 0.0682 -0.0465 -0.0043 230 ALA A CB 1819 N N . VAL A 232 ? 0.7199 0.5056 0.4573 0.0596 -0.0666 -0.0050 231 VAL A N 1820 C CA . VAL A 232 ? 0.7180 0.5001 0.4506 0.0535 -0.0685 -0.0096 231 VAL A CA 1821 C C . VAL A 232 ? 0.7087 0.4839 0.4398 0.0539 -0.0593 -0.0136 231 VAL A C 1822 O O . VAL A 232 ? 0.7353 0.5111 0.4713 0.0516 -0.0576 -0.0156 231 VAL A O 1823 C CB . VAL A 232 ? 0.7372 0.5109 0.4514 0.0488 -0.0743 -0.0110 231 VAL A CB 1824 C CG1 . VAL A 232 ? 0.7413 0.5076 0.4494 0.0415 -0.0743 -0.0168 231 VAL A CG1 1825 C CG2 . VAL A 232 ? 0.7447 0.5307 0.4617 0.0486 -0.0847 -0.0052 231 VAL A CG2 1826 N N . SER A 233 ? 0.6928 0.4629 0.4183 0.0570 -0.0529 -0.0138 232 SER A N 1827 C CA . SER A 233 ? 0.6837 0.4518 0.4091 0.0576 -0.0447 -0.0162 232 SER A CA 1828 C C . SER A 233 ? 0.6576 0.4384 0.3990 0.0582 -0.0421 -0.0154 232 SER A C 1829 O O . SER A 233 ? 0.6571 0.4395 0.4007 0.0588 -0.0374 -0.0158 232 SER A O 1830 C CB . SER A 233 ? 0.6853 0.4492 0.4039 0.0593 -0.0386 -0.0163 232 SER A CB 1831 O OG . SER A 233 ? 0.6782 0.4458 0.4019 0.0606 -0.0387 -0.0141 232 SER A OG 1832 N N . THR A 234 ? 0.6408 0.4310 0.3932 0.0586 -0.0445 -0.0137 233 THR A N 1833 C CA . THR A 234 ? 0.6379 0.4402 0.4036 0.0583 -0.0422 -0.0130 233 THR A CA 1834 C C . THR A 234 ? 0.6487 0.4519 0.4187 0.0568 -0.0444 -0.0124 233 THR A C 1835 O O . THR A 234 ? 0.6561 0.4634 0.4300 0.0576 -0.0401 -0.0114 233 THR A O 1836 C CB . THR A 234 ? 0.6377 0.4479 0.4132 0.0591 -0.0430 -0.0116 233 THR A CB 1837 O OG1 . THR A 234 ? 0.6285 0.4335 0.3986 0.0605 -0.0393 -0.0121 233 THR A OG1 1838 C CG2 . THR A 234 ? 0.6318 0.4540 0.4177 0.0579 -0.0394 -0.0115 233 THR A CG2 1839 N N . SER A 235 ? 0.6652 0.4651 0.4343 0.0544 -0.0507 -0.0124 234 SER A N 1840 C CA . SER A 235 ? 0.6859 0.4835 0.4574 0.0509 -0.0520 -0.0128 234 SER A CA 1841 C C . SER A 235 ? 0.7023 0.4853 0.4622 0.0507 -0.0470 -0.0149 234 SER A C 1842 O O . SER A 235 ? 0.7212 0.5007 0.4838 0.0503 -0.0431 -0.0142 234 SER A O 1843 C CB . SER A 235 ? 0.6953 0.4947 0.4678 0.0460 -0.0603 -0.0129 234 SER A CB 1844 O OG . SER A 235 ? 0.6905 0.5050 0.4776 0.0476 -0.0629 -0.0096 234 SER A OG 1845 N N . TRP A 236 ? 0.7150 0.4881 0.4614 0.0515 -0.0460 -0.0171 235 TRP A N 1846 C CA . TRP A 236 ? 0.7198 0.4783 0.4545 0.0526 -0.0392 -0.0192 235 TRP A CA 1847 C C . TRP A 236 ? 0.7162 0.4807 0.4594 0.0584 -0.0308 -0.0156 235 TRP A C 1848 O O . TRP A 236 ? 0.7175 0.4715 0.4567 0.0608 -0.0239 -0.0152 235 TRP A O 1849 C CB . TRP A 236 ? 0.7271 0.4776 0.4475 0.0532 -0.0389 -0.0213 235 TRP A CB 1850 C CG . TRP A 236 ? 0.7331 0.4674 0.4397 0.0544 -0.0311 -0.0239 235 TRP A CG 1851 C CD1 . TRP A 236 ? 0.7375 0.4561 0.4360 0.0521 -0.0269 -0.0268 235 TRP A CD1 1852 C CD2 . TRP A 236 ? 0.7177 0.4484 0.4166 0.0580 -0.0250 -0.0240 235 TRP A CD2 1853 N NE1 . TRP A 236 ? 0.7451 0.4500 0.4313 0.0553 -0.0178 -0.0285 235 TRP A NE1 1854 C CE2 . TRP A 236 ? 0.7286 0.4422 0.4155 0.0589 -0.0169 -0.0266 235 TRP A CE2 1855 C CE3 . TRP A 236 ? 0.7039 0.4429 0.4044 0.0600 -0.0243 -0.0224 235 TRP A CE3 1856 C CZ2 . TRP A 236 ? 0.7232 0.4302 0.4013 0.0625 -0.0085 -0.0271 235 TRP A CZ2 1857 C CZ3 . TRP A 236 ? 0.7103 0.4432 0.4019 0.0624 -0.0166 -0.0230 235 TRP A CZ3 1858 C CH2 . TRP A 236 ? 0.7162 0.4344 0.3974 0.0640 -0.0090 -0.0251 235 TRP A CH2 1859 N N . LEU A 237 ? 0.7132 0.4946 0.4673 0.0608 -0.0308 -0.0127 236 LEU A N 1860 C CA . LEU A 237 ? 0.7138 0.5066 0.4759 0.0653 -0.0243 -0.0085 236 LEU A CA 1861 C C . LEU A 237 ? 0.6759 0.4802 0.4506 0.0662 -0.0241 -0.0040 236 LEU A C 1862 O O . LEU A 237 ? 0.6811 0.5001 0.4633 0.0696 -0.0203 0.0007 236 LEU A O 1863 C CB . LEU A 237 ? 0.7327 0.5381 0.4967 0.0653 -0.0233 -0.0086 236 LEU A CB 1864 C CG . LEU A 237 ? 0.7858 0.5821 0.5384 0.0656 -0.0203 -0.0112 236 LEU A CG 1865 C CD1 . LEU A 237 ? 0.7996 0.6107 0.5563 0.0645 -0.0172 -0.0106 236 LEU A CD1 1866 C CD2 . LEU A 237 ? 0.8047 0.5894 0.5505 0.0696 -0.0140 -0.0104 236 LEU A CD2 1867 N N . LEU A 238 ? 0.6446 0.4440 0.4216 0.0627 -0.0281 -0.0049 237 LEU A N 1868 C CA . LEU A 238 ? 0.6385 0.4450 0.4254 0.0635 -0.0265 -0.0003 237 LEU A CA 1869 C C . LEU A 238 ? 0.6459 0.4445 0.4312 0.0691 -0.0183 0.0043 237 LEU A C 1870 O O . LEU A 238 ? 0.6766 0.4575 0.4516 0.0701 -0.0145 0.0017 237 LEU A O 1871 C CB . LEU A 238 ? 0.6397 0.4403 0.4286 0.0577 -0.0312 -0.0024 237 LEU A CB 1872 C CG . LEU A 238 ? 0.6358 0.4490 0.4321 0.0545 -0.0377 -0.0037 237 LEU A CG 1873 C CD1 . LEU A 238 ? 0.6524 0.4606 0.4498 0.0484 -0.0433 -0.0060 237 LEU A CD1 1874 C CD2 . LEU A 238 ? 0.6111 0.4411 0.4185 0.0560 -0.0356 0.0002 237 LEU A CD2 1875 N N . PRO A 239 ? 0.6321 0.4427 0.4268 0.0731 -0.0147 0.0116 238 PRO A N 1876 C CA . PRO A 239 ? 0.6467 0.4508 0.4418 0.0807 -0.0058 0.0186 238 PRO A CA 1877 C C . PRO A 239 ? 0.6705 0.4456 0.4560 0.0796 -0.0005 0.0157 238 PRO A C 1878 O O . PRO A 239 ? 0.6625 0.4274 0.4457 0.0719 -0.0042 0.0111 238 PRO A O 1879 C CB . PRO A 239 ? 0.6310 0.4516 0.4369 0.0827 -0.0052 0.0268 238 PRO A CB 1880 C CG . PRO A 239 ? 0.6069 0.4495 0.4176 0.0783 -0.0121 0.0245 238 PRO A CG 1881 C CD . PRO A 239 ? 0.6157 0.4483 0.4202 0.0717 -0.0179 0.0147 238 PRO A CD 1882 N N . TYR A 240 ? 0.6874 0.4501 0.4678 0.0869 0.0089 0.0185 239 TYR A N 1883 C CA . TYR A 240 ? 0.7221 0.4533 0.4906 0.0862 0.0172 0.0152 239 TYR A CA 1884 C C . TYR A 240 ? 0.7668 0.4908 0.5406 0.0955 0.0290 0.0255 239 TYR A C 1885 O O . TYR A 240 ? 0.7587 0.5028 0.5437 0.1056 0.0322 0.0363 239 TYR A O 1886 C CB . TYR A 240 ? 0.7218 0.4391 0.4779 0.0884 0.0222 0.0102 239 TYR A CB 1887 C CG . TYR A 240 ? 0.7104 0.4259 0.4564 0.0789 0.0125 0.0000 239 TYR A CG 1888 C CD1 . TYR A 240 ? 0.6886 0.4262 0.4401 0.0788 0.0049 -0.0001 239 TYR A CD1 1889 C CD2 . TYR A 240 ? 0.7164 0.4079 0.4463 0.0695 0.0112 -0.0093 239 TYR A CD2 1890 C CE1 . TYR A 240 ? 0.6828 0.4177 0.4249 0.0717 -0.0028 -0.0077 239 TYR A CE1 1891 C CE2 . TYR A 240 ? 0.7129 0.4054 0.4334 0.0617 0.0018 -0.0167 239 TYR A CE2 1892 C CZ . TYR A 240 ? 0.6952 0.4088 0.4223 0.0638 -0.0049 -0.0151 239 TYR A CZ 1893 O OH . TYR A 240 ? 0.6942 0.4077 0.4121 0.0576 -0.0132 -0.0207 239 TYR A OH 1894 N N . ASN A 241 ? 0.8319 0.5265 0.5965 0.0918 0.0362 0.0225 240 ASN A N 1895 C CA . ASN A 241 ? 0.8932 0.5746 0.6610 0.1007 0.0495 0.0326 240 ASN A CA 1896 C C . ASN A 241 ? 0.9023 0.5727 0.6681 0.1150 0.0642 0.0397 240 ASN A C 1897 O O . ASN A 241 ? 0.9182 0.5802 0.6885 0.1256 0.0764 0.0509 240 ASN A O 1898 C CB . ASN A 241 ? 0.9713 0.6210 0.7283 0.0903 0.0541 0.0260 240 ASN A CB 1899 C CG . ASN A 241 ? 1.0609 0.6801 0.7978 0.0820 0.0580 0.0129 240 ASN A CG 1900 O OD1 . ASN A 241 ? 1.1353 0.7507 0.8657 0.0878 0.0620 0.0111 240 ASN A OD1 1901 N ND2 . ASN A 241 ? 1.1762 0.7754 0.9027 0.0670 0.0562 0.0034 240 ASN A ND2 1902 N N . TYR A 242 ? 0.9039 0.5737 0.6632 0.1163 0.0644 0.0342 241 TYR A N 1903 C CA . TYR A 242 ? 0.9199 0.5836 0.6799 0.1311 0.0791 0.0419 241 TYR A CA 1904 C C . TYR A 242 ? 0.8935 0.5973 0.6730 0.1430 0.0765 0.0555 241 TYR A C 1905 O O . TYR A 242 ? 0.9088 0.6159 0.6944 0.1573 0.0883 0.0657 241 TYR A O 1906 C CB . TYR A 242 ? 0.9324 0.5748 0.6753 0.1275 0.0834 0.0303 241 TYR A CB 1907 C CG . TYR A 242 ? 0.9089 0.5704 0.6496 0.1191 0.0693 0.0219 241 TYR A CG 1908 C CD1 . TYR A 242 ? 0.8933 0.5850 0.6459 0.1264 0.0668 0.0282 241 TYR A CD1 1909 C CD2 . TYR A 242 ? 0.9064 0.5556 0.6326 0.1037 0.0593 0.0083 241 TYR A CD2 1910 C CE1 . TYR A 242 ? 0.8722 0.5774 0.6214 0.1187 0.0560 0.0207 241 TYR A CE1 1911 C CE2 . TYR A 242 ? 0.8822 0.5469 0.6059 0.0976 0.0478 0.0023 241 TYR A CE2 1912 C CZ . TYR A 242 ? 0.8685 0.5592 0.6032 0.1053 0.0469 0.0083 241 TYR A CZ 1913 O OH . TYR A 242 ? 0.8616 0.5648 0.5931 0.0993 0.0374 0.0027 241 TYR A OH 1914 N N . THR A 243 ? 0.8709 0.6060 0.6599 0.1365 0.0616 0.0557 242 THR A N 1915 C CA . THR A 243 ? 0.8233 0.5990 0.6292 0.1438 0.0573 0.0674 242 THR A CA 1916 C C . THR A 243 ? 0.8064 0.5992 0.6223 0.1443 0.0531 0.0767 242 THR A C 1917 O O . THR A 243 ? 0.8291 0.6460 0.6575 0.1552 0.0563 0.0918 242 THR A O 1918 C CB . THR A 243 ? 0.8118 0.6100 0.6180 0.1345 0.0447 0.0589 242 THR A CB 1919 O OG1 . THR A 243 ? 0.8350 0.6190 0.6319 0.1348 0.0494 0.0518 242 THR A OG1 1920 C CG2 . THR A 243 ? 0.7979 0.6388 0.6197 0.1383 0.0397 0.0691 242 THR A CG2 1921 N N . TRP A 244 ? 0.7832 0.5658 0.5938 0.1326 0.0458 0.0686 243 TRP A N 1922 C CA . TRP A 244 ? 0.7649 0.5644 0.5836 0.1310 0.0409 0.0757 243 TRP A CA 1923 C C . TRP A 244 ? 0.7870 0.5579 0.6015 0.1315 0.0494 0.0785 243 TRP A C 1924 O O . TRP A 244 ? 0.8380 0.5752 0.6408 0.1268 0.0550 0.0696 243 TRP A O 1925 C CB . TRP A 244 ? 0.7393 0.5521 0.5574 0.1172 0.0269 0.0651 243 TRP A CB 1926 C CG . TRP A 244 ? 0.7124 0.5483 0.5323 0.1139 0.0190 0.0601 243 TRP A CG 1927 C CD1 . TRP A 244 ? 0.7091 0.5351 0.5212 0.1093 0.0167 0.0494 243 TRP A CD1 1928 C CD2 . TRP A 244 ? 0.6782 0.5495 0.5066 0.1133 0.0129 0.0651 243 TRP A CD2 1929 N NE1 . TRP A 244 ? 0.6851 0.5366 0.5011 0.1064 0.0103 0.0478 243 TRP A NE1 1930 C CE2 . TRP A 244 ? 0.6696 0.5490 0.4953 0.1080 0.0079 0.0566 243 TRP A CE2 1931 C CE3 . TRP A 244 ? 0.6785 0.5751 0.5151 0.1159 0.0115 0.0759 243 TRP A CE3 1932 C CZ2 . TRP A 244 ? 0.6554 0.5657 0.4861 0.1040 0.0023 0.0575 243 TRP A CZ2 1933 C CZ3 . TRP A 244 ? 0.6630 0.5924 0.5039 0.1116 0.0049 0.0766 243 TRP A CZ3 1934 C CH2 . TRP A 244 ? 0.6635 0.5988 0.5014 0.1052 0.0006 0.0669 243 TRP A CH2 1935 N N . SER A 245 ? 0.7880 0.5724 0.6105 0.1359 0.0505 0.0905 244 SER A N 1936 C CA . SER A 245 ? 0.8044 0.5632 0.6236 0.1356 0.0590 0.0945 244 SER A CA 1937 C C . SER A 245 ? 0.8080 0.5549 0.6214 0.1185 0.0509 0.0804 244 SER A C 1938 O O . SER A 245 ? 0.7753 0.5454 0.5930 0.1105 0.0385 0.0753 244 SER A O 1939 C CB . SER A 245 ? 0.7922 0.5732 0.6216 0.1446 0.0610 0.1122 244 SER A CB 1940 O OG . SER A 245 ? 0.8066 0.5636 0.6326 0.1424 0.0685 0.1155 244 SER A OG 1941 N N . PRO A 246 ? 0.8470 0.5581 0.6508 0.1125 0.0586 0.0744 245 PRO A N 1942 C CA . PRO A 246 ? 0.8498 0.5544 0.6506 0.0959 0.0506 0.0628 245 PRO A CA 1943 C C . PRO A 246 ? 0.8445 0.5680 0.6550 0.0931 0.0465 0.0695 245 PRO A C 1944 O O . PRO A 246 ? 0.8526 0.5806 0.6647 0.0806 0.0383 0.0612 245 PRO A O 1945 C CB . PRO A 246 ? 0.8872 0.5496 0.6753 0.0902 0.0622 0.0570 245 PRO A CB 1946 C CG . PRO A 246 ? 0.9074 0.5527 0.6883 0.1019 0.0736 0.0595 245 PRO A CG 1947 C CD . PRO A 246 ? 0.8866 0.5612 0.6807 0.1188 0.0748 0.0759 245 PRO A CD 1948 N N . GLU A 247 ? 0.8525 0.5883 0.6695 0.1049 0.0524 0.0852 246 GLU A N 1949 C CA . GLU A 247 ? 0.8594 0.6143 0.6838 0.1027 0.0491 0.0924 246 GLU A CA 1950 C C . GLU A 247 ? 0.8108 0.6062 0.6427 0.1043 0.0380 0.0952 246 GLU A C 1951 O O . GLU A 247 ? 0.8213 0.6336 0.6575 0.1013 0.0349 0.0995 246 GLU A O 1952 C CB . GLU A 247 ? 0.9177 0.6612 0.7429 0.1133 0.0625 0.1091 246 GLU A CB 1953 C CG . GLU A 247 ? 0.9972 0.6962 0.8133 0.1100 0.0760 0.1061 246 GLU A CG 1954 C CD . GLU A 247 ? 1.0480 0.7308 0.8590 0.0905 0.0706 0.0887 246 GLU A CD 1955 O OE1 . GLU A 247 ? 1.0361 0.7380 0.8534 0.0810 0.0613 0.0854 246 GLU A OE1 1956 O OE2 . GLU A 247 ? 1.0783 0.7303 0.8786 0.0842 0.0759 0.0783 246 GLU A OE2 1957 N N . LYS A 248 ? 0.7835 0.5931 0.6157 0.1078 0.0329 0.0919 247 LYS A N 1958 C CA . LYS A 248 ? 0.7518 0.5973 0.5890 0.1068 0.0233 0.0927 247 LYS A CA 1959 C C . LYS A 248 ? 0.7340 0.5856 0.5714 0.0936 0.0140 0.0802 247 LYS A C 1960 O O . LYS A 248 ? 0.7296 0.5666 0.5638 0.0865 0.0105 0.0680 247 LYS A O 1961 C CB . LYS A 248 ? 0.7635 0.6188 0.6005 0.1117 0.0211 0.0905 247 LYS A CB 1962 C CG . LYS A 248 ? 0.7714 0.6559 0.6103 0.1059 0.0109 0.0848 247 LYS A CG 1963 C CD . LYS A 248 ? 0.7816 0.6995 0.6258 0.1118 0.0099 0.0975 247 LYS A CD 1964 C CE . LYS A 248 ? 0.7815 0.7256 0.6253 0.1033 0.0008 0.0898 247 LYS A CE 1965 N NZ . LYS A 248 ? 0.8318 0.8093 0.6782 0.1040 -0.0014 0.1006 247 LYS A NZ 1966 N N . VAL A 249 ? 0.7072 0.5807 0.5481 0.0907 0.0105 0.0838 248 VAL A N 1967 C CA . VAL A 249 ? 0.6755 0.5562 0.5175 0.0799 0.0036 0.0732 248 VAL A CA 1968 C C . VAL A 249 ? 0.6665 0.5663 0.5074 0.0779 -0.0031 0.0667 248 VAL A C 1969 O O . VAL A 249 ? 0.6652 0.5877 0.5060 0.0808 -0.0040 0.0729 248 VAL A O 1970 C CB . VAL A 249 ? 0.6754 0.5689 0.5200 0.0773 0.0050 0.0795 248 VAL A CB 1971 C CG1 . VAL A 249 ? 0.6561 0.5576 0.5028 0.0677 -0.0002 0.0690 248 VAL A CG1 1972 C CG2 . VAL A 249 ? 0.7021 0.5751 0.5475 0.0786 0.0131 0.0866 248 VAL A CG2 1973 N N . PHE A 250 ? 0.6587 0.5494 0.4983 0.0725 -0.0076 0.0547 249 PHE A N 1974 C CA . PHE A 250 ? 0.6351 0.5387 0.4726 0.0697 -0.0127 0.0474 249 PHE A CA 1975 C C . PHE A 250 ? 0.6205 0.5352 0.4593 0.0625 -0.0155 0.0417 249 PHE A C 1976 O O . PHE A 250 ? 0.5948 0.5243 0.4306 0.0598 -0.0173 0.0384 249 PHE A O 1977 C CB . PHE A 250 ? 0.6304 0.5172 0.4645 0.0687 -0.0152 0.0387 249 PHE A CB 1978 C CG . PHE A 250 ? 0.6513 0.5287 0.4821 0.0757 -0.0114 0.0425 249 PHE A CG 1979 C CD1 . PHE A 250 ? 0.6480 0.5408 0.4784 0.0799 -0.0109 0.0459 249 PHE A CD1 1980 C CD2 . PHE A 250 ? 0.6804 0.5336 0.5084 0.0774 -0.0072 0.0426 249 PHE A CD2 1981 C CE1 . PHE A 250 ? 0.6631 0.5485 0.4922 0.0876 -0.0060 0.0504 249 PHE A CE1 1982 C CE2 . PHE A 250 ? 0.6934 0.5354 0.5176 0.0847 -0.0014 0.0461 249 PHE A CE2 1983 C CZ . PHE A 250 ? 0.6771 0.5358 0.5028 0.0907 -0.0006 0.0505 249 PHE A CZ 1984 N N . VAL A 251 ? 0.6210 0.5275 0.4641 0.0589 -0.0150 0.0399 250 VAL A N 1985 C CA . VAL A 251 ? 0.6224 0.5379 0.4682 0.0534 -0.0156 0.0352 250 VAL A CA 1986 C C . VAL A 251 ? 0.6396 0.5568 0.4898 0.0521 -0.0117 0.0414 250 VAL A C 1987 O O . VAL A 251 ? 0.6310 0.5349 0.4854 0.0515 -0.0104 0.0433 250 VAL A O 1988 C CB . VAL A 251 ? 0.6167 0.5230 0.4659 0.0502 -0.0191 0.0261 250 VAL A CB 1989 C CG1 . VAL A 251 ? 0.6242 0.5391 0.4784 0.0464 -0.0174 0.0230 250 VAL A CG1 1990 C CG2 . VAL A 251 ? 0.6059 0.5096 0.4494 0.0513 -0.0221 0.0204 250 VAL A CG2 1991 N N . GLN A 252 ? 0.6623 0.5956 0.5104 0.0503 -0.0094 0.0440 251 GLN A N 1992 C CA . GLN A 252 ? 0.6964 0.6332 0.5475 0.0486 -0.0049 0.0500 251 GLN A CA 1993 C C . GLN A 252 ? 0.6817 0.6256 0.5352 0.0431 -0.0032 0.0433 251 GLN A C 1994 O O . GLN A 252 ? 0.7109 0.6624 0.5593 0.0410 -0.0038 0.0368 251 GLN A O 1995 C CB . GLN A 252 ? 0.7265 0.6784 0.5708 0.0515 -0.0025 0.0603 251 GLN A CB 1996 C CG . GLN A 252 ? 0.7576 0.7107 0.6032 0.0513 0.0029 0.0696 251 GLN A CG 1997 C CD . GLN A 252 ? 0.7838 0.7538 0.6222 0.0554 0.0045 0.0821 251 GLN A CD 1998 O OE1 . GLN A 252 ? 0.8069 0.7967 0.6380 0.0520 0.0029 0.0809 251 GLN A OE1 1999 N NE2 . GLN A 252 ? 0.8095 0.7718 0.6492 0.0624 0.0081 0.0943 251 GLN A NE2 2000 N N . THR A 253 ? 0.6850 0.6249 0.5467 0.0406 -0.0001 0.0447 252 THR A N 2001 C CA . THR A 253 ? 0.6981 0.6452 0.5640 0.0367 0.0036 0.0403 252 THR A CA 2002 C C . THR A 253 ? 0.7097 0.6608 0.5774 0.0348 0.0096 0.0482 252 THR A C 2003 O O . THR A 253 ? 0.7056 0.6513 0.5718 0.0368 0.0104 0.0567 252 THR A O 2004 C CB . THR A 253 ? 0.6931 0.6336 0.5715 0.0354 0.0013 0.0340 252 THR A CB 2005 O OG1 . THR A 253 ? 0.6931 0.6272 0.5807 0.0331 0.0015 0.0382 252 THR A OG1 2006 C CG2 . THR A 253 ? 0.6677 0.6004 0.5439 0.0379 -0.0051 0.0285 252 THR A CG2 2007 N N . PRO A 254 ? 0.7441 0.7033 0.6147 0.0314 0.0152 0.0459 253 PRO A N 2008 C CA . PRO A 254 ? 0.7707 0.7337 0.6420 0.0292 0.0217 0.0540 253 PRO A CA 2009 C C . PRO A 254 ? 0.7944 0.7465 0.6775 0.0276 0.0224 0.0585 253 PRO A C 2010 O O . PRO A 254 ? 0.7894 0.7399 0.6709 0.0267 0.0274 0.0672 253 PRO A O 2011 C CB . PRO A 254 ? 0.7565 0.7289 0.6293 0.0259 0.0284 0.0489 253 PRO A CB 2012 C CG . PRO A 254 ? 0.7496 0.7232 0.6167 0.0267 0.0263 0.0392 253 PRO A CG 2013 C CD . PRO A 254 ? 0.7487 0.7124 0.6211 0.0300 0.0177 0.0369 253 PRO A CD 2014 N N . THR A 255 ? 0.8360 0.7807 0.7298 0.0264 0.0175 0.0527 254 THR A N 2015 C CA . THR A 255 ? 0.8553 0.7914 0.7602 0.0216 0.0180 0.0547 254 THR A CA 2016 C C . THR A 255 ? 0.8535 0.7729 0.7562 0.0217 0.0125 0.0538 254 THR A C 2017 O O . THR A 255 ? 0.8714 0.7809 0.7798 0.0160 0.0139 0.0552 254 THR A O 2018 C CB . THR A 255 ? 0.8652 0.8101 0.7867 0.0174 0.0173 0.0491 254 THR A CB 2019 O OG1 . THR A 255 ? 0.8452 0.7899 0.7689 0.0200 0.0097 0.0420 254 THR A OG1 2020 C CG2 . THR A 255 ? 0.8679 0.8272 0.7922 0.0178 0.0249 0.0491 254 THR A CG2 2021 N N . ILE A 256 ? 0.8157 0.7315 0.7098 0.0270 0.0074 0.0510 255 ILE A N 2022 C CA . ILE A 256 ? 0.7935 0.6929 0.6848 0.0270 0.0031 0.0488 255 ILE A CA 2023 C C . ILE A 256 ? 0.7387 0.6357 0.6185 0.0345 0.0005 0.0491 255 ILE A C 2024 O O . ILE A 256 ? 0.7322 0.6419 0.6084 0.0375 -0.0012 0.0468 255 ILE A O 2025 C CB . ILE A 256 ? 0.8079 0.7078 0.7092 0.0214 -0.0031 0.0407 255 ILE A CB 2026 C CG1 . ILE A 256 ? 0.8184 0.7015 0.7137 0.0202 -0.0078 0.0370 255 ILE A CG1 2027 C CG2 . ILE A 256 ? 0.8351 0.7492 0.7401 0.0246 -0.0067 0.0354 255 ILE A CG2 2028 C CD1 . ILE A 256 ? 0.8442 0.7302 0.7484 0.0133 -0.0146 0.0305 255 ILE A CD1 2029 N N . ASN A 257 ? 0.7080 0.5885 0.5818 0.0369 0.0016 0.0523 256 ASN A N 2030 C CA . ASN A 257 ? 0.7281 0.6057 0.5931 0.0442 -0.0001 0.0532 256 ASN A CA 2031 C C . ASN A 257 ? 0.6984 0.5609 0.5613 0.0426 -0.0046 0.0455 256 ASN A C 2032 O O . ASN A 257 ? 0.7350 0.5834 0.5999 0.0363 -0.0042 0.0425 256 ASN A O 2033 C CB . ASN A 257 ? 0.7759 0.6479 0.6350 0.0512 0.0065 0.0649 256 ASN A CB 2034 C CG . ASN A 257 ? 0.8225 0.7125 0.6809 0.0534 0.0099 0.0738 256 ASN A CG 2035 O OD1 . ASN A 257 ? 0.8670 0.7727 0.7276 0.0493 0.0079 0.0699 256 ASN A OD1 2036 N ND2 . ASN A 257 ? 0.9118 0.7997 0.7660 0.0603 0.0156 0.0862 256 ASN A ND2 2037 N N . TYR A 258 ? 0.6498 0.5163 0.5080 0.0467 -0.0089 0.0416 257 TYR A N 2038 C CA . TYR A 258 ? 0.6425 0.4946 0.4960 0.0460 -0.0125 0.0351 257 TYR A CA 2039 C C . TYR A 258 ? 0.6361 0.4806 0.4814 0.0539 -0.0091 0.0393 257 TYR A C 2040 O O . TYR A 258 ? 0.6300 0.4886 0.4737 0.0593 -0.0098 0.0419 257 TYR A O 2041 C CB . TYR A 258 ? 0.6273 0.4883 0.4823 0.0443 -0.0197 0.0271 257 TYR A CB 2042 C CG . TYR A 258 ? 0.6349 0.5061 0.5002 0.0388 -0.0222 0.0244 257 TYR A CG 2043 C CD1 . TYR A 258 ? 0.6265 0.4926 0.4970 0.0321 -0.0261 0.0205 257 TYR A CD1 2044 C CD2 . TYR A 258 ? 0.6546 0.5420 0.5245 0.0399 -0.0200 0.0260 257 TYR A CD2 2045 C CE1 . TYR A 258 ? 0.6452 0.5245 0.5280 0.0280 -0.0279 0.0197 257 TYR A CE1 2046 C CE2 . TYR A 258 ? 0.6655 0.5625 0.5462 0.0362 -0.0203 0.0243 257 TYR A CE2 2047 C CZ . TYR A 258 ? 0.6639 0.5579 0.5524 0.0310 -0.0244 0.0218 257 TYR A CZ 2048 O OH . TYR A 258 ? 0.6694 0.5764 0.5711 0.0283 -0.0243 0.0215 257 TYR A OH 2049 N N . THR A 259 ? 0.6359 0.4578 0.4761 0.0537 -0.0047 0.0396 258 THR A N 2050 C CA . THR A 259 ? 0.6330 0.4421 0.4653 0.0611 0.0000 0.0421 258 THR A CA 2051 C C . THR A 259 ? 0.6376 0.4332 0.4627 0.0570 -0.0042 0.0317 258 THR A C 2052 O O . THR A 259 ? 0.6212 0.4192 0.4481 0.0488 -0.0113 0.0241 258 THR A O 2053 C CB . THR A 259 ? 0.6504 0.4373 0.4792 0.0637 0.0105 0.0489 258 THR A CB 2054 O OG1 . THR A 259 ? 0.6524 0.4164 0.4764 0.0536 0.0112 0.0405 258 THR A OG1 2055 C CG2 . THR A 259 ? 0.6452 0.4416 0.4803 0.0656 0.0150 0.0594 258 THR A CG2 2056 N N . LEU A 260 ? 0.6475 0.4298 0.4646 0.0630 0.0005 0.0323 259 LEU A N 2057 C CA . LEU A 260 ? 0.6594 0.4276 0.4669 0.0588 -0.0026 0.0226 259 LEU A CA 2058 C C . LEU A 260 ? 0.6755 0.4209 0.4762 0.0481 -0.0017 0.0157 259 LEU A C 2059 O O . LEU A 260 ? 0.7025 0.4386 0.4943 0.0419 -0.0062 0.0069 259 LEU A O 2060 C CB . LEU A 260 ? 0.6634 0.4237 0.4639 0.0682 0.0035 0.0248 259 LEU A CB 2061 C CG . LEU A 260 ? 0.6791 0.4181 0.4751 0.0753 0.0167 0.0315 259 LEU A CG 2062 C CD1 . LEU A 260 ? 0.6920 0.3981 0.4739 0.0682 0.0217 0.0227 259 LEU A CD1 2063 C CD2 . LEU A 260 ? 0.6785 0.4275 0.4764 0.0883 0.0218 0.0392 259 LEU A CD2 2064 N N . ARG A 261 ? 0.6657 0.4026 0.4696 0.0450 0.0039 0.0196 260 ARG A N 2065 C CA . ARG A 261 ? 0.6783 0.3971 0.4770 0.0315 0.0041 0.0124 260 ARG A CA 2066 C C . ARG A 261 ? 0.6685 0.4075 0.4780 0.0214 -0.0064 0.0089 260 ARG A C 2067 O O . ARG A 261 ? 0.6935 0.4243 0.5015 0.0086 -0.0080 0.0034 260 ARG A O 2068 C CB . ARG A 261 ? 0.6945 0.3906 0.4903 0.0316 0.0172 0.0179 260 ARG A CB 2069 C CG . ARG A 261 ? 0.7080 0.3827 0.4943 0.0433 0.0297 0.0229 260 ARG A CG 2070 C CD . ARG A 261 ? 0.7418 0.3815 0.5188 0.0396 0.0441 0.0236 260 ARG A CD 2071 N NE . ARG A 261 ? 0.7417 0.3851 0.5282 0.0424 0.0500 0.0345 260 ARG A NE 2072 C CZ . ARG A 261 ? 0.7778 0.3943 0.5592 0.0364 0.0615 0.0357 260 ARG A CZ 2073 N NH1 . ARG A 261 ? 0.8054 0.3878 0.5714 0.0256 0.0687 0.0255 260 ARG A NH1 2074 N NH2 . ARG A 261 ? 0.7846 0.4072 0.5749 0.0401 0.0666 0.0471 260 ARG A NH2 2075 N N . ASP A 262 ? 0.6481 0.4136 0.4684 0.0266 -0.0128 0.0119 261 ASP A N 2076 C CA . ASP A 262 ? 0.6333 0.4192 0.4663 0.0201 -0.0202 0.0108 261 ASP A CA 2077 C C . ASP A 262 ? 0.6156 0.4181 0.4515 0.0207 -0.0303 0.0064 261 ASP A C 2078 O O . ASP A 262 ? 0.5909 0.4135 0.4389 0.0203 -0.0346 0.0076 261 ASP A O 2079 C CB . ASP A 262 ? 0.6151 0.4163 0.4588 0.0253 -0.0161 0.0192 261 ASP A CB 2080 C CG . ASP A 262 ? 0.6410 0.4270 0.4827 0.0257 -0.0056 0.0258 261 ASP A CG 2081 O OD1 . ASP A 262 ? 0.6589 0.4295 0.4990 0.0158 -0.0027 0.0231 261 ASP A OD1 2082 O OD2 . ASP A 262 ? 0.6409 0.4307 0.4825 0.0355 0.0000 0.0344 261 ASP A OD2 2083 N N . TYR A 263 ? 0.6175 0.4105 0.4420 0.0219 -0.0330 0.0017 262 TYR A N 2084 C CA . TYR A 263 ? 0.6160 0.4225 0.4418 0.0238 -0.0413 -0.0011 262 TYR A CA 2085 C C . TYR A 263 ? 0.6245 0.4435 0.4586 0.0154 -0.0500 -0.0036 262 TYR A C 2086 O O . TYR A 263 ? 0.6318 0.4681 0.4746 0.0190 -0.0548 -0.0023 262 TYR A O 2087 C CB . TYR A 263 ? 0.6205 0.4139 0.4314 0.0266 -0.0419 -0.0051 262 TYR A CB 2088 C CG . TYR A 263 ? 0.6149 0.4040 0.4213 0.0367 -0.0346 -0.0015 262 TYR A CG 2089 C CD1 . TYR A 263 ? 0.5947 0.4001 0.4101 0.0434 -0.0323 0.0039 262 TYR A CD1 2090 C CD2 . TYR A 263 ? 0.6199 0.3903 0.4127 0.0391 -0.0297 -0.0036 262 TYR A CD2 2091 C CE1 . TYR A 263 ? 0.5850 0.3916 0.3975 0.0515 -0.0268 0.0079 262 TYR A CE1 2092 C CE2 . TYR A 263 ? 0.6143 0.3848 0.4056 0.0488 -0.0230 0.0008 262 TYR A CE2 2093 C CZ . TYR A 263 ? 0.6029 0.3932 0.4048 0.0547 -0.0222 0.0070 262 TYR A CZ 2094 O OH . TYR A 263 ? 0.5979 0.3931 0.3994 0.0633 -0.0166 0.0122 262 TYR A OH 2095 N N . ARG A 264 ? 0.6572 0.4685 0.4890 0.0042 -0.0515 -0.0067 263 ARG A N 2096 C CA . ARG A 264 ? 0.6794 0.5082 0.5214 -0.0043 -0.0605 -0.0078 263 ARG A CA 2097 C C . ARG A 264 ? 0.6618 0.5128 0.5242 -0.0014 -0.0598 -0.0022 263 ARG A C 2098 O O . ARG A 264 ? 0.6778 0.5484 0.5510 0.0011 -0.0658 -0.0003 263 ARG A O 2099 C CB . ARG A 264 ? 0.7258 0.5442 0.5617 -0.0196 -0.0620 -0.0129 263 ARG A CB 2100 C CG . ARG A 264 ? 0.7546 0.5956 0.6000 -0.0287 -0.0736 -0.0136 263 ARG A CG 2101 C CD . ARG A 264 ? 0.8174 0.6509 0.6557 -0.0470 -0.0761 -0.0197 263 ARG A CD 2102 N NE . ARG A 264 ? 0.8945 0.7576 0.7459 -0.0551 -0.0883 -0.0183 263 ARG A NE 2103 C CZ . ARG A 264 ? 0.9760 0.8459 0.8288 -0.0732 -0.0932 -0.0221 263 ARG A CZ 2104 N NH1 . ARG A 264 ? 1.0295 0.8738 0.8692 -0.0862 -0.0857 -0.0288 263 ARG A NH1 2105 N NH2 . ARG A 264 ? 1.0042 0.9070 0.8718 -0.0787 -0.1051 -0.0188 263 ARG A NH2 2106 N N . LYS A 265 ? 0.6596 0.5063 0.5261 -0.0009 -0.0515 0.0009 264 LYS A N 2107 C CA . LYS A 265 ? 0.6480 0.5133 0.5311 0.0022 -0.0486 0.0062 264 LYS A CA 2108 C C . LYS A 265 ? 0.6349 0.5114 0.5208 0.0138 -0.0483 0.0082 264 LYS A C 2109 O O . LYS A 265 ? 0.6287 0.5232 0.5279 0.0160 -0.0493 0.0104 264 LYS A O 2110 C CB . LYS A 265 ? 0.6392 0.4946 0.5212 0.0024 -0.0387 0.0101 264 LYS A CB 2111 C CG . LYS A 265 ? 0.6554 0.5007 0.5381 -0.0098 -0.0360 0.0091 264 LYS A CG 2112 C CD . LYS A 265 ? 0.6543 0.4972 0.5416 -0.0087 -0.0261 0.0155 264 LYS A CD 2113 C CE . LYS A 265 ? 0.6412 0.4709 0.5175 0.0022 -0.0186 0.0203 264 LYS A CE 2114 N NZ . LYS A 265 ? 0.6490 0.4695 0.5258 0.0009 -0.0085 0.0269 264 LYS A NZ 2115 N N . PHE A 266 ? 0.6362 0.5012 0.5094 0.0207 -0.0456 0.0076 265 PHE A N 2116 C CA . PHE A 266 ? 0.6377 0.5102 0.5103 0.0295 -0.0443 0.0082 265 PHE A CA 2117 C C . PHE A 266 ? 0.6362 0.5179 0.5133 0.0312 -0.0506 0.0064 265 PHE A C 2118 O O . PHE A 266 ? 0.6168 0.5107 0.5026 0.0356 -0.0488 0.0079 265 PHE A O 2119 C CB . PHE A 266 ? 0.6550 0.5149 0.5135 0.0345 -0.0416 0.0075 265 PHE A CB 2120 C CG . PHE A 266 ? 0.6562 0.5231 0.5123 0.0410 -0.0403 0.0071 265 PHE A CG 2121 C CD1 . PHE A 266 ? 0.6610 0.5387 0.5211 0.0433 -0.0352 0.0097 265 PHE A CD1 2122 C CD2 . PHE A 266 ? 0.6750 0.5369 0.5233 0.0435 -0.0435 0.0037 265 PHE A CD2 2123 C CE1 . PHE A 266 ? 0.6724 0.5554 0.5282 0.0468 -0.0333 0.0079 265 PHE A CE1 2124 C CE2 . PHE A 266 ? 0.6721 0.5386 0.5174 0.0477 -0.0412 0.0026 265 PHE A CE2 2125 C CZ . PHE A 266 ? 0.6730 0.5498 0.5219 0.0487 -0.0361 0.0042 265 PHE A CZ 2126 N N . PHE A 267 ? 0.6486 0.5238 0.5190 0.0279 -0.0572 0.0037 266 PHE A N 2127 C CA . PHE A 267 ? 0.6392 0.5234 0.5128 0.0303 -0.0636 0.0038 266 PHE A CA 2128 C C . PHE A 267 ? 0.6614 0.5658 0.5538 0.0282 -0.0667 0.0075 266 PHE A C 2129 O O . PHE A 267 ? 0.6863 0.6019 0.5871 0.0349 -0.0671 0.0105 266 PHE A O 2130 C CB . PHE A 267 ? 0.6373 0.5112 0.4976 0.0263 -0.0705 0.0005 266 PHE A CB 2131 C CG . PHE A 267 ? 0.6286 0.4864 0.4724 0.0314 -0.0675 -0.0020 266 PHE A CG 2132 C CD1 . PHE A 267 ? 0.6218 0.4818 0.4643 0.0393 -0.0660 -0.0011 266 PHE A CD1 2133 C CD2 . PHE A 267 ? 0.6318 0.4718 0.4617 0.0281 -0.0651 -0.0054 266 PHE A CD2 2134 C CE1 . PHE A 267 ? 0.6245 0.4718 0.4531 0.0428 -0.0630 -0.0035 266 PHE A CE1 2135 C CE2 . PHE A 267 ? 0.6341 0.4620 0.4510 0.0332 -0.0616 -0.0072 266 PHE A CE2 2136 C CZ . PHE A 267 ? 0.6290 0.4618 0.4457 0.0400 -0.0611 -0.0062 266 PHE A CZ 2137 N N . GLN A 268 ? 0.6819 0.5911 0.5817 0.0193 -0.0676 0.0079 267 GLN A N 2138 C CA . GLN A 268 ? 0.7067 0.6384 0.6272 0.0172 -0.0692 0.0122 267 GLN A CA 2139 C C . GLN A 268 ? 0.6812 0.6206 0.6117 0.0256 -0.0603 0.0153 267 GLN A C 2140 O O . GLN A 268 ? 0.6766 0.6322 0.6213 0.0311 -0.0600 0.0191 267 GLN A O 2141 C CB . GLN A 268 ? 0.7470 0.6807 0.6727 0.0045 -0.0698 0.0114 267 GLN A CB 2142 C CG . GLN A 268 ? 0.8066 0.7431 0.7289 -0.0068 -0.0799 0.0088 267 GLN A CG 2143 C CD . GLN A 268 ? 0.8769 0.8092 0.8000 -0.0218 -0.0788 0.0062 267 GLN A CD 2144 O OE1 . GLN A 268 ? 0.9824 0.8995 0.8906 -0.0322 -0.0819 0.0005 267 GLN A OE1 2145 N NE2 . GLN A 268 ? 0.8673 0.8111 0.8065 -0.0237 -0.0732 0.0098 267 GLN A NE2 2146 N N . ASP A 269 ? 0.6583 0.5864 0.5811 0.0267 -0.0526 0.0140 268 ASP A N 2147 C CA . ASP A 269 ? 0.6504 0.5857 0.5802 0.0316 -0.0438 0.0161 268 ASP A CA 2148 C C . ASP A 269 ? 0.6633 0.5973 0.5889 0.0409 -0.0399 0.0150 268 ASP A C 2149 O O . ASP A 269 ? 0.6467 0.5884 0.5797 0.0447 -0.0327 0.0163 268 ASP A O 2150 C CB . ASP A 269 ? 0.6279 0.5541 0.5501 0.0289 -0.0373 0.0164 268 ASP A CB 2151 C CG . ASP A 269 ? 0.6209 0.5476 0.5494 0.0195 -0.0375 0.0183 268 ASP A CG 2152 O OD1 . ASP A 269 ? 0.6078 0.5464 0.5493 0.0140 -0.0422 0.0190 268 ASP A OD1 2153 O OD2 . ASP A 269 ? 0.6185 0.5343 0.5394 0.0175 -0.0326 0.0196 268 ASP A OD2 2154 N N . ILE A 270 ? 0.7004 0.6232 0.6131 0.0439 -0.0434 0.0123 269 ILE A N 2155 C CA . ILE A 270 ? 0.7021 0.6221 0.6108 0.0514 -0.0394 0.0111 269 ILE A CA 2156 C C . ILE A 270 ? 0.7146 0.6419 0.6326 0.0565 -0.0432 0.0143 269 ILE A C 2157 O O . ILE A 270 ? 0.7532 0.6760 0.6684 0.0635 -0.0387 0.0142 269 ILE A O 2158 C CB . ILE A 270 ? 0.7070 0.6118 0.5973 0.0523 -0.0394 0.0071 269 ILE A CB 2159 C CG1 . ILE A 270 ? 0.7199 0.6171 0.6028 0.0509 -0.0481 0.0064 269 ILE A CG1 2160 C CG2 . ILE A 270 ? 0.7106 0.6122 0.5935 0.0491 -0.0354 0.0061 269 ILE A CG2 2161 C CD1 . ILE A 270 ? 0.7225 0.6059 0.5885 0.0519 -0.0471 0.0029 269 ILE A CD1 2162 N N . GLY A 271 ? 0.7057 0.6444 0.6339 0.0526 -0.0515 0.0177 270 GLY A N 2163 C CA . GLY A 271 ? 0.7114 0.6629 0.6508 0.0577 -0.0565 0.0231 270 GLY A CA 2164 C C . GLY A 271 ? 0.7408 0.6828 0.6666 0.0595 -0.0636 0.0226 270 GLY A C 2165 O O . GLY A 271 ? 0.7678 0.7134 0.6971 0.0677 -0.0638 0.0273 270 GLY A O 2166 N N . PHE A 272 ? 0.7627 0.6916 0.6725 0.0524 -0.0684 0.0177 271 PHE A N 2167 C CA . PHE A 272 ? 0.7463 0.6650 0.6411 0.0531 -0.0744 0.0166 271 PHE A CA 2168 C C . PHE A 272 ? 0.7730 0.6873 0.6581 0.0423 -0.0826 0.0131 271 PHE A C 2169 O O . PHE A 272 ? 0.7792 0.6752 0.6475 0.0394 -0.0810 0.0078 271 PHE A O 2170 C CB . PHE A 272 ? 0.7262 0.6260 0.6057 0.0579 -0.0671 0.0125 271 PHE A CB 2171 C CG . PHE A 272 ? 0.7407 0.6295 0.6050 0.0597 -0.0714 0.0120 271 PHE A CG 2172 C CD1 . PHE A 272 ? 0.7535 0.6491 0.6212 0.0656 -0.0756 0.0180 271 PHE A CD1 2173 C CD2 . PHE A 272 ? 0.7415 0.6141 0.5886 0.0563 -0.0706 0.0065 271 PHE A CD2 2174 C CE1 . PHE A 272 ? 0.7514 0.6366 0.6036 0.0671 -0.0792 0.0183 271 PHE A CE1 2175 C CE2 . PHE A 272 ? 0.7466 0.6088 0.5790 0.0577 -0.0737 0.0060 271 PHE A CE2 2176 C CZ . PHE A 272 ? 0.7578 0.6258 0.5919 0.0626 -0.0782 0.0117 271 PHE A CZ 2177 N N . GLU A 273 ? 0.8160 0.7472 0.7113 0.0358 -0.0908 0.0161 272 GLU A N 2178 C CA . GLU A 273 ? 0.8450 0.7714 0.7303 0.0227 -0.0976 0.0114 272 GLU A CA 2179 C C . GLU A 273 ? 0.8330 0.7449 0.6965 0.0211 -0.1028 0.0081 272 GLU A C 2180 O O . GLU A 273 ? 0.8723 0.7682 0.7204 0.0122 -0.1032 0.0017 272 GLU A O 2181 C CB . GLU A 273 ? 0.8989 0.8499 0.8004 0.0139 -0.1057 0.0150 272 GLU A CB 2182 C CG . GLU A 273 ? 0.9130 0.8748 0.8335 0.0125 -0.0992 0.0168 272 GLU A CG 2183 C CD . GLU A 273 ? 0.9700 0.9496 0.9020 -0.0017 -0.1057 0.0171 272 GLU A CD 2184 O OE1 . GLU A 273 ? 0.9640 0.9328 0.8819 -0.0152 -0.1102 0.0109 272 GLU A OE1 2185 O OE2 . GLU A 273 ? 1.0391 1.0430 0.9941 -0.0002 -0.1052 0.0232 272 GLU A OE2 2186 N N . ASP A 274 ? 0.8282 0.7432 0.6891 0.0299 -0.1054 0.0126 273 ASP A N 2187 C CA . ASP A 274 ? 0.8430 0.7436 0.6819 0.0291 -0.1091 0.0100 273 ASP A CA 2188 C C . ASP A 274 ? 0.8072 0.6815 0.6292 0.0294 -0.1006 0.0027 273 ASP A C 2189 O O . ASP A 274 ? 0.8409 0.7005 0.6436 0.0247 -0.1024 -0.0018 273 ASP A O 2190 C CB . ASP A 274 ? 0.8709 0.7763 0.7100 0.0408 -0.1103 0.0172 273 ASP A CB 2191 C CG . ASP A 274 ? 0.8858 0.8183 0.7386 0.0420 -0.1203 0.0267 273 ASP A CG 2192 O OD1 . ASP A 274 ? 0.9064 0.8548 0.7637 0.0308 -0.1294 0.0265 273 ASP A OD1 2193 O OD2 . ASP A 274 ? 0.8887 0.8269 0.7479 0.0543 -0.1184 0.0349 273 ASP A OD2 2194 N N . GLY A 275 ? 0.7445 0.6143 0.5733 0.0352 -0.0912 0.0022 274 GLY A N 2195 C CA . GLY A 275 ? 0.7234 0.5738 0.5394 0.0363 -0.0834 -0.0028 274 GLY A CA 2196 C C . GLY A 275 ? 0.7183 0.5564 0.5250 0.0272 -0.0828 -0.0080 274 GLY A C 2197 O O . GLY A 275 ? 0.7321 0.5526 0.5236 0.0274 -0.0785 -0.0118 274 GLY A O 2198 N N . TRP A 276 ? 0.7171 0.5635 0.5332 0.0193 -0.0857 -0.0079 275 TRP A N 2199 C CA . TRP A 276 ? 0.7315 0.5632 0.5380 0.0093 -0.0837 -0.0131 275 TRP A CA 2200 C C . TRP A 276 ? 0.7445 0.5655 0.5316 0.0017 -0.0894 -0.0180 275 TRP A C 2201 O O . TRP A 276 ? 0.7445 0.5431 0.5147 -0.0016 -0.0840 -0.0236 275 TRP A O 2202 C CB . TRP A 276 ? 0.7348 0.5783 0.5560 0.0010 -0.0853 -0.0120 275 TRP A CB 2203 C CG . TRP A 276 ? 0.7584 0.5856 0.5684 -0.0119 -0.0837 -0.0180 275 TRP A CG 2204 C CD1 . TRP A 276 ? 0.7771 0.6109 0.5867 -0.0263 -0.0909 -0.0210 275 TRP A CD1 2205 C CD2 . TRP A 276 ? 0.7599 0.5607 0.5571 -0.0120 -0.0732 -0.0216 275 TRP A CD2 2206 N NE1 . TRP A 276 ? 0.8114 0.6212 0.6066 -0.0368 -0.0848 -0.0277 275 TRP A NE1 2207 C CE2 . TRP A 276 ? 0.7979 0.5862 0.5858 -0.0270 -0.0732 -0.0276 275 TRP A CE2 2208 C CE3 . TRP A 276 ? 0.7506 0.5383 0.5437 -0.0010 -0.0634 -0.0198 275 TRP A CE3 2209 C CZ2 . TRP A 276 ? 0.8091 0.5681 0.5830 -0.0299 -0.0621 -0.0317 275 TRP A CZ2 2210 C CZ3 . TRP A 276 ? 0.7779 0.5410 0.5595 -0.0027 -0.0535 -0.0224 275 TRP A CZ3 2211 C CH2 . TRP A 276 ? 0.8075 0.5543 0.5792 -0.0164 -0.0521 -0.0283 275 TRP A CH2 2212 N N . LEU A 277 ? 0.7573 0.5946 0.5463 -0.0003 -0.0998 -0.0154 276 LEU A N 2213 C CA . LEU A 277 ? 0.7818 0.6118 0.5503 -0.0078 -0.1064 -0.0194 276 LEU A CA 2214 C C . LEU A 277 ? 0.7707 0.5810 0.5215 0.0001 -0.1005 -0.0214 276 LEU A C 2215 O O . LEU A 277 ? 0.7720 0.5627 0.5015 -0.0059 -0.0983 -0.0279 276 LEU A O 2216 C CB . LEU A 277 ? 0.7868 0.6427 0.5623 -0.0096 -0.1194 -0.0134 276 LEU A CB 2217 C CG . LEU A 277 ? 0.8021 0.6833 0.5975 -0.0179 -0.1263 -0.0102 276 LEU A CG 2218 C CD1 . LEU A 277 ? 0.8174 0.7280 0.6228 -0.0152 -0.1383 -0.0012 276 LEU A CD1 2219 C CD2 . LEU A 277 ? 0.8275 0.7001 0.6118 -0.0366 -0.1281 -0.0187 276 LEU A CD2 2220 N N . MET A 278 ? 0.7416 0.5562 0.5006 0.0130 -0.0967 -0.0164 277 MET A N 2221 C CA . MET A 278 ? 0.7541 0.5522 0.4990 0.0201 -0.0900 -0.0180 277 MET A CA 2222 C C . MET A 278 ? 0.7460 0.5238 0.4827 0.0196 -0.0794 -0.0233 277 MET A C 2223 O O . MET A 278 ? 0.7456 0.5058 0.4642 0.0195 -0.0749 -0.0273 277 MET A O 2224 C CB . MET A 278 ? 0.7550 0.5617 0.5118 0.0317 -0.0865 -0.0125 277 MET A CB 2225 C CG . MET A 278 ? 0.7636 0.5842 0.5249 0.0361 -0.0936 -0.0060 277 MET A CG 2226 S SD . MET A 278 ? 0.7452 0.5715 0.5212 0.0481 -0.0860 -0.0011 277 MET A SD 2227 C CE . MET A 278 ? 0.7977 0.6358 0.5765 0.0541 -0.0929 0.0076 277 MET A CE 2228 N N . ARG A 279 ? 0.7245 0.5053 0.4748 0.0202 -0.0746 -0.0223 278 ARG A N 2229 C CA . ARG A 279 ? 0.7180 0.4815 0.4630 0.0212 -0.0642 -0.0248 278 ARG A CA 2230 C C . ARG A 279 ? 0.7685 0.5119 0.4957 0.0110 -0.0628 -0.0316 278 ARG A C 2231 O O . ARG A 279 ? 0.8101 0.5334 0.5232 0.0131 -0.0541 -0.0348 278 ARG A O 2232 C CB . ARG A 279 ? 0.6966 0.4679 0.4586 0.0232 -0.0599 -0.0212 278 ARG A CB 2233 C CG . ARG A 279 ? 0.6950 0.4500 0.4530 0.0261 -0.0486 -0.0212 278 ARG A CG 2234 C CD . ARG A 279 ? 0.6826 0.4343 0.4366 0.0361 -0.0418 -0.0192 278 ARG A CD 2235 N NE . ARG A 279 ? 0.6837 0.4243 0.4374 0.0412 -0.0308 -0.0165 278 ARG A NE 2236 C CZ . ARG A 279 ? 0.6825 0.4250 0.4370 0.0504 -0.0240 -0.0127 278 ARG A CZ 2237 N NH1 . ARG A 279 ? 0.6749 0.4283 0.4297 0.0541 -0.0266 -0.0125 278 ARG A NH1 2238 N NH2 . ARG A 279 ? 0.7038 0.4381 0.4596 0.0561 -0.0140 -0.0084 278 ARG A NH2 2239 N N . GLN A 280 ? 0.7958 0.5446 0.5233 -0.0006 -0.0704 -0.0340 279 GLN A N 2240 C CA . GLN A 280 ? 0.8508 0.5798 0.5585 -0.0133 -0.0694 -0.0421 279 GLN A CA 2241 C C . GLN A 280 ? 0.8677 0.5849 0.5526 -0.0143 -0.0706 -0.0464 279 GLN A C 2242 O O . GLN A 280 ? 0.8915 0.5833 0.5568 -0.0192 -0.0627 -0.0533 279 GLN A O 2243 C CB . GLN A 280 ? 0.8781 0.6204 0.5904 -0.0279 -0.0794 -0.0440 279 GLN A CB 2244 C CG . GLN A 280 ? 0.8961 0.6427 0.6258 -0.0307 -0.0755 -0.0419 279 GLN A CG 2245 C CD . GLN A 280 ? 0.9369 0.6925 0.6679 -0.0484 -0.0833 -0.0456 279 GLN A CD 2246 O OE1 . GLN A 280 ? 0.9463 0.7271 0.6842 -0.0530 -0.0962 -0.0432 279 GLN A OE1 2247 N NE2 . GLN A 280 ? 0.9779 0.7134 0.7028 -0.0587 -0.0750 -0.0510 279 GLN A NE2 2248 N N . ASP A 281 ? 0.8677 0.6017 0.5545 -0.0096 -0.0794 -0.0421 280 ASP A N 2249 C CA . ASP A 281 ? 0.8853 0.6093 0.5501 -0.0099 -0.0807 -0.0448 280 ASP A CA 2250 C C . ASP A 281 ? 0.8796 0.5832 0.5352 -0.0004 -0.0673 -0.0463 280 ASP A C 2251 O O . ASP A 281 ? 0.9056 0.5916 0.5388 -0.0030 -0.0635 -0.0514 280 ASP A O 2252 C CB . ASP A 281 ? 0.8853 0.6302 0.5561 -0.0036 -0.0905 -0.0375 280 ASP A CB 2253 C CG . ASP A 281 ? 0.8981 0.6670 0.5775 -0.0112 -0.1045 -0.0339 280 ASP A CG 2254 O OD1 . ASP A 281 ? 0.9107 0.6800 0.5863 -0.0249 -0.1085 -0.0388 280 ASP A OD1 2255 O OD2 . ASP A 281 ? 0.9058 0.6936 0.5963 -0.0032 -0.1107 -0.0256 280 ASP A OD2 2256 N N . THR A 282 ? 0.8607 0.5691 0.5338 0.0104 -0.0603 -0.0415 281 THR A N 2257 C CA . THR A 282 ? 0.8506 0.5495 0.5202 0.0208 -0.0497 -0.0403 281 THR A CA 2258 C C . THR A 282 ? 0.8466 0.5312 0.5188 0.0255 -0.0362 -0.0406 281 THR A C 2259 O O . THR A 282 ? 0.8407 0.5158 0.5071 0.0327 -0.0265 -0.0403 281 THR A O 2260 C CB . THR A 282 ? 0.8373 0.5555 0.5229 0.0305 -0.0516 -0.0334 281 THR A CB 2261 O OG1 . THR A 282 ? 0.8064 0.5399 0.5133 0.0327 -0.0530 -0.0293 281 THR A OG1 2262 C CG2 . THR A 282 ? 0.8376 0.5656 0.5187 0.0293 -0.0616 -0.0315 281 THR A CG2 2263 N N . GLU A 283 ? 0.8516 0.5352 0.5329 0.0218 -0.0349 -0.0404 282 GLU A N 2264 C CA . GLU A 283 ? 0.8717 0.5447 0.5588 0.0284 -0.0221 -0.0377 282 GLU A CA 2265 C C . GLU A 283 ? 0.8851 0.5285 0.5526 0.0288 -0.0092 -0.0426 282 GLU A C 2266 O O . GLU A 283 ? 0.9107 0.5470 0.5827 0.0390 0.0030 -0.0382 282 GLU A O 2267 C CB . GLU A 283 ? 0.8892 0.5647 0.5879 0.0232 -0.0230 -0.0362 282 GLU A CB 2268 C CG . GLU A 283 ? 0.9416 0.5999 0.6264 0.0082 -0.0244 -0.0442 282 GLU A CG 2269 C CD . GLU A 283 ? 0.9589 0.6220 0.6572 0.0024 -0.0251 -0.0422 282 GLU A CD 2270 O OE1 . GLU A 283 ? 0.9889 0.6591 0.7028 0.0117 -0.0197 -0.0346 282 GLU A OE1 2271 O OE2 . GLU A 283 ? 0.9748 0.6359 0.6678 -0.0121 -0.0312 -0.0479 282 GLU A OE2 2272 N N . GLY A 284 ? 0.8929 0.5200 0.5385 0.0180 -0.0114 -0.0513 283 GLY A N 2273 C CA . GLY A 284 ? 0.9079 0.5038 0.5317 0.0170 0.0020 -0.0576 283 GLY A CA 2274 C C . GLY A 284 ? 0.9193 0.5105 0.5295 0.0223 0.0056 -0.0591 283 GLY A C 2275 O O . GLY A 284 ? 0.9421 0.5066 0.5327 0.0216 0.0178 -0.0648 283 GLY A O 2276 N N . LEU A 285 ? 0.8931 0.5077 0.5124 0.0273 -0.0034 -0.0542 284 LEU A N 2277 C CA . LEU A 285 ? 0.9119 0.5220 0.5167 0.0301 -0.0008 -0.0559 284 LEU A CA 2278 C C . LEU A 285 ? 0.9253 0.5240 0.5300 0.0418 0.0159 -0.0536 284 LEU A C 2279 O O . LEU A 285 ? 0.9571 0.5360 0.5413 0.0410 0.0247 -0.0588 284 LEU A O 2280 C CB . LEU A 285 ? 0.8919 0.5275 0.5074 0.0332 -0.0123 -0.0504 284 LEU A CB 2281 C CG . LEU A 285 ? 0.8971 0.5447 0.5105 0.0234 -0.0284 -0.0515 284 LEU A CG 2282 C CD1 . LEU A 285 ? 0.8765 0.5461 0.5020 0.0292 -0.0363 -0.0448 284 LEU A CD1 2283 C CD2 . LEU A 285 ? 0.9199 0.5511 0.5050 0.0119 -0.0315 -0.0593 284 LEU A CD2 2284 N N . VAL A 286 ? 0.9182 0.5314 0.5459 0.0525 0.0205 -0.0452 285 VAL A N 2285 C CA . VAL A 286 ? 0.9322 0.5415 0.5648 0.0650 0.0359 -0.0404 285 VAL A CA 2286 C C . VAL A 286 ? 0.9700 0.5581 0.6017 0.0681 0.0489 -0.0401 285 VAL A C 2287 O O . VAL A 286 ? 0.9921 0.5861 0.6368 0.0678 0.0459 -0.0363 285 VAL A O 2288 C CB . VAL A 286 ? 0.8921 0.5333 0.5502 0.0745 0.0331 -0.0303 285 VAL A CB 2289 C CG1 . VAL A 286 ? 0.9009 0.5444 0.5706 0.0879 0.0480 -0.0225 285 VAL A CG1 2290 C CG2 . VAL A 286 ? 0.8839 0.5385 0.5393 0.0728 0.0263 -0.0311 285 VAL A CG2 2291 N N . GLU A 287 ? 1.0107 0.5725 0.6264 0.0716 0.0646 -0.0436 286 GLU A N 2292 C CA . GLU A 287 ? 1.0657 0.6015 0.6781 0.0754 0.0800 -0.0433 286 GLU A CA 2293 C C . GLU A 287 ? 1.0247 0.5791 0.6641 0.0918 0.0872 -0.0291 286 GLU A C 2294 O O . GLU A 287 ? 0.9602 0.5311 0.6110 0.1038 0.0929 -0.0214 286 GLU A O 2295 C CB . GLU A 287 ? 1.1402 0.6410 0.7273 0.0758 0.0974 -0.0509 286 GLU A CB 2296 C CG . GLU A 287 ? 1.2181 0.6795 0.7845 0.0667 0.1079 -0.0601 286 GLU A CG 2297 C CD . GLU A 287 ? 1.2701 0.7228 0.8518 0.0767 0.1201 -0.0515 286 GLU A CD 2298 O OE1 . GLU A 287 ? 1.2971 0.7658 0.9003 0.0948 0.1283 -0.0382 286 GLU A OE1 2299 O OE2 . GLU A 287 ? 1.3217 0.7524 0.8938 0.0659 0.1218 -0.0574 286 GLU A OE2 2300 N N . ALA A 288 ? 1.0416 0.5941 0.6905 0.0914 0.0869 -0.0252 287 ALA A N 2301 C CA . ALA A 288 ? 1.0283 0.6031 0.7030 0.1047 0.0896 -0.0108 287 ALA A CA 2302 C C . ALA A 288 ? 1.0370 0.6125 0.7205 0.1230 0.1071 -0.0002 287 ALA A C 2303 O O . ALA A 288 ? 1.0272 0.6363 0.7327 0.1335 0.1045 0.0116 287 ALA A O 2304 C CB . ALA A 288 ? 1.0355 0.5965 0.7121 0.1006 0.0912 -0.0096 287 ALA A CB 2305 N N . THR A 289 ? 1.0644 0.6040 0.7307 0.1264 0.1251 -0.0045 288 THR A N 2306 C CA . THR A 289 ? 1.0819 0.6188 0.7577 0.1457 0.1449 0.0069 288 THR A CA 2307 C C . THR A 289 ? 1.0982 0.6304 0.7645 0.1503 0.1542 0.0033 288 THR A C 2308 O O . THR A 289 ? 1.1274 0.6696 0.8076 0.1674 0.1679 0.0149 288 THR A O 2309 C CB . THR A 289 ? 1.1243 0.6208 0.7910 0.1515 0.1651 0.0084 288 THR A CB 2310 O OG1 . THR A 289 ? 1.1510 0.6040 0.7862 0.1376 0.1718 -0.0086 288 THR A OG1 2311 C CG2 . THR A 289 ? 1.1136 0.6153 0.7919 0.1493 0.1588 0.0147 288 THR A CG2 2312 N N . MET A 290 ? 1.0927 0.6108 0.7360 0.1357 0.1475 -0.0114 289 MET A N 2313 C CA . MET A 290 ? 1.1086 0.6154 0.7375 0.1382 0.1580 -0.0165 289 MET A CA 2314 C C . MET A 290 ? 1.0726 0.6209 0.7221 0.1459 0.1520 -0.0075 289 MET A C 2315 O O . MET A 290 ? 1.0484 0.6238 0.7050 0.1375 0.1330 -0.0085 289 MET A O 2316 C CB . MET A 290 ? 1.1471 0.6310 0.7449 0.1189 0.1499 -0.0338 289 MET A CB 2317 C CG . MET A 290 ? 1.1900 0.6533 0.7657 0.1192 0.1628 -0.0412 289 MET A CG 2318 S SD . MET A 290 ? 1.2471 0.6917 0.7867 0.0953 0.1488 -0.0595 289 MET A SD 2319 C CE . MET A 290 ? 1.2537 0.6759 0.7697 0.0994 0.1679 -0.0653 289 MET A CE 2320 N N . PRO A 291 ? 1.0823 0.6356 0.7416 0.1618 0.1691 0.0011 290 PRO A N 2321 C CA . PRO A 291 ? 1.0508 0.6450 0.7306 0.1680 0.1647 0.0097 290 PRO A CA 2322 C C . PRO A 291 ? 1.0592 0.6488 0.7198 0.1567 0.1596 -0.0015 290 PRO A C 2323 O O . PRO A 291 ? 1.1067 0.6606 0.7382 0.1475 0.1633 -0.0144 290 PRO A O 2324 C CB . PRO A 291 ? 1.0772 0.6727 0.7707 0.1882 0.1871 0.0220 290 PRO A CB 2325 C CG . PRO A 291 ? 1.1302 0.6731 0.7968 0.1888 0.2060 0.0129 290 PRO A CG 2326 C CD . PRO A 291 ? 1.1335 0.6523 0.7832 0.1736 0.1948 0.0023 290 PRO A CD 2327 N N . PRO A 292 ? 1.0141 0.6391 0.6896 0.1567 0.1517 0.0031 291 PRO A N 2328 C CA . PRO A 292 ? 0.9955 0.6152 0.6526 0.1465 0.1477 -0.0063 291 PRO A CA 2329 C C . PRO A 292 ? 1.0099 0.6065 0.6517 0.1529 0.1685 -0.0092 291 PRO A C 2330 O O . PRO A 292 ? 1.0281 0.6056 0.6447 0.1433 0.1680 -0.0196 291 PRO A O 2331 C CB . PRO A 292 ? 0.9647 0.6284 0.6446 0.1455 0.1365 0.0008 291 PRO A CB 2332 C CG . PRO A 292 ? 0.9538 0.6471 0.6642 0.1588 0.1409 0.0155 291 PRO A CG 2333 C CD . PRO A 292 ? 0.9727 0.6438 0.6805 0.1635 0.1449 0.0167 291 PRO A CD 2334 N N . GLY A 293 ? 1.0036 0.6021 0.6602 0.1695 0.1871 0.0006 292 GLY A N 2335 C CA . GLY A 293 ? 1.0320 0.6064 0.6749 0.1775 0.2098 -0.0016 292 GLY A CA 2336 C C . GLY A 293 ? 1.0230 0.6232 0.6751 0.1801 0.2138 0.0023 292 GLY A C 2337 O O . GLY A 293 ? 1.0442 0.6225 0.6774 0.1810 0.2288 -0.0034 292 GLY A O 2338 N N . VAL A 294 ? 0.9880 0.6345 0.6680 0.1802 0.2010 0.0118 293 VAL A N 2339 C CA . VAL A 294 ? 0.9642 0.6417 0.6584 0.1821 0.2046 0.0173 293 VAL A CA 2340 C C . VAL A 294 ? 0.9362 0.6632 0.6698 0.1924 0.2025 0.0340 293 VAL A C 2341 O O . VAL A 294 ? 0.9287 0.6666 0.6761 0.1958 0.1945 0.0402 293 VAL A O 2342 C CB . VAL A 294 ? 0.9557 0.6394 0.6372 0.1645 0.1878 0.0085 293 VAL A CB 2343 C CG1 . VAL A 294 ? 0.9814 0.6206 0.6238 0.1537 0.1872 -0.0064 293 VAL A CG1 2344 C CG2 . VAL A 294 ? 0.9271 0.6372 0.6234 0.1560 0.1656 0.0106 293 VAL A CG2 2345 N N . GLN A 295 ? 0.9346 0.6930 0.6860 0.1968 0.2097 0.0415 294 GLN A N 2346 C CA . GLN A 295 ? 0.9154 0.7273 0.7040 0.2037 0.2057 0.0572 294 GLN A CA 2347 C C . GLN A 295 ? 0.8869 0.7211 0.6809 0.1889 0.1814 0.0546 294 GLN A C 2348 O O . GLN A 295 ? 0.8971 0.7254 0.6761 0.1732 0.1706 0.0440 294 GLN A O 2349 C CB . GLN A 295 ? 0.9122 0.7556 0.7170 0.2064 0.2157 0.0635 294 GLN A CB 2350 C CG . GLN A 295 ? 0.8936 0.7976 0.7371 0.2113 0.2106 0.0798 294 GLN A CG 2351 C CD . GLN A 295 ? 0.8979 0.8358 0.7599 0.2142 0.2219 0.0870 294 GLN A CD 2352 O OE1 . GLN A 295 ? 0.8847 0.8556 0.7563 0.2003 0.2115 0.0861 294 GLN A OE1 2353 N NE2 . GLN A 295 ? 0.9288 0.8582 0.7960 0.2319 0.2446 0.0943 294 GLN A NE2 2354 N N . LEU A 296 ? 0.8814 0.7381 0.6950 0.1946 0.1742 0.0645 295 LEU A N 2355 C CA . LEU A 296 ? 0.8715 0.7428 0.6873 0.1816 0.1529 0.0614 295 LEU A CA 2356 C C . LEU A 296 ? 0.8320 0.7595 0.6796 0.1833 0.1459 0.0751 295 LEU A C 2357 O O . LEU A 296 ? 0.8231 0.7725 0.6921 0.1990 0.1544 0.0902 295 LEU A O 2358 C CB . LEU A 296 ? 0.8906 0.7315 0.6949 0.1839 0.1490 0.0586 295 LEU A CB 2359 C CG . LEU A 296 ? 0.8828 0.7359 0.6896 0.1728 0.1290 0.0562 295 LEU A CG 2360 C CD1 . LEU A 296 ? 0.8823 0.7297 0.6735 0.1546 0.1159 0.0430 295 LEU A CD1 2361 C CD2 . LEU A 296 ? 0.9012 0.7226 0.6972 0.1762 0.1285 0.0541 295 LEU A CD2 2362 N N . HIS A 297 ? 0.8092 0.7599 0.6591 0.1669 0.1312 0.0701 296 HIS A N 2363 C CA . HIS A 297 ? 0.7840 0.7871 0.6592 0.1633 0.1217 0.0801 296 HIS A CA 2364 C C . HIS A 297 ? 0.7739 0.7731 0.6417 0.1518 0.1044 0.0739 296 HIS A C 2365 O O . HIS A 297 ? 0.7582 0.7422 0.6098 0.1366 0.0957 0.0611 296 HIS A O 2366 C CB . HIS A 297 ? 0.7713 0.8048 0.6546 0.1517 0.1213 0.0786 296 HIS A CB 2367 C CG . HIS A 297 ? 0.7990 0.8367 0.6896 0.1621 0.1390 0.0842 296 HIS A CG 2368 N ND1 . HIS A 297 ? 0.8009 0.8868 0.7211 0.1708 0.1458 0.0996 296 HIS A ND1 2369 C CD2 . HIS A 297 ? 0.8197 0.8203 0.6915 0.1652 0.1518 0.0767 296 HIS A CD2 2370 C CE1 . HIS A 297 ? 0.8187 0.8966 0.7394 0.1795 0.1628 0.1014 296 HIS A CE1 2371 N NE2 . HIS A 297 ? 0.8363 0.8614 0.7266 0.1760 0.1671 0.0872 296 HIS A NE2 2372 N N . CYS A 298 ? 0.7840 0.7954 0.6632 0.1602 0.1008 0.0836 297 CYS A N 2373 C CA A CYS A 298 ? 0.7659 0.7741 0.6391 0.1508 0.0859 0.0788 297 CYS A CA 2374 C CA B CYS A 298 ? 0.7854 0.7937 0.6588 0.1509 0.0860 0.0790 297 CYS A CA 2375 C C . CYS A 298 ? 0.7411 0.7995 0.6321 0.1419 0.0750 0.0850 297 CYS A C 2376 O O . CYS A 298 ? 0.7194 0.8127 0.6306 0.1513 0.0759 0.1002 297 CYS A O 2377 C CB A CYS A 298 ? 0.7763 0.7639 0.6482 0.1634 0.0886 0.0848 297 CYS A CB 2378 C CB B CYS A 298 ? 0.8170 0.8067 0.6903 0.1643 0.0891 0.0858 297 CYS A CB 2379 S SG A CYS A 298 ? 0.8051 0.7300 0.6517 0.1697 0.1004 0.0748 297 CYS A SG 2380 S SG B CYS A 298 ? 0.8706 0.8389 0.7295 0.1534 0.0742 0.0764 297 CYS A SG 2381 N N . LEU A 299 ? 0.7128 0.7739 0.5949 0.1234 0.0653 0.0734 298 LEU A N 2382 C CA . LEU A 299 ? 0.6971 0.8014 0.5910 0.1108 0.0552 0.0758 298 LEU A CA 2383 C C . LEU A 299 ? 0.6883 0.7826 0.5727 0.1028 0.0434 0.0699 298 LEU A C 2384 O O . LEU A 299 ? 0.7130 0.7717 0.5786 0.0955 0.0399 0.0570 298 LEU A O 2385 C CB . LEU A 299 ? 0.7045 0.8186 0.5949 0.0945 0.0549 0.0668 298 LEU A CB 2386 C CG . LEU A 299 ? 0.7129 0.8604 0.6211 0.0980 0.0641 0.0757 298 LEU A CG 2387 C CD1 . LEU A 299 ? 0.7253 0.8480 0.6326 0.1163 0.0785 0.0802 298 LEU A CD1 2388 C CD2 . LEU A 299 ? 0.7137 0.8681 0.6163 0.0787 0.0634 0.0653 298 LEU A CD2 2389 N N . TYR A 300 ? 0.6733 0.8005 0.5709 0.1046 0.0374 0.0802 299 TYR A N 2390 C CA . TYR A 300 ? 0.6628 0.7816 0.5522 0.0987 0.0276 0.0761 299 TYR A CA 2391 C C . TYR A 300 ? 0.6419 0.8070 0.5412 0.0876 0.0187 0.0807 299 TYR A C 2392 O O . TYR A 300 ? 0.6384 0.8462 0.5559 0.0922 0.0196 0.0942 299 TYR A O 2393 C CB . TYR A 300 ? 0.6690 0.7679 0.5590 0.1152 0.0308 0.0844 299 TYR A CB 2394 C CG . TYR A 300 ? 0.6781 0.8083 0.5884 0.1313 0.0364 0.1039 299 TYR A CG 2395 C CD1 . TYR A 300 ? 0.6989 0.8271 0.6178 0.1458 0.0491 0.1119 299 TYR A CD1 2396 C CD2 . TYR A 300 ? 0.6822 0.8440 0.6026 0.1330 0.0298 0.1155 299 TYR A CD2 2397 C CE1 . TYR A 300 ? 0.7123 0.8694 0.6513 0.1628 0.0557 0.1316 299 TYR A CE1 2398 C CE2 . TYR A 300 ? 0.6959 0.8880 0.6356 0.1494 0.0350 0.1358 299 TYR A CE2 2399 C CZ . TYR A 300 ? 0.7117 0.9013 0.6614 0.1650 0.0482 0.1442 299 TYR A CZ 2400 O OH . TYR A 300 ? 0.7361 0.9561 0.7065 0.1833 0.0546 0.1660 299 TYR A OH 2401 N N . GLY A 301 ? 0.6414 0.7990 0.5283 0.0725 0.0106 0.0694 300 GLY A N 2402 C CA . GLY A 301 ? 0.6322 0.8292 0.5235 0.0594 0.0022 0.0714 300 GLY A CA 2403 C C . GLY A 301 ? 0.6230 0.8340 0.5200 0.0681 -0.0022 0.0830 300 GLY A C 2404 O O . GLY A 301 ? 0.6214 0.8001 0.5121 0.0780 -0.0009 0.0830 300 GLY A O 2405 N N . THR A 302 ? 0.6242 0.8846 0.5324 0.0631 -0.0078 0.0930 301 THR A N 2406 C CA . THR A 302 ? 0.6274 0.9059 0.5384 0.0679 -0.0134 0.1039 301 THR A CA 2407 C C . THR A 302 ? 0.6439 0.9581 0.5502 0.0469 -0.0228 0.0994 301 THR A C 2408 O O . THR A 302 ? 0.6500 0.9777 0.5532 0.0296 -0.0241 0.0894 301 THR A O 2409 C CB . THR A 302 ? 0.6299 0.9381 0.5613 0.0882 -0.0099 0.1270 301 THR A CB 2410 O OG1 . THR A 302 ? 0.6336 0.9944 0.5809 0.0835 -0.0118 0.1358 301 THR A OG1 2411 C CG2 . THR A 302 ? 0.6438 0.9140 0.5780 0.1082 0.0016 0.1305 301 THR A CG2 2412 N N . GLY A 303 ? 0.6455 0.9733 0.5496 0.0476 -0.0285 0.1063 302 GLY A N 2413 C CA . GLY A 303 ? 0.6402 1.0056 0.5386 0.0283 -0.0373 0.1040 302 GLY A CA 2414 C C . GLY A 303 ? 0.6585 0.9961 0.5352 0.0081 -0.0388 0.0822 302 GLY A C 2415 O O . GLY A 303 ? 0.6847 1.0486 0.5532 -0.0119 -0.0441 0.0758 302 GLY A O 2416 N N . VAL A 304 ? 0.6494 0.9345 0.5163 0.0130 -0.0337 0.0710 303 VAL A N 2417 C CA . VAL A 304 ? 0.6469 0.9021 0.4947 -0.0020 -0.0335 0.0524 303 VAL A CA 2418 C C . VAL A 304 ? 0.6474 0.8746 0.4898 0.0081 -0.0335 0.0538 303 VAL A C 2419 O O . VAL A 304 ? 0.6510 0.8535 0.4991 0.0251 -0.0300 0.0595 303 VAL A O 2420 C CB . VAL A 304 ? 0.6427 0.8624 0.4840 -0.0062 -0.0275 0.0382 303 VAL A CB 2421 C CG1 . VAL A 304 ? 0.6342 0.8240 0.4566 -0.0205 -0.0260 0.0207 303 VAL A CG1 2422 C CG2 . VAL A 304 ? 0.6488 0.8961 0.4971 -0.0152 -0.0264 0.0382 303 VAL A CG2 2423 N N . PRO A 305 ? 0.6537 0.8849 0.4845 -0.0030 -0.0366 0.0484 304 PRO A N 2424 C CA . PRO A 305 ? 0.6478 0.8536 0.4745 0.0060 -0.0358 0.0499 304 PRO A CA 2425 C C . PRO A 305 ? 0.6213 0.7783 0.4443 0.0125 -0.0308 0.0400 304 PRO A C 2426 O O . PRO A 305 ? 0.6360 0.7742 0.4500 0.0023 -0.0283 0.0260 304 PRO A O 2427 C CB . PRO A 305 ? 0.6546 0.8689 0.4663 -0.0111 -0.0381 0.0409 304 PRO A CB 2428 C CG . PRO A 305 ? 0.6611 0.9156 0.4709 -0.0276 -0.0417 0.0397 304 PRO A CG 2429 C CD . PRO A 305 ? 0.6622 0.9162 0.4812 -0.0257 -0.0394 0.0387 304 PRO A CD 2430 N N . THR A 306 ? 0.6005 0.7383 0.4302 0.0290 -0.0291 0.0480 305 THR A N 2431 C CA . THR A 306 ? 0.6033 0.6998 0.4308 0.0358 -0.0254 0.0409 305 THR A CA 2432 C C . THR A 306 ? 0.6108 0.6867 0.4360 0.0412 -0.0252 0.0418 305 THR A C 2433 O O . THR A 306 ? 0.5942 0.6789 0.4255 0.0503 -0.0254 0.0540 305 THR A O 2434 C CB . THR A 306 ? 0.6124 0.7034 0.4495 0.0495 -0.0221 0.0490 305 THR A CB 2435 O OG1 . THR A 306 ? 0.6019 0.7203 0.4443 0.0453 -0.0220 0.0514 305 THR A OG1 2436 C CG2 . THR A 306 ? 0.6052 0.6558 0.4370 0.0533 -0.0189 0.0399 305 THR A CG2 2437 N N . PRO A 307 ? 0.6325 0.6819 0.4497 0.0358 -0.0242 0.0297 306 PRO A N 2438 C CA . PRO A 307 ? 0.6422 0.6738 0.4592 0.0403 -0.0238 0.0304 306 PRO A CA 2439 C C . PRO A 307 ? 0.6518 0.6700 0.4763 0.0542 -0.0224 0.0398 306 PRO A C 2440 O O . PRO A 307 ? 0.6763 0.6788 0.5024 0.0598 -0.0207 0.0388 306 PRO A O 2441 C CB . PRO A 307 ? 0.6430 0.6473 0.4536 0.0354 -0.0223 0.0172 306 PRO A CB 2442 C CG . PRO A 307 ? 0.6562 0.6695 0.4597 0.0239 -0.0214 0.0088 306 PRO A CG 2443 C CD . PRO A 307 ? 0.6494 0.6841 0.4584 0.0261 -0.0226 0.0160 306 PRO A CD 2444 N N . ASP A 308 ? 0.6865 0.7099 0.5141 0.0586 -0.0222 0.0486 307 ASP A N 2445 C CA . ASP A 308 ? 0.7004 0.7115 0.5340 0.0709 -0.0191 0.0587 307 ASP A CA 2446 C C . ASP A 308 ? 0.6739 0.6628 0.5064 0.0707 -0.0180 0.0561 307 ASP A C 2447 O O . ASP A 308 ? 0.6715 0.6375 0.5058 0.0769 -0.0152 0.0574 307 ASP A O 2448 C CB . ASP A 308 ? 0.7591 0.7986 0.5984 0.0773 -0.0185 0.0745 307 ASP A CB 2449 C CG . ASP A 308 ? 0.8233 0.8508 0.6669 0.0884 -0.0139 0.0861 307 ASP A CG 2450 O OD1 . ASP A 308 ? 0.9438 0.9520 0.7907 0.0979 -0.0089 0.0893 307 ASP A OD1 2451 O OD2 . ASP A 308 ? 0.7914 0.8273 0.6339 0.0871 -0.0143 0.0917 307 ASP A OD2 2452 N N . SER A 309 ? 0.6476 0.6429 0.4766 0.0628 -0.0196 0.0517 308 SER A N 2453 C CA . SER A 309 ? 0.6274 0.6063 0.4571 0.0620 -0.0183 0.0497 308 SER A CA 2454 C C . SER A 309 ? 0.6233 0.6108 0.4482 0.0523 -0.0189 0.0424 308 SER A C 2455 O O . SER A 309 ? 0.6075 0.6140 0.4267 0.0459 -0.0200 0.0401 308 SER A O 2456 C CB . SER A 309 ? 0.6150 0.5947 0.4487 0.0692 -0.0150 0.0628 308 SER A CB 2457 O OG . SER A 309 ? 0.6145 0.6216 0.4479 0.0713 -0.0154 0.0738 308 SER A OG 2458 N N . PHE A 310 ? 0.6217 0.5951 0.4486 0.0508 -0.0174 0.0387 309 PHE A N 2459 C CA . PHE A 310 ? 0.6376 0.6122 0.4608 0.0431 -0.0160 0.0300 309 PHE A CA 2460 C C . PHE A 310 ? 0.6457 0.6192 0.4722 0.0428 -0.0130 0.0337 309 PHE A C 2461 O O . PHE A 310 ? 0.6382 0.6001 0.4715 0.0472 -0.0124 0.0384 309 PHE A O 2462 C CB . PHE A 310 ? 0.6366 0.5934 0.4609 0.0418 -0.0166 0.0196 309 PHE A CB 2463 C CG . PHE A 310 ? 0.6331 0.5877 0.4541 0.0424 -0.0188 0.0163 309 PHE A CG 2464 C CD1 . PHE A 310 ? 0.6396 0.6039 0.4529 0.0357 -0.0179 0.0105 309 PHE A CD1 2465 C CD2 . PHE A 310 ? 0.6498 0.5919 0.4741 0.0485 -0.0208 0.0186 309 PHE A CD2 2466 C CE1 . PHE A 310 ? 0.6531 0.6159 0.4638 0.0354 -0.0192 0.0077 309 PHE A CE1 2467 C CE2 . PHE A 310 ? 0.6551 0.5953 0.4760 0.0491 -0.0219 0.0159 309 PHE A CE2 2468 C CZ . PHE A 310 ? 0.6582 0.6094 0.4731 0.0427 -0.0212 0.0109 309 PHE A CZ 2469 N N . TYR A 311 ? 0.6623 0.6467 0.4827 0.0363 -0.0101 0.0305 310 TYR A N 2470 C CA . TYR A 311 ? 0.6778 0.6602 0.5010 0.0348 -0.0058 0.0315 310 TYR A CA 2471 C C . TYR A 311 ? 0.6667 0.6402 0.4903 0.0306 -0.0022 0.0203 310 TYR A C 2472 O O . TYR A 311 ? 0.6774 0.6543 0.4919 0.0250 0.0001 0.0126 310 TYR A O 2473 C CB . TYR A 311 ? 0.6967 0.6982 0.5118 0.0314 -0.0035 0.0382 310 TYR A CB 2474 C CG . TYR A 311 ? 0.7342 0.7325 0.5521 0.0300 0.0020 0.0396 310 TYR A CG 2475 C CD1 . TYR A 311 ? 0.7579 0.7514 0.5833 0.0349 0.0031 0.0497 310 TYR A CD1 2476 C CD2 . TYR A 311 ? 0.7607 0.7591 0.5738 0.0236 0.0076 0.0306 310 TYR A CD2 2477 C CE1 . TYR A 311 ? 0.7899 0.7812 0.6186 0.0328 0.0088 0.0510 310 TYR A CE1 2478 C CE2 . TYR A 311 ? 0.7839 0.7804 0.6008 0.0226 0.0138 0.0320 310 TYR A CE2 2479 C CZ . TYR A 311 ? 0.8310 0.8251 0.6561 0.0269 0.0138 0.0424 310 TYR A CZ 2480 O OH . TYR A 311 ? 0.9239 0.9173 0.7534 0.0252 0.0204 0.0441 310 TYR A OH 2481 N N . TYR A 312 ? 0.6692 0.6311 0.5038 0.0335 -0.0011 0.0200 311 TYR A N 2482 C CA . TYR A 312 ? 0.6983 0.6536 0.5373 0.0322 0.0033 0.0126 311 TYR A CA 2483 C C . TYR A 312 ? 0.7469 0.7070 0.5911 0.0309 0.0089 0.0162 311 TYR A C 2484 O O . TYR A 312 ? 0.7518 0.7119 0.6033 0.0326 0.0077 0.0238 311 TYR A O 2485 C CB . TYR A 312 ? 0.6733 0.6158 0.5234 0.0365 -0.0006 0.0107 311 TYR A CB 2486 C CG . TYR A 312 ? 0.6509 0.5860 0.4959 0.0378 -0.0043 0.0056 311 TYR A CG 2487 C CD1 . TYR A 312 ? 0.6350 0.5692 0.4760 0.0394 -0.0097 0.0086 311 TYR A CD1 2488 C CD2 . TYR A 312 ? 0.6454 0.5733 0.4900 0.0381 -0.0012 -0.0013 311 TYR A CD2 2489 C CE1 . TYR A 312 ? 0.6334 0.5611 0.4696 0.0401 -0.0122 0.0041 311 TYR A CE1 2490 C CE2 . TYR A 312 ? 0.6408 0.5605 0.4799 0.0390 -0.0038 -0.0053 311 TYR A CE2 2491 C CZ . TYR A 312 ? 0.6389 0.5592 0.4737 0.0395 -0.0095 -0.0028 311 TYR A CZ 2492 O OH . TYR A 312 ? 0.6513 0.5638 0.4804 0.0399 -0.0113 -0.0067 311 TYR A OH 2493 N N . GLU A 313 ? 0.8229 0.7846 0.6634 0.0277 0.0164 0.0103 312 GLU A N 2494 C CA . GLU A 313 ? 0.9025 0.8681 0.7484 0.0266 0.0238 0.0124 312 GLU A CA 2495 C C . GLU A 313 ? 0.9397 0.8997 0.8050 0.0309 0.0235 0.0132 312 GLU A C 2496 O O . GLU A 313 ? 0.9433 0.9075 0.8183 0.0306 0.0265 0.0181 312 GLU A O 2497 C CB . GLU A 313 ? 0.9518 0.9184 0.7872 0.0221 0.0339 0.0045 312 GLU A CB 2498 C CG . GLU A 313 ? 1.0492 1.0244 0.8635 0.0147 0.0349 0.0019 312 GLU A CG 2499 C CD . GLU A 313 ? 1.1193 1.0913 0.9209 0.0085 0.0465 -0.0080 312 GLU A CD 2500 O OE1 . GLU A 313 ? 1.1388 1.0975 0.9457 0.0115 0.0527 -0.0150 312 GLU A OE1 2501 O OE2 . GLU A 313 ? 1.2069 1.1891 0.9922 0.0008 0.0502 -0.0086 312 GLU A OE2 2502 N N . SER A 314 ? 0.9721 0.9240 0.8427 0.0345 0.0200 0.0089 313 SER A N 2503 C CA . SER A 314 ? 0.9515 0.9015 0.8402 0.0382 0.0161 0.0113 313 SER A CA 2504 C C . SER A 314 ? 0.9067 0.8481 0.7936 0.0416 0.0105 0.0074 313 SER A C 2505 O O . SER A 314 ? 0.8699 0.8068 0.7429 0.0404 0.0103 0.0035 313 SER A O 2506 C CB . SER A 314 ? 0.9610 0.9164 0.8630 0.0400 0.0244 0.0111 313 SER A CB 2507 O OG . SER A 314 ? 1.0022 0.9526 0.8987 0.0425 0.0324 0.0047 313 SER A OG 2508 N N . PHE A 315 ? 0.9036 0.8439 0.8041 0.0450 0.0059 0.0088 314 PHE A N 2509 C CA . PHE A 315 ? 0.9362 0.8684 0.8352 0.0495 0.0028 0.0055 314 PHE A CA 2510 C C . PHE A 315 ? 1.0078 0.9427 0.9187 0.0549 0.0098 0.0054 314 PHE A C 2511 O O . PHE A 315 ? 1.0008 0.9463 0.9282 0.0558 0.0095 0.0101 314 PHE A O 2512 C CB . PHE A 315 ? 0.9018 0.8308 0.8045 0.0500 -0.0081 0.0078 314 PHE A CB 2513 C CG . PHE A 315 ? 0.8870 0.8116 0.7804 0.0463 -0.0135 0.0089 314 PHE A CG 2514 C CD1 . PHE A 315 ? 0.8832 0.8012 0.7619 0.0462 -0.0142 0.0062 314 PHE A CD1 2515 C CD2 . PHE A 315 ? 0.8538 0.7799 0.7538 0.0429 -0.0174 0.0129 314 PHE A CD2 2516 C CE1 . PHE A 315 ? 0.8396 0.7541 0.7117 0.0449 -0.0181 0.0087 314 PHE A CE1 2517 C CE2 . PHE A 315 ? 0.8566 0.7753 0.7481 0.0409 -0.0204 0.0145 314 PHE A CE2 2518 C CZ . PHE A 315 ? 0.8651 0.7785 0.7434 0.0429 -0.0206 0.0129 314 PHE A CZ 2519 N N . PRO A 316 ? 1.0929 1.0185 0.9964 0.0584 0.0170 0.0008 315 PRO A N 2520 C CA . PRO A 316 ? 1.1462 1.0598 1.0307 0.0558 0.0175 -0.0051 315 PRO A CA 2521 C C . PRO A 316 ? 1.1989 1.1104 1.0679 0.0497 0.0274 -0.0113 315 PRO A C 2522 O O . PRO A 316 ? 1.3323 1.2416 1.2014 0.0506 0.0389 -0.0141 315 PRO A O 2523 C CB . PRO A 316 ? 1.1406 1.0439 1.0274 0.0630 0.0208 -0.0060 315 PRO A CB 2524 C CG . PRO A 316 ? 1.1224 1.0315 1.0249 0.0691 0.0295 -0.0027 315 PRO A CG 2525 C CD . PRO A 316 ? 1.0930 1.0187 1.0085 0.0661 0.0253 0.0021 315 PRO A CD 2526 N N . ASP A 317 ? 1.1953 1.1079 1.0499 0.0433 0.0233 -0.0135 316 ASP A N 2527 C CA . ASP A 317 ? 1.1879 1.1038 1.0269 0.0354 0.0301 -0.0184 316 ASP A CA 2528 C C . ASP A 317 ? 1.2043 1.1094 1.0277 0.0312 0.0338 -0.0265 316 ASP A C 2529 O O . ASP A 317 ? 1.1347 1.0383 0.9547 0.0308 0.0261 -0.0261 316 ASP A O 2530 C CB . ASP A 317 ? 1.1880 1.1169 1.0229 0.0311 0.0224 -0.0133 316 ASP A CB 2531 C CG . ASP A 317 ? 1.1859 1.1246 1.0083 0.0236 0.0285 -0.0148 316 ASP A CG 2532 O OD1 . ASP A 317 ? 1.3071 1.2410 1.1204 0.0195 0.0389 -0.0223 316 ASP A OD1 2533 O OD2 . ASP A 317 ? 1.1259 1.0767 0.9467 0.0218 0.0233 -0.0083 316 ASP A OD2 2534 N N . ARG A 318 ? 1.3265 1.2232 1.1399 0.0273 0.0464 -0.0341 317 ARG A N 2535 C CA . ARG A 318 ? 1.4464 1.3299 1.2429 0.0209 0.0523 -0.0433 317 ARG A CA 2536 C C . ARG A 318 ? 1.4166 1.3109 1.2010 0.0118 0.0436 -0.0446 317 ARG A C 2537 O O . ARG A 318 ? 1.3773 1.2652 1.1577 0.0108 0.0401 -0.0466 317 ARG A O 2538 C CB . ARG A 318 ? 1.5379 1.4124 1.3205 0.0141 0.0683 -0.0526 317 ARG A CB 2539 C CG . ARG A 318 ? 1.6155 1.4754 1.4085 0.0241 0.0805 -0.0524 317 ARG A CG 2540 C CD . ARG A 318 ? 1.7183 1.5625 1.4937 0.0169 0.0990 -0.0635 317 ARG A CD 2541 N NE . ARG A 318 ? 1.7843 1.6204 1.5714 0.0269 0.1122 -0.0615 317 ARG A NE 2542 C CZ . ARG A 318 ? 1.8190 1.6422 1.5936 0.0228 0.1305 -0.0699 317 ARG A CZ 2543 N NH1 . ARG A 318 ? 1.8474 1.6639 1.5951 0.0069 0.1373 -0.0819 317 ARG A NH1 2544 N NH2 . ARG A 318 ? 1.8049 1.6228 1.5938 0.0342 0.1426 -0.0662 317 ARG A NH2 2545 N N . ASP A 319 ? 1.3280 1.2399 1.1066 0.0052 0.0411 -0.0427 318 ASP A N 2546 C CA . ASP A 319 ? 1.2548 1.1829 1.0250 -0.0019 0.0328 -0.0411 318 ASP A CA 2547 C C . ASP A 319 ? 1.0901 1.0328 0.8729 0.0047 0.0234 -0.0293 318 ASP A C 2548 O O . ASP A 319 ? 1.1318 1.0835 0.9144 0.0036 0.0256 -0.0260 318 ASP A O 2549 C CB . ASP A 319 ? 1.3148 1.2522 1.0655 -0.0160 0.0394 -0.0483 318 ASP A CB 2550 C CG . ASP A 319 ? 1.3465 1.3081 1.0890 -0.0245 0.0305 -0.0451 318 ASP A CG 2551 O OD1 . ASP A 319 ? 1.3921 1.3537 1.1307 -0.0287 0.0275 -0.0484 318 ASP A OD1 2552 O OD2 . ASP A 319 ? 1.2685 1.2502 1.0084 -0.0270 0.0271 -0.0388 318 ASP A OD2 2553 N N . PRO A 320 ? 0.9169 0.8613 0.7085 0.0110 0.0137 -0.0228 319 PRO A N 2554 C CA . PRO A 320 ? 0.8396 0.7993 0.6370 0.0143 0.0065 -0.0119 319 PRO A CA 2555 C C . PRO A 320 ? 0.7743 0.7550 0.5612 0.0075 0.0033 -0.0091 319 PRO A C 2556 O O . PRO A 320 ? 0.7793 0.7628 0.5564 0.0001 0.0040 -0.0157 319 PRO A O 2557 C CB . PRO A 320 ? 0.8306 0.7817 0.6387 0.0227 -0.0003 -0.0075 319 PRO A CB 2558 C CG . PRO A 320 ? 0.8485 0.7892 0.6510 0.0206 0.0006 -0.0151 319 PRO A CG 2559 C CD . PRO A 320 ? 0.8867 0.8184 0.6826 0.0158 0.0101 -0.0240 319 PRO A CD 2560 N N . LYS A 321 ? 0.7177 0.7133 0.5065 0.0094 0.0006 0.0006 320 LYS A N 2561 C CA . LYS A 321 ? 0.6933 0.7134 0.4744 0.0048 -0.0033 0.0065 320 LYS A CA 2562 C C . LYS A 321 ? 0.6794 0.7026 0.4688 0.0123 -0.0099 0.0139 320 LYS A C 2563 O O . LYS A 321 ? 0.6475 0.6560 0.4479 0.0217 -0.0112 0.0180 320 LYS A O 2564 C CB . LYS A 321 ? 0.6908 0.7256 0.4697 0.0049 -0.0025 0.0157 320 LYS A CB 2565 C CG . LYS A 321 ? 0.7046 0.7307 0.4789 0.0007 0.0055 0.0095 320 LYS A CG 2566 C CD . LYS A 321 ? 0.7272 0.7566 0.4841 -0.0124 0.0110 -0.0028 320 LYS A CD 2567 C CE . LYS A 321 ? 0.7516 0.7650 0.5056 -0.0146 0.0216 -0.0111 320 LYS A CE 2568 N NZ . LYS A 321 ? 0.7843 0.7883 0.5236 -0.0253 0.0292 -0.0259 320 LYS A NZ 2569 N N . ILE A 322 ? 0.6751 0.7174 0.4597 0.0079 -0.0135 0.0155 321 ILE A N 2570 C CA . ILE A 322 ? 0.6536 0.6970 0.4465 0.0153 -0.0179 0.0212 321 ILE A CA 2571 C C . ILE A 322 ? 0.6530 0.7243 0.4486 0.0190 -0.0220 0.0353 321 ILE A C 2572 O O . ILE A 322 ? 0.6622 0.7601 0.4498 0.0103 -0.0237 0.0370 321 ILE A O 2573 C CB . ILE A 322 ? 0.6604 0.6998 0.4488 0.0086 -0.0177 0.0109 321 ILE A CB 2574 C CG1 . ILE A 322 ? 0.6659 0.6771 0.4518 0.0069 -0.0128 -0.0011 321 ILE A CG1 2575 C CG2 . ILE A 322 ? 0.6627 0.7030 0.4597 0.0168 -0.0212 0.0170 321 ILE A CG2 2576 C CD1 . ILE A 322 ? 0.6994 0.7005 0.4810 0.0021 -0.0113 -0.0101 321 ILE A CD1 2577 N N . CYS A 323 ? 0.6302 0.6953 0.4366 0.0318 -0.0231 0.0457 322 CYS A N 2578 C CA . CYS A 323 ? 0.6277 0.7163 0.4399 0.0393 -0.0255 0.0611 322 CYS A CA 2579 C C . CYS A 323 ? 0.6334 0.7250 0.4508 0.0423 -0.0269 0.0607 322 CYS A C 2580 O O . CYS A 323 ? 0.6477 0.7136 0.4681 0.0463 -0.0252 0.0544 322 CYS A O 2581 C CB . CYS A 323 ? 0.6399 0.7154 0.4600 0.0524 -0.0228 0.0732 322 CYS A CB 2582 S SG . CYS A 323 ? 0.6480 0.7329 0.4639 0.0519 -0.0210 0.0823 322 CYS A SG 2583 N N . PHE A 324 ? 0.6281 0.7528 0.4467 0.0401 -0.0301 0.0679 323 PHE A N 2584 C CA . PHE A 324 ? 0.6197 0.7523 0.4436 0.0408 -0.0310 0.0671 323 PHE A CA 2585 C C . PHE A 324 ? 0.6258 0.7754 0.4623 0.0554 -0.0305 0.0850 323 PHE A C 2586 O O . PHE A 324 ? 0.6202 0.7948 0.4594 0.0597 -0.0322 0.0992 323 PHE A O 2587 C CB . PHE A 324 ? 0.6189 0.7800 0.4354 0.0244 -0.0344 0.0601 323 PHE A CB 2588 C CG . PHE A 324 ? 0.6143 0.7553 0.4179 0.0102 -0.0323 0.0415 323 PHE A CG 2589 C CD1 . PHE A 324 ? 0.6099 0.7292 0.4124 0.0074 -0.0297 0.0301 323 PHE A CD1 2590 C CD2 . PHE A 324 ? 0.6082 0.7507 0.4004 0.0004 -0.0316 0.0359 323 PHE A CD2 2591 C CE1 . PHE A 324 ? 0.6122 0.7112 0.4032 -0.0037 -0.0262 0.0145 323 PHE A CE1 2592 C CE2 . PHE A 324 ? 0.6189 0.7404 0.3995 -0.0109 -0.0274 0.0193 323 PHE A CE2 2593 C CZ . PHE A 324 ? 0.6174 0.7169 0.3980 -0.0125 -0.0246 0.0091 323 PHE A CZ 2594 N N . GLY A 325 ? 0.6299 0.7666 0.4733 0.0633 -0.0276 0.0849 324 GLY A N 2595 C CA . GLY A 325 ? 0.6221 0.7762 0.4781 0.0770 -0.0254 0.1010 324 GLY A CA 2596 C C . GLY A 325 ? 0.6200 0.7924 0.4804 0.0725 -0.0262 0.0978 324 GLY A C 2597 O O . GLY A 325 ? 0.6217 0.8002 0.4746 0.0568 -0.0295 0.0848 324 GLY A O 2598 N N . ASP A 326 ? 0.6200 0.8001 0.4927 0.0863 -0.0220 0.1098 325 ASP A N 2599 C CA . ASP A 326 ? 0.6283 0.8296 0.5079 0.0833 -0.0218 0.1092 325 ASP A CA 2600 C C . ASP A 326 ? 0.6320 0.7952 0.5066 0.0833 -0.0169 0.0956 325 ASP A C 2601 O O . ASP A 326 ? 0.6412 0.7652 0.5104 0.0898 -0.0130 0.0911 325 ASP A O 2602 C CB . ASP A 326 ? 0.6418 0.8726 0.5386 0.0998 -0.0184 0.1304 325 ASP A CB 2603 C CG . ASP A 326 ? 0.6555 0.9320 0.5624 0.0930 -0.0216 0.1343 325 ASP A CG 2604 O OD1 . ASP A 326 ? 0.6463 0.9243 0.5459 0.0758 -0.0247 0.1190 325 ASP A OD1 2605 O OD2 . ASP A 326 ? 0.6711 0.9830 0.5940 0.1052 -0.0205 0.1537 325 ASP A OD2 2606 N N . GLY A 327 ? 0.6267 0.8030 0.5026 0.0749 -0.0171 0.0894 326 GLY A N 2607 C CA . GLY A 327 ? 0.6327 0.7771 0.5027 0.0735 -0.0126 0.0771 326 GLY A CA 2608 C C . GLY A 327 ? 0.6281 0.7867 0.4932 0.0557 -0.0152 0.0657 326 GLY A C 2609 O O . GLY A 327 ? 0.6299 0.8294 0.5007 0.0469 -0.0191 0.0701 326 GLY A O 2610 N N . ASP A 328 ? 0.6304 0.7556 0.4843 0.0497 -0.0129 0.0514 327 ASP A N 2611 C CA . ASP A 328 ? 0.6429 0.7738 0.4906 0.0334 -0.0129 0.0402 327 ASP A CA 2612 C C . ASP A 328 ? 0.6466 0.7582 0.4790 0.0193 -0.0151 0.0258 327 ASP A C 2613 O O . ASP A 328 ? 0.6534 0.7565 0.4775 0.0069 -0.0128 0.0148 327 ASP A O 2614 C CB . ASP A 328 ? 0.6668 0.7773 0.5139 0.0379 -0.0065 0.0367 327 ASP A CB 2615 C CG . ASP A 328 ? 0.6777 0.7407 0.5125 0.0426 -0.0044 0.0280 327 ASP A CG 2616 O OD1 . ASP A 328 ? 0.6905 0.7369 0.5187 0.0417 -0.0078 0.0241 327 ASP A OD1 2617 O OD2 . ASP A 328 ? 0.6986 0.7424 0.5304 0.0469 0.0005 0.0256 327 ASP A OD2 2618 N N . GLY A 329 ? 0.6558 0.7600 0.4848 0.0215 -0.0182 0.0265 328 GLY A N 2619 C CA . GLY A 329 ? 0.6575 0.7420 0.4734 0.0109 -0.0187 0.0142 328 GLY A CA 2620 C C . GLY A 329 ? 0.6765 0.7205 0.4875 0.0195 -0.0171 0.0098 328 GLY A C 2621 O O . GLY A 329 ? 0.7155 0.7456 0.5201 0.0164 -0.0177 0.0044 328 GLY A O 2622 N N . THR A 330 ? 0.6759 0.7024 0.4898 0.0300 -0.0147 0.0123 329 THR A N 2623 C CA . THR A 330 ? 0.6839 0.6745 0.4925 0.0368 -0.0139 0.0081 329 THR A CA 2624 C C . THR A 330 ? 0.6800 0.6634 0.4951 0.0512 -0.0130 0.0172 329 THR A C 2625 O O . THR A 330 ? 0.6925 0.6615 0.5075 0.0564 -0.0144 0.0187 329 THR A O 2626 C CB . THR A 330 ? 0.7074 0.6775 0.5078 0.0331 -0.0107 -0.0001 329 THR A CB 2627 O OG1 . THR A 330 ? 0.7491 0.7208 0.5421 0.0197 -0.0094 -0.0090 329 THR A OG1 2628 C CG2 . THR A 330 ? 0.7048 0.6419 0.4995 0.0399 -0.0111 -0.0031 329 THR A CG2 2629 N N . VAL A 331 ? 0.6719 0.6646 0.4925 0.0570 -0.0094 0.0231 330 VAL A N 2630 C CA . VAL A 331 ? 0.6814 0.6643 0.5067 0.0707 -0.0057 0.0314 330 VAL A CA 2631 C C . VAL A 331 ? 0.6736 0.6831 0.5107 0.0778 -0.0056 0.0448 330 VAL A C 2632 O O . VAL A 331 ? 0.6423 0.6857 0.4878 0.0758 -0.0061 0.0512 330 VAL A O 2633 C CB . VAL A 331 ? 0.7053 0.6830 0.5304 0.0751 0.0001 0.0316 330 VAL A CB 2634 C CG1 . VAL A 331 ? 0.7166 0.6849 0.5464 0.0897 0.0065 0.0406 330 VAL A CG1 2635 C CG2 . VAL A 331 ? 0.7206 0.6694 0.5323 0.0696 0.0002 0.0200 330 VAL A CG2 2636 N N . ASN A 332 ? 0.6801 0.6752 0.5178 0.0857 -0.0048 0.0495 331 ASN A N 2637 C CA . ASN A 332 ? 0.6694 0.6857 0.5171 0.0937 -0.0039 0.0636 331 ASN A CA 2638 C C . ASN A 332 ? 0.6872 0.7131 0.5444 0.1064 0.0034 0.0749 331 ASN A C 2639 O O . ASN A 332 ? 0.6750 0.6778 0.5286 0.1117 0.0095 0.0715 331 ASN A O 2640 C CB . ASN A 332 ? 0.6749 0.6697 0.5197 0.0978 -0.0037 0.0652 331 ASN A CB 2641 C CG . ASN A 332 ? 0.6832 0.6650 0.5195 0.0864 -0.0095 0.0532 331 ASN A CG 2642 O OD1 . ASN A 332 ? 0.7200 0.6761 0.5487 0.0829 -0.0100 0.0427 331 ASN A OD1 2643 N ND2 . ASN A 332 ? 0.6562 0.6566 0.4936 0.0809 -0.0135 0.0553 331 ASN A ND2 2644 N N . LEU A 333 ? 0.7087 0.7706 0.5779 0.1113 0.0031 0.0888 332 LEU A N 2645 C CA . LEU A 333 ? 0.7243 0.8019 0.6061 0.1252 0.0107 0.1024 332 LEU A CA 2646 C C . LEU A 333 ? 0.7671 0.8086 0.6471 0.1403 0.0215 0.1065 332 LEU A C 2647 O O . LEU A 333 ? 0.7996 0.8359 0.6835 0.1493 0.0302 0.1098 332 LEU A O 2648 C CB . LEU A 333 ? 0.7202 0.8431 0.6158 0.1300 0.0080 0.1197 332 LEU A CB 2649 C CG . LEU A 333 ? 0.7161 0.8610 0.6285 0.1475 0.0163 0.1383 332 LEU A CG 2650 C CD1 . LEU A 333 ? 0.7176 0.8715 0.6350 0.1461 0.0202 0.1344 332 LEU A CD1 2651 C CD2 . LEU A 333 ? 0.7114 0.9061 0.6364 0.1499 0.0108 0.1555 332 LEU A CD2 2652 N N . LYS A 334 ? 0.8087 0.8244 0.6820 0.1421 0.0220 0.1056 333 LYS A N 2653 C CA . LYS A 334 ? 0.8656 0.8431 0.7342 0.1533 0.0328 0.1073 333 LYS A CA 2654 C C . LYS A 334 ? 0.8526 0.7983 0.7106 0.1518 0.0383 0.0950 333 LYS A C 2655 O O . LYS A 334 ? 0.8559 0.7782 0.7120 0.1628 0.0501 0.0987 333 LYS A O 2656 C CB . LYS A 334 ? 0.8986 0.8503 0.7586 0.1491 0.0305 0.1029 333 LYS A CB 2657 C CG . LYS A 334 ? 0.9589 0.9258 0.8268 0.1565 0.0316 0.1183 333 LYS A CG 2658 C CD . LYS A 334 ? 1.0129 0.9530 0.8718 0.1503 0.0297 0.1122 333 LYS A CD 2659 C CE . LYS A 334 ? 1.0510 1.0134 0.9157 0.1519 0.0266 0.1244 333 LYS A CE 2660 N NZ . LYS A 334 ? 1.1047 1.0724 0.9783 0.1694 0.0370 0.1445 333 LYS A NZ 2661 N N . SER A 335 ? 0.8310 0.7743 0.6807 0.1385 0.0308 0.0808 334 SER A N 2662 C CA . SER A 335 ? 0.8639 0.7806 0.7025 0.1367 0.0353 0.0701 334 SER A CA 2663 C C . SER A 335 ? 0.9001 0.8248 0.7460 0.1481 0.0465 0.0781 334 SER A C 2664 O O . SER A 335 ? 0.9157 0.8106 0.7526 0.1535 0.0562 0.0744 334 SER A O 2665 C CB . SER A 335 ? 0.8516 0.7703 0.6822 0.1219 0.0258 0.0568 334 SER A CB 2666 O OG . SER A 335 ? 0.8697 0.7733 0.6923 0.1133 0.0180 0.0487 334 SER A OG 2667 N N . ALA A 336 ? 0.8960 0.8621 0.7582 0.1517 0.0456 0.0893 335 ALA A N 2668 C CA . ALA A 336 ? 0.9296 0.9104 0.8029 0.1634 0.0564 0.0988 335 ALA A CA 2669 C C . ALA A 336 ? 0.9495 0.9152 0.8282 0.1827 0.0709 0.1118 335 ALA A C 2670 O O . ALA A 336 ? 0.9602 0.9297 0.8461 0.1941 0.0827 0.1188 335 ALA A O 2671 C CB . ALA A 336 ? 0.9324 0.9668 0.8233 0.1608 0.0505 0.1083 335 ALA A CB 2672 N N . LEU A 337 ? 0.9744 0.9225 0.8498 0.1866 0.0715 0.1156 336 LEU A N 2673 C CA . LEU A 337 ? 1.0274 0.9507 0.9039 0.2039 0.0876 0.1259 336 LEU A CA 2674 C C . LEU A 337 ? 1.0362 0.9091 0.8933 0.2031 0.0982 0.1124 336 LEU A C 2675 O O . LEU A 337 ? 1.0410 0.8902 0.8970 0.2172 0.1151 0.1188 336 LEU A O 2676 C CB . LEU A 337 ? 1.0535 0.9699 0.9306 0.2070 0.0862 0.1336 336 LEU A CB 2677 C CG . LEU A 337 ? 1.0765 1.0404 0.9730 0.2145 0.0813 0.1529 336 LEU A CG 2678 C CD1 . LEU A 337 ? 1.0718 1.0284 0.9648 0.2121 0.0765 0.1565 336 LEU A CD1 2679 C CD2 . LEU A 337 ? 1.0880 1.0673 1.0013 0.2366 0.0960 0.1734 336 LEU A CD2 2680 N N . GLN A 338 ? 1.0017 0.8582 0.8429 0.1867 0.0889 0.0944 337 GLN A N 2681 C CA . GLN A 338 ? 1.0048 0.8167 0.8250 0.1830 0.0964 0.0806 337 GLN A CA 2682 C C . GLN A 338 ? 1.0068 0.8183 0.8276 0.1909 0.1087 0.0817 337 GLN A C 2683 O O . GLN A 338 ? 1.0366 0.8117 0.8443 0.1965 0.1232 0.0779 337 GLN A O 2684 C CB . GLN A 338 ? 1.0084 0.8093 0.8133 0.1643 0.0820 0.0636 337 GLN A CB 2685 C CG . GLN A 338 ? 1.0533 0.8106 0.8344 0.1578 0.0868 0.0492 337 GLN A CG 2686 C CD . GLN A 338 ? 1.1143 0.8349 0.8851 0.1608 0.0963 0.0484 337 GLN A CD 2687 O OE1 . GLN A 338 ? 1.1316 0.8568 0.9119 0.1656 0.0968 0.0573 337 GLN A OE1 2688 N NE2 . GLN A 338 ? 1.1586 0.8414 0.9081 0.1568 0.1043 0.0372 337 GLN A NE2 2689 N N . CYS A 339 ? 0.9730 0.8238 0.8078 0.1901 0.1038 0.0862 338 CYS A N 2690 C CA A CYS A 339 ? 1.0013 0.8573 0.8402 0.1982 0.1162 0.0891 338 CYS A CA 2691 C CA B CYS A 339 ? 0.9726 0.8300 0.8122 0.1984 0.1160 0.0896 338 CYS A CA 2692 C C . CYS A 339 ? 0.9972 0.8566 0.8508 0.2199 0.1338 0.1065 338 CYS A C 2693 O O . CYS A 339 ? 1.0332 0.8736 0.8827 0.2295 0.1503 0.1068 338 CYS A O 2694 C CB A CYS A 339 ? 0.9992 0.8971 0.8500 0.1906 0.1075 0.0896 338 CYS A CB 2695 C CB B CYS A 339 ? 0.9413 0.8460 0.7963 0.1921 0.1066 0.0927 338 CYS A CB 2696 S SG A CYS A 339 ? 1.0394 0.9941 0.9130 0.1865 0.0923 0.1010 338 CYS A SG 2697 S SG B CYS A 339 ? 0.8968 0.8032 0.7385 0.1685 0.0871 0.0757 338 CYS A SG 2698 N N . GLN A 340 ? 0.9760 0.8584 0.8459 0.2280 0.1311 0.1213 339 GLN A N 2699 C CA . GLN A 340 ? 0.9971 0.8838 0.8823 0.2504 0.1478 0.1405 339 GLN A CA 2700 C C . GLN A 340 ? 0.9878 0.8157 0.8541 0.2578 0.1656 0.1354 339 GLN A C 2701 O O . GLN A 340 ? 1.0270 0.8420 0.8971 0.2744 0.1856 0.1434 339 GLN A O 2702 C CB . GLN A 340 ? 1.0254 0.9473 0.9290 0.2563 0.1398 0.1576 339 GLN A CB 2703 C CG . GLN A 340 ? 1.0818 1.0361 1.0108 0.2793 0.1523 0.1825 339 GLN A CG 2704 C CD . GLN A 340 ? 1.1063 1.1034 1.0533 0.2837 0.1419 0.2005 339 GLN A CD 2705 O OE1 . GLN A 340 ? 1.1024 1.1218 1.0474 0.2671 0.1230 0.1943 339 GLN A OE1 2706 N NE2 . GLN A 340 ? 1.1447 1.1534 1.1086 0.3066 0.1553 0.2235 339 GLN A NE2 2707 N N . ALA A 341 ? 0.9453 0.7374 0.7907 0.2443 0.1591 0.1211 340 ALA A N 2708 C CA . ALA A 341 ? 0.9659 0.7007 0.7900 0.2466 0.1746 0.1133 340 ALA A CA 2709 C C . ALA A 341 ? 0.9911 0.6957 0.7977 0.2454 0.1874 0.1010 340 ALA A C 2710 O O . ALA A 341 ? 1.0651 0.7293 0.8597 0.2546 0.2080 0.1002 340 ALA A O 2711 C CB . ALA A 341 ? 0.9563 0.6662 0.7628 0.2288 0.1621 0.0993 340 ALA A CB 2712 N N . TRP A 342 ? 0.9794 0.7020 0.7831 0.2339 0.1763 0.0914 341 TRP A N 2713 C CA . TRP A 342 ? 1.0010 0.6976 0.7865 0.2311 0.1868 0.0796 341 TRP A CA 2714 C C . TRP A 342 ? 1.0416 0.7455 0.8403 0.2512 0.2083 0.0921 341 TRP A C 2715 O O . TRP A 342 ? 1.0600 0.7295 0.8409 0.2534 0.2246 0.0839 341 TRP A O 2716 C CB . TRP A 342 ? 0.9635 0.6779 0.7426 0.2138 0.1694 0.0674 341 TRP A CB 2717 C CG . TRP A 342 ? 0.9320 0.6300 0.6929 0.1943 0.1517 0.0525 341 TRP A CG 2718 C CD1 . TRP A 342 ? 0.9520 0.6113 0.6940 0.1878 0.1527 0.0437 341 TRP A CD1 2719 C CD2 . TRP A 342 ? 0.8881 0.6077 0.6482 0.1789 0.1319 0.0449 341 TRP A CD2 2720 N NE1 . TRP A 342 ? 0.9346 0.5943 0.6664 0.1701 0.1337 0.0323 341 TRP A NE1 2721 C CE2 . TRP A 342 ? 0.8983 0.5932 0.6406 0.1653 0.1214 0.0331 341 TRP A CE2 2722 C CE3 . TRP A 342 ? 0.8613 0.6182 0.6340 0.1751 0.1230 0.0472 341 TRP A CE3 2723 C CZ2 . TRP A 342 ? 0.8726 0.5793 0.6107 0.1504 0.1029 0.0248 341 TRP A CZ2 2724 C CZ3 . TRP A 342 ? 0.8489 0.6135 0.6151 0.1592 0.1055 0.0378 341 TRP A CZ3 2725 C CH2 . TRP A 342 ? 0.8496 0.5892 0.5992 0.1482 0.0959 0.0274 341 TRP A CH2 2726 N N . GLN A 343 ? 1.0630 0.8124 0.8925 0.2656 0.2087 0.1121 342 GLN A N 2727 C CA . GLN A 343 ? 1.1100 0.8742 0.9572 0.2863 0.2287 0.1269 342 GLN A CA 2728 C C . GLN A 343 ? 1.1430 0.8554 0.9765 0.3012 0.2560 0.1276 342 GLN A C 2729 O O . GLN A 343 ? 1.1386 0.8409 0.9705 0.3108 0.2742 0.1281 342 GLN A O 2730 C CB . GLN A 343 ? 1.1275 0.9489 1.0104 0.3007 0.2247 0.1511 342 GLN A CB 2731 C CG . GLN A 343 ? 1.1322 1.0113 1.0332 0.2910 0.2075 0.1533 342 GLN A CG 2732 C CD . GLN A 343 ? 1.1612 1.1005 1.0972 0.3049 0.2050 0.1777 342 GLN A CD 2733 O OE1 . GLN A 343 ? 1.2130 1.1827 1.1695 0.3179 0.2158 0.1904 342 GLN A OE1 2734 N NE2 . GLN A 343 ? 1.1655 1.1244 1.1087 0.3020 0.1907 0.1849 342 GLN A NE2 2735 N N . SER A 344 ? 1.1676 0.8455 0.9901 0.3022 0.2599 0.1269 343 SER A N 2736 C CA . SER A 344 ? 1.2289 0.8539 1.0372 0.3156 0.2875 0.1275 343 SER A CA 2737 C C . SER A 344 ? 1.2686 0.8346 1.0372 0.2983 0.2928 0.1021 343 SER A C 2738 O O . SER A 344 ? 1.2982 0.8147 1.0494 0.3061 0.3172 0.0987 343 SER A O 2739 C CB . SER A 344 ? 1.2374 0.8516 1.0529 0.3259 0.2921 0.1407 343 SER A CB 2740 O OG . SER A 344 ? 1.2261 0.8253 1.0256 0.3053 0.2738 0.1275 343 SER A OG 2741 N N . ARG A 345 ? 1.2555 0.8261 1.0090 0.2748 0.2708 0.0848 344 ARG A N 2742 C CA . ARG A 345 ? 1.2811 0.8014 0.9966 0.2560 0.2719 0.0613 344 ARG A CA 2743 C C . ARG A 345 ? 1.2622 0.7793 0.9625 0.2490 0.2739 0.0494 344 ARG A C 2744 O O . ARG A 345 ? 1.2742 0.7513 0.9416 0.2341 0.2760 0.0307 344 ARG A O 2745 C CB . ARG A 345 ? 1.2901 0.8111 0.9954 0.2343 0.2468 0.0499 344 ARG A CB 2746 C CG . ARG A 345 ? 1.3292 0.8477 1.0448 0.2382 0.2449 0.0592 344 ARG A CG 2747 C CD . ARG A 345 ? 1.3738 0.8708 1.0688 0.2156 0.2291 0.0432 344 ARG A CD 2748 N NE . ARG A 345 ? 1.4146 0.9233 1.1245 0.2172 0.2215 0.0532 344 ARG A NE 2749 C CZ . ARG A 345 ? 1.3874 0.9381 1.1149 0.2116 0.1992 0.0582 344 ARG A CZ 2750 N NH1 . ARG A 345 ? 1.3580 0.9431 1.0914 0.2036 0.1819 0.0543 344 ARG A NH1 2751 N NH2 . ARG A 345 ? 1.3641 0.9205 1.1024 0.2137 0.1953 0.0673 344 ARG A NH2 2752 N N . GLN A 346 ? 1.2226 0.7832 0.9461 0.2581 0.2727 0.0601 345 GLN A N 2753 C CA . GLN A 346 ? 1.2097 0.7672 0.9199 0.2527 0.2772 0.0504 345 GLN A CA 2754 C C . GLN A 346 ? 1.2237 0.8060 0.9584 0.2745 0.2962 0.0666 345 GLN A C 2755 O O . GLN A 346 ? 1.2202 0.8383 0.9869 0.2904 0.2975 0.0862 345 GLN A O 2756 C CB . GLN A 346 ? 1.1476 0.7357 0.8570 0.2338 0.2506 0.0423 345 GLN A CB 2757 C CG . GLN A 346 ? 1.0872 0.7370 0.8322 0.2383 0.2366 0.0573 345 GLN A CG 2758 C CD . GLN A 346 ? 1.0485 0.7213 0.7895 0.2199 0.2153 0.0481 345 GLN A CD 2759 O OE1 . GLN A 346 ? 1.0312 0.6823 0.7490 0.2030 0.2023 0.0337 345 GLN A OE1 2760 N NE2 . GLN A 346 ? 1.0220 0.7394 0.7858 0.2230 0.2123 0.0572 345 GLN A NE2 2761 N N . GLU A 347 ? 1.2657 0.8294 0.9848 0.2752 0.3116 0.0590 346 GLU A N 2762 C CA . GLU A 347 ? 1.2964 0.8840 1.0385 0.2954 0.3313 0.0737 346 GLU A CA 2763 C C . GLU A 347 ? 1.2402 0.8889 1.0092 0.2925 0.3159 0.0818 346 GLU A C 2764 O O . GLU A 347 ? 1.2186 0.9089 1.0211 0.3097 0.3237 0.1007 346 GLU A O 2765 C CB . GLU A 347 ? 1.3697 0.9117 1.0837 0.2975 0.3564 0.0621 346 GLU A CB 2766 C CG . GLU A 347 ? 1.4484 0.9291 1.1383 0.3040 0.3790 0.0562 346 GLU A CG 2767 C CD . GLU A 347 ? 1.5007 0.9823 1.2149 0.3337 0.4071 0.0763 346 GLU A CD 2768 O OE1 . GLU A 347 ? 1.5734 1.0426 1.2845 0.3455 0.4316 0.0773 346 GLU A OE1 2769 O OE2 . GLU A 347 ? 1.4738 0.9674 1.2095 0.3459 0.4060 0.0915 346 GLU A OE2 2770 N N . HIS A 348 ? 1.2158 0.8709 0.9703 0.2705 0.2947 0.0680 347 HIS A N 2771 C CA . HIS A 348 ? 1.1629 0.8725 0.9401 0.2643 0.2792 0.0738 347 HIS A CA 2772 C C . HIS A 348 ? 1.0978 0.8565 0.9090 0.2696 0.2647 0.0901 347 HIS A C 2773 O O . HIS A 348 ? 1.0749 0.8234 0.8850 0.2695 0.2569 0.0915 347 HIS A O 2774 C CB . HIS A 348 ? 1.1562 0.8569 0.9090 0.2400 0.2597 0.0560 347 HIS A CB 2775 C CG . HIS A 348 ? 1.1763 0.8394 0.8977 0.2340 0.2722 0.0420 347 HIS A CG 2776 N ND1 . HIS A 348 ? 1.2124 0.8201 0.8979 0.2283 0.2793 0.0276 347 HIS A ND1 2777 C CD2 . HIS A 348 ? 1.1816 0.8551 0.9011 0.2319 0.2792 0.0403 347 HIS A CD2 2778 C CE1 . HIS A 348 ? 1.2514 0.8371 0.9129 0.2232 0.2898 0.0176 347 HIS A CE1 2779 N NE2 . HIS A 348 ? 1.2351 0.8592 0.9168 0.2257 0.2903 0.0253 347 HIS A NE2 2780 N N . GLN A 349 ? 1.0612 0.8741 0.9020 0.2732 0.2616 0.1024 348 GLN A N 2781 C CA . GLN A 349 ? 1.0301 0.8957 0.9035 0.2777 0.2485 0.1189 348 GLN A CA 2782 C C . GLN A 349 ? 0.9709 0.8442 0.8368 0.2574 0.2214 0.1097 348 GLN A C 2783 O O . GLN A 349 ? 0.9633 0.8224 0.8085 0.2387 0.2104 0.0934 348 GLN A O 2784 C CB . GLN A 349 ? 1.0336 0.9568 0.9380 0.2826 0.2510 0.1321 348 GLN A CB 2785 C CG . GLN A 349 ? 1.0489 1.0295 0.9907 0.2941 0.2452 0.1543 348 GLN A CG 2786 C CD . GLN A 349 ? 1.0616 1.0954 1.0358 0.3047 0.2550 0.1705 348 GLN A CD 2787 O OE1 . GLN A 349 ? 1.0798 1.1607 1.0860 0.3188 0.2553 0.1917 348 GLN A OE1 2788 N NE2 . GLN A 349 ? 1.0517 1.0803 1.0181 0.2980 0.2632 0.1614 348 GLN A NE2 2789 N N . VAL A 350 ? 0.9328 0.8269 0.8148 0.2623 0.2123 0.1208 349 VAL A N 2790 C CA . VAL A 350 ? 0.8903 0.8001 0.7709 0.2455 0.1881 0.1154 349 VAL A CA 2791 C C . VAL A 350 ? 0.8611 0.8352 0.7750 0.2490 0.1789 0.1328 349 VAL A C 2792 O O . VAL A 350 ? 0.8861 0.8786 0.8200 0.2667 0.1861 0.1508 349 VAL A O 2793 C CB . VAL A 350 ? 0.8879 0.7619 0.7539 0.2458 0.1846 0.1117 349 VAL A CB 2794 C CG1 . VAL A 350 ? 0.8554 0.7479 0.7216 0.2294 0.1607 0.1070 349 VAL A CG1 2795 C CG2 . VAL A 350 ? 0.9089 0.7210 0.7415 0.2412 0.1940 0.0948 349 VAL A CG2 2796 N N . LEU A 351 ? 0.8448 0.8526 0.7641 0.2324 0.1644 0.1278 350 LEU A N 2797 C CA . LEU A 351 ? 0.8396 0.9110 0.7881 0.2314 0.1549 0.1421 350 LEU A CA 2798 C C . LEU A 351 ? 0.8323 0.9129 0.7752 0.2150 0.1336 0.1358 350 LEU A C 2799 O O . LEU A 351 ? 0.8223 0.8802 0.7446 0.1973 0.1237 0.1185 350 LEU A O 2800 C CB . LEU A 351 ? 0.8376 0.9415 0.7966 0.2232 0.1564 0.1410 350 LEU A CB 2801 C CG . LEU A 351 ? 0.8812 0.9826 0.8500 0.2413 0.1792 0.1497 350 LEU A CG 2802 C CD1 . LEU A 351 ? 0.8775 0.9771 0.8385 0.2294 0.1835 0.1386 350 LEU A CD1 2803 C CD2 . LEU A 351 ? 0.8838 1.0408 0.8894 0.2591 0.1851 0.1745 350 LEU A CD2 2804 N N . LEU A 352 ? 0.8419 0.9548 0.8024 0.2217 0.1273 0.1506 351 LEU A N 2805 C CA . LEU A 352 ? 0.8284 0.9559 0.7854 0.2064 0.1080 0.1461 351 LEU A CA 2806 C C . LEU A 352 ? 0.7939 0.9822 0.7699 0.1949 0.0975 0.1518 351 LEU A C 2807 O O . LEU A 352 ? 0.7793 1.0110 0.7799 0.2057 0.1030 0.1688 351 LEU A O 2808 C CB . LEU A 352 ? 0.8597 0.9834 0.8208 0.2186 0.1071 0.1579 351 LEU A CB 2809 C CG . LEU A 352 ? 0.9040 0.9673 0.8400 0.2182 0.1092 0.1457 351 LEU A CG 2810 C CD1 . LEU A 352 ? 0.9281 0.9457 0.8515 0.2285 0.1274 0.1404 351 LEU A CD1 2811 C CD2 . LEU A 352 ? 0.9305 0.9941 0.8718 0.2284 0.1079 0.1581 351 LEU A CD2 2812 N N . GLN A 353 ? 0.7718 0.9631 0.7361 0.1725 0.0833 0.1374 352 GLN A N 2813 C CA . GLN A 353 ? 0.7426 0.9889 0.7213 0.1576 0.0727 0.1404 352 GLN A CA 2814 C C . GLN A 353 ? 0.7382 0.9899 0.7070 0.1412 0.0563 0.1330 352 GLN A C 2815 O O . GLN A 353 ? 0.7488 0.9685 0.6967 0.1264 0.0507 0.1153 352 GLN A O 2816 C CB . GLN A 353 ? 0.7329 0.9812 0.7078 0.1437 0.0756 0.1291 352 GLN A CB 2817 C CG . GLN A 353 ? 0.7198 1.0229 0.7081 0.1253 0.0662 0.1302 352 GLN A CG 2818 C CD . GLN A 353 ? 0.7151 1.0801 0.7347 0.1361 0.0679 0.1522 352 GLN A CD 2819 O OE1 . GLN A 353 ? 0.7276 1.1058 0.7632 0.1496 0.0806 0.1624 352 GLN A OE1 2820 N NE2 . GLN A 353 ? 0.6925 1.0974 0.7210 0.1304 0.0553 0.1603 352 GLN A NE2 2821 N N . GLU A 354 ? 0.7342 1.0269 0.7181 0.1447 0.0495 0.1475 353 GLU A N 2822 C CA . GLU A 354 ? 0.7337 1.0403 0.7100 0.1283 0.0346 0.1420 353 GLU A CA 2823 C C . GLU A 354 ? 0.7246 1.0609 0.6996 0.1036 0.0265 0.1315 353 GLU A C 2824 O O . GLU A 354 ? 0.7333 1.1102 0.7251 0.1009 0.0288 0.1384 353 GLU A O 2825 C CB . GLU A 354 ? 0.7538 1.1005 0.7465 0.1391 0.0301 0.1623 353 GLU A CB 2826 C CG . GLU A 354 ? 0.7718 1.1294 0.7543 0.1241 0.0160 0.1576 353 GLU A CG 2827 C CD . GLU A 354 ? 0.7822 1.1825 0.7801 0.1348 0.0115 0.1794 353 GLU A CD 2828 O OE1 . GLU A 354 ? 0.8070 1.2390 0.8270 0.1521 0.0180 0.1993 353 GLU A OE1 2829 O OE2 . GLU A 354 ? 0.7726 1.1754 0.7606 0.1266 0.0020 0.1774 353 GLU A OE2 2830 N N . LEU A 355 ? 0.7029 1.0187 0.6582 0.0854 0.0180 0.1151 354 LEU A N 2831 C CA . LEU A 355 ? 0.7041 1.0408 0.6537 0.0598 0.0110 0.1031 354 LEU A CA 2832 C C . LEU A 355 ? 0.6933 1.0500 0.6373 0.0476 -0.0007 0.1021 354 LEU A C 2833 O O . LEU A 355 ? 0.6741 0.9967 0.5986 0.0387 -0.0043 0.0884 354 LEU A O 2834 C CB . LEU A 355 ? 0.7090 0.9966 0.6373 0.0489 0.0144 0.0830 354 LEU A CB 2835 C CG . LEU A 355 ? 0.7181 0.9805 0.6468 0.0592 0.0262 0.0820 354 LEU A CG 2836 C CD1 . LEU A 355 ? 0.7255 0.9391 0.6309 0.0487 0.0279 0.0634 354 LEU A CD1 2837 C CD2 . LEU A 355 ? 0.7188 1.0255 0.6668 0.0564 0.0310 0.0900 354 LEU A CD2 2838 N N . PRO A 356 ? 0.6913 1.1050 0.6525 0.0476 -0.0065 0.1175 355 PRO A N 2839 C CA . PRO A 356 ? 0.6907 1.1234 0.6450 0.0378 -0.0172 0.1182 355 PRO A CA 2840 C C . PRO A 356 ? 0.6900 1.1229 0.6269 0.0085 -0.0230 0.0988 355 PRO A C 2841 O O . PRO A 356 ? 0.7200 1.1770 0.6607 -0.0072 -0.0226 0.0938 355 PRO A O 2842 C CB . PRO A 356 ? 0.6784 1.1773 0.6562 0.0443 -0.0217 0.1406 355 PRO A CB 2843 C CG . PRO A 356 ? 0.6912 1.1994 0.6898 0.0625 -0.0115 0.1531 355 PRO A CG 2844 C CD . PRO A 356 ? 0.6861 1.1517 0.6730 0.0553 -0.0037 0.1348 355 PRO A CD 2845 N N . GLY A 357 ? 0.6779 1.0814 0.5956 0.0014 -0.0268 0.0879 356 GLY A N 2846 C CA . GLY A 357 ? 0.7003 1.0973 0.5990 -0.0249 -0.0302 0.0691 356 GLY A CA 2847 C C . GLY A 357 ? 0.7341 1.0819 0.6184 -0.0318 -0.0228 0.0510 356 GLY A C 2848 O O . GLY A 357 ? 0.7730 1.1127 0.6420 -0.0535 -0.0228 0.0354 356 GLY A O 2849 N N . SER A 358 ? 0.7566 1.0700 0.6439 -0.0140 -0.0157 0.0529 357 SER A N 2850 C CA . SER A 358 ? 0.7562 1.0256 0.6300 -0.0195 -0.0089 0.0378 357 SER A CA 2851 C C . SER A 358 ? 0.7527 0.9707 0.6099 -0.0138 -0.0084 0.0288 357 SER A C 2852 O O . SER A 358 ? 0.7395 0.9384 0.5999 0.0046 -0.0077 0.0359 357 SER A O 2853 C CB . SER A 358 ? 0.7640 1.0276 0.6487 -0.0059 -0.0011 0.0441 357 SER A CB 2854 O OG . SER A 358 ? 0.8031 1.0372 0.6755 -0.0162 0.0049 0.0305 357 SER A OG 2855 N N . GLU A 359 ? 0.7520 0.9485 0.5921 -0.0303 -0.0080 0.0136 358 GLU A N 2856 C CA . GLU A 359 ? 0.7466 0.8975 0.5723 -0.0259 -0.0072 0.0052 358 GLU A CA 2857 C C . GLU A 359 ? 0.7209 0.8310 0.5419 -0.0153 -0.0013 0.0018 358 GLU A C 2858 O O . GLU A 359 ? 0.7186 0.8283 0.5411 -0.0177 0.0038 0.0006 358 GLU A O 2859 C CB . GLU A 359 ? 0.7699 0.9108 0.5790 -0.0461 -0.0067 -0.0093 358 GLU A CB 2860 C CG . GLU A 359 ? 0.7804 0.8835 0.5774 -0.0420 -0.0064 -0.0161 358 GLU A CG 2861 C CD . GLU A 359 ? 0.8182 0.8756 0.6053 -0.0380 -0.0003 -0.0242 358 GLU A CD 2862 O OE1 . GLU A 359 ? 0.8374 0.8871 0.6193 -0.0469 0.0052 -0.0303 358 GLU A OE1 2863 O OE2 . GLU A 359 ? 0.8168 0.8467 0.6013 -0.0262 -0.0011 -0.0237 358 GLU A OE2 2864 N N . HIS A 360 ? 0.7025 0.7801 0.5174 -0.0045 -0.0022 0.0007 359 HIS A N 2865 C CA . HIS A 360 ? 0.7089 0.7499 0.5188 0.0069 0.0014 -0.0007 359 HIS A CA 2866 C C . HIS A 360 ? 0.7161 0.7366 0.5158 -0.0009 0.0074 -0.0094 359 HIS A C 2867 O O . HIS A 360 ? 0.7161 0.7271 0.5167 0.0063 0.0116 -0.0069 359 HIS A O 2868 C CB . HIS A 360 ? 0.6997 0.7115 0.5023 0.0133 -0.0014 -0.0035 359 HIS A CB 2869 C CG . HIS A 360 ? 0.7055 0.6840 0.5030 0.0249 0.0004 -0.0038 359 HIS A CG 2870 N ND1 . HIS A 360 ? 0.7053 0.6822 0.5092 0.0384 0.0017 0.0042 359 HIS A ND1 2871 C CD2 . HIS A 360 ? 0.7093 0.6551 0.4951 0.0247 0.0013 -0.0109 359 HIS A CD2 2872 C CE1 . HIS A 360 ? 0.6936 0.6383 0.4882 0.0440 0.0030 0.0006 359 HIS A CE1 2873 N NE2 . HIS A 360 ? 0.6965 0.6239 0.4808 0.0363 0.0020 -0.0077 359 HIS A NE2 2874 N N . ILE A 361 ? 0.7393 0.7505 0.5281 -0.0155 0.0090 -0.0197 360 ILE A N 2875 C CA . ILE A 361 ? 0.7647 0.7544 0.5427 -0.0235 0.0160 -0.0275 360 ILE A CA 2876 C C . ILE A 361 ? 0.7851 0.8028 0.5678 -0.0371 0.0198 -0.0283 360 ILE A C 2877 O O . ILE A 361 ? 0.8056 0.8148 0.5861 -0.0380 0.0257 -0.0291 360 ILE A O 2878 C CB . ILE A 361 ? 0.7953 0.7577 0.5583 -0.0328 0.0188 -0.0381 360 ILE A CB 2879 C CG1 . ILE A 361 ? 0.7817 0.7190 0.5416 -0.0204 0.0151 -0.0371 360 ILE A CG1 2880 C CG2 . ILE A 361 ? 0.8366 0.7742 0.5879 -0.0398 0.0273 -0.0445 360 ILE A CG2 2881 C CD1 . ILE A 361 ? 0.7972 0.7073 0.5534 -0.0071 0.0155 -0.0342 360 ILE A CD1 2882 N N . GLU A 362 ? 0.8163 0.8687 0.6048 -0.0488 0.0163 -0.0282 361 GLU A N 2883 C CA . GLU A 362 ? 0.8354 0.9201 0.6291 -0.0649 0.0189 -0.0294 361 GLU A CA 2884 C C . GLU A 362 ? 0.8053 0.9127 0.6151 -0.0549 0.0203 -0.0185 361 GLU A C 2885 O O . GLU A 362 ? 0.8269 0.9500 0.6399 -0.0660 0.0253 -0.0201 361 GLU A O 2886 C CB . GLU A 362 ? 0.8530 0.9760 0.6501 -0.0792 0.0131 -0.0298 361 GLU A CB 2887 C CG . GLU A 362 ? 0.8983 1.0003 0.6770 -0.0953 0.0153 -0.0436 361 GLU A CG 2888 C CD . GLU A 362 ? 0.9409 1.0789 0.7199 -0.1089 0.0092 -0.0443 361 GLU A CD 2889 O OE1 . GLU A 362 ? 0.9620 1.1477 0.7544 -0.1140 0.0041 -0.0364 361 GLU A OE1 2890 O OE2 . GLU A 362 ? 0.9577 1.0775 0.7234 -0.1143 0.0097 -0.0522 361 GLU A OE2 2891 N N . MET A 363 ? 0.7886 0.8952 0.6078 -0.0342 0.0176 -0.0080 362 MET A N 2892 C CA . MET A 363 ? 0.7890 0.9142 0.6231 -0.0227 0.0211 0.0026 362 MET A CA 2893 C C . MET A 363 ? 0.7799 0.8813 0.6069 -0.0238 0.0302 -0.0020 362 MET A C 2894 O O . MET A 363 ? 0.7658 0.8894 0.6046 -0.0220 0.0351 0.0041 362 MET A O 2895 C CB . MET A 363 ? 0.8003 0.9210 0.6427 -0.0002 0.0190 0.0137 362 MET A CB 2896 C CG . MET A 363 ? 0.8272 0.8994 0.6568 0.0124 0.0218 0.0102 362 MET A CG 2897 S SD . MET A 363 ? 0.8377 0.9058 0.6771 0.0365 0.0229 0.0229 362 MET A SD 2898 C CE . MET A 363 ? 0.8428 0.9352 0.6905 0.0375 0.0138 0.0294 362 MET A CE 2899 N N . LEU A 364 ? 0.7842 0.8421 0.5923 -0.0264 0.0328 -0.0118 363 LEU A N 2900 C CA . LEU A 364 ? 0.7988 0.8310 0.5968 -0.0280 0.0413 -0.0161 363 LEU A CA 2901 C C . LEU A 364 ? 0.8038 0.8513 0.6013 -0.0477 0.0475 -0.0216 363 LEU A C 2902 O O . LEU A 364 ? 0.8098 0.8456 0.6034 -0.0484 0.0557 -0.0223 363 LEU A O 2903 C CB . LEU A 364 ? 0.8150 0.7990 0.5930 -0.0255 0.0418 -0.0236 363 LEU A CB 2904 C CG . LEU A 364 ? 0.8304 0.7885 0.6042 -0.0066 0.0392 -0.0194 363 LEU A CG 2905 C CD1 . LEU A 364 ? 0.8621 0.7796 0.6176 -0.0068 0.0389 -0.0262 363 LEU A CD1 2906 C CD2 . LEU A 364 ? 0.8250 0.7810 0.6012 0.0035 0.0453 -0.0139 363 LEU A CD2 2907 N N . ALA A 365 ? 0.7907 0.8623 0.5902 -0.0650 0.0443 -0.0262 364 ALA A N 2908 C CA . ALA A 365 ? 0.8016 0.8893 0.5998 -0.0873 0.0501 -0.0328 364 ALA A CA 2909 C C . ALA A 365 ? 0.7995 0.9469 0.6182 -0.0958 0.0455 -0.0260 364 ALA A C 2910 O O . ALA A 365 ? 0.8076 0.9774 0.6271 -0.1175 0.0483 -0.0315 364 ALA A O 2911 C CB . ALA A 365 ? 0.8047 0.8666 0.5838 -0.1045 0.0521 -0.0461 364 ALA A CB 2912 N N . ASN A 366 ? 0.7843 0.9579 0.6197 -0.0789 0.0390 -0.0134 365 ASN A N 2913 C CA . ASN A 366 ? 0.7854 1.0182 0.6413 -0.0840 0.0332 -0.0043 365 ASN A CA 2914 C C . ASN A 366 ? 0.7754 1.0397 0.6503 -0.0807 0.0393 0.0050 365 ASN A C 2915 O O . ASN A 366 ? 0.7817 1.0275 0.6601 -0.0619 0.0453 0.0111 365 ASN A O 2916 C CB . ASN A 366 ? 0.7999 1.0455 0.6651 -0.0659 0.0247 0.0067 365 ASN A CB 2917 C CG . ASN A 366 ? 0.8262 1.1353 0.7125 -0.0694 0.0178 0.0186 365 ASN A CG 2918 O OD1 . ASN A 366 ? 0.8338 1.1795 0.7395 -0.0665 0.0207 0.0287 365 ASN A OD1 2919 N ND2 . ASN A 366 ? 0.8528 1.1770 0.7358 -0.0749 0.0087 0.0186 365 ASN A ND2 2920 N N . ALA A 367 ? 0.7730 1.0857 0.6598 -0.0996 0.0379 0.0059 366 ALA A N 2921 C CA . ALA A 367 ? 0.7696 1.1177 0.6763 -0.0998 0.0443 0.0143 366 ALA A CA 2922 C C . ALA A 367 ? 0.7630 1.1352 0.6928 -0.0724 0.0444 0.0332 366 ALA A C 2923 O O . ALA A 367 ? 0.7801 1.1559 0.7209 -0.0627 0.0538 0.0395 366 ALA A O 2924 C CB . ALA A 367 ? 0.7589 1.1613 0.6755 -0.1269 0.0408 0.0124 366 ALA A CB 2925 N N . THR A 368 ? 0.7533 1.1413 0.6903 -0.0601 0.0355 0.0424 367 THR A N 2926 C CA . THR A 368 ? 0.7607 1.1656 0.7179 -0.0326 0.0372 0.0607 367 THR A CA 2927 C C . THR A 368 ? 0.7615 1.1088 0.7069 -0.0112 0.0459 0.0592 367 THR A C 2928 O O . THR A 368 ? 0.7559 1.1068 0.7144 0.0069 0.0547 0.0697 367 THR A O 2929 C CB . THR A 368 ? 0.7680 1.1985 0.7326 -0.0247 0.0261 0.0710 367 THR A CB 2930 O OG1 . THR A 368 ? 0.7752 1.2607 0.7482 -0.0462 0.0171 0.0722 367 THR A OG1 2931 C CG2 . THR A 368 ? 0.7724 1.2214 0.7591 0.0040 0.0297 0.0917 367 THR A CG2 2932 N N . THR A 369 ? 0.7540 1.0494 0.6745 -0.0136 0.0439 0.0462 368 THR A N 2933 C CA . THR A 369 ? 0.7635 1.0052 0.6699 0.0024 0.0508 0.0429 368 THR A CA 2934 C C . THR A 369 ? 0.7768 1.0059 0.6804 0.0000 0.0624 0.0394 368 THR A C 2935 O O . THR A 369 ? 0.7793 0.9906 0.6840 0.0173 0.0712 0.0446 368 THR A O 2936 C CB . THR A 369 ? 0.7752 0.9691 0.6562 -0.0035 0.0458 0.0292 368 THR A CB 2937 O OG1 . THR A 369 ? 0.7888 0.9949 0.6718 -0.0027 0.0357 0.0319 368 THR A OG1 2938 C CG2 . THR A 369 ? 0.7833 0.9256 0.6496 0.0124 0.0513 0.0266 368 THR A CG2 2939 N N . LEU A 370 ? 0.7969 1.0323 0.6945 -0.0224 0.0635 0.0298 369 LEU A N 2940 C CA . LEU A 370 ? 0.8028 1.0241 0.6954 -0.0275 0.0751 0.0256 369 LEU A CA 2941 C C . LEU A 370 ? 0.7863 1.0510 0.7048 -0.0196 0.0827 0.0388 369 LEU A C 2942 O O . LEU A 370 ? 0.7892 1.0360 0.7057 -0.0105 0.0941 0.0403 369 LEU A O 2943 C CB . LEU A 370 ? 0.8261 1.0429 0.7061 -0.0546 0.0757 0.0125 369 LEU A CB 2944 C CG . LEU A 370 ? 0.8416 1.0125 0.6957 -0.0620 0.0711 -0.0004 369 LEU A CG 2945 C CD1 . LEU A 370 ? 0.8590 1.0303 0.7028 -0.0897 0.0736 -0.0124 369 LEU A CD1 2946 C CD2 . LEU A 370 ? 0.8397 0.9546 0.6743 -0.0474 0.0760 -0.0036 369 LEU A CD2 2947 N N . ALA A 371 ? 0.7663 1.0887 0.7089 -0.0224 0.0767 0.0492 370 ALA A N 2948 C CA . ALA A 371 ? 0.7503 1.1196 0.7217 -0.0118 0.0836 0.0648 370 ALA A CA 2949 C C . ALA A 371 ? 0.7437 1.0928 0.7199 0.0186 0.0911 0.0756 370 ALA A C 2950 O O . ALA A 371 ? 0.7727 1.1299 0.7611 0.0300 0.1037 0.0833 370 ALA A O 2951 C CB . ALA A 371 ? 0.7254 1.1627 0.7215 -0.0197 0.0738 0.0754 370 ALA A CB 2952 N N . TYR A 372 ? 0.7227 1.0449 0.6889 0.0312 0.0847 0.0760 371 TYR A N 2953 C CA . TYR A 372 ? 0.7225 1.0187 0.6892 0.0580 0.0926 0.0843 371 TYR A CA 2954 C C . TYR A 372 ? 0.7521 0.9944 0.6969 0.0619 0.1040 0.0743 371 TYR A C 2955 O O . TYR A 372 ? 0.7789 1.0144 0.7293 0.0781 0.1172 0.0810 371 TYR A O 2956 C CB . TYR A 372 ? 0.7085 0.9842 0.6666 0.0671 0.0831 0.0849 371 TYR A CB 2957 C CG . TYR A 372 ? 0.7043 0.9612 0.6667 0.0940 0.0917 0.0955 371 TYR A CG 2958 C CD1 . TYR A 372 ? 0.7106 0.9112 0.6517 0.1032 0.1004 0.0876 371 TYR A CD1 2959 C CD2 . TYR A 372 ? 0.6933 0.9881 0.6799 0.1097 0.0918 0.1138 371 TYR A CD2 2960 C CE1 . TYR A 372 ? 0.7200 0.9000 0.6626 0.1258 0.1099 0.0958 371 TYR A CE1 2961 C CE2 . TYR A 372 ? 0.7052 0.9786 0.6947 0.1344 0.1021 0.1235 371 TYR A CE2 2962 C CZ . TYR A 372 ? 0.7180 0.9326 0.6848 0.1416 0.1115 0.1135 371 TYR A CZ 2963 O OH . TYR A 372 ? 0.7391 0.9291 0.7061 0.1641 0.1231 0.1215 371 TYR A OH 2964 N N . LEU A 373 ? 0.7553 0.9593 0.6743 0.0473 0.0995 0.0587 372 LEU A N 2965 C CA . LEU A 373 ? 0.7856 0.9410 0.6819 0.0489 0.1087 0.0496 372 LEU A CA 2966 C C . LEU A 373 ? 0.8247 0.9968 0.7296 0.0455 0.1219 0.0521 372 LEU A C 2967 O O . LEU A 373 ? 0.8409 0.9875 0.7379 0.0572 0.1342 0.0526 372 LEU A O 2968 C CB . LEU A 373 ? 0.7989 0.9177 0.6690 0.0328 0.1012 0.0346 372 LEU A CB 2969 C CG . LEU A 373 ? 0.8116 0.8787 0.6551 0.0342 0.1086 0.0258 372 LEU A CG 2970 C CD1 . LEU A 373 ? 0.8137 0.8476 0.6469 0.0540 0.1114 0.0279 372 LEU A CD1 2971 C CD2 . LEU A 373 ? 0.8145 0.8528 0.6364 0.0186 0.1014 0.0137 372 LEU A CD2 2972 N N . LYS A 374 ? 0.8468 1.0623 0.7674 0.0283 0.1200 0.0531 373 LYS A N 2973 C CA . LYS A 374 ? 0.8598 1.0977 0.7920 0.0231 0.1325 0.0562 373 LYS A CA 2974 C C . LYS A 374 ? 0.8728 1.1309 0.8263 0.0462 0.1446 0.0710 373 LYS A C 2975 O O . LYS A 374 ? 0.8774 1.1225 0.8280 0.0517 0.1593 0.0714 373 LYS A O 2976 C CB . LYS A 374 ? 0.8671 1.1573 0.8169 0.0002 0.1271 0.0564 373 LYS A CB 2977 C CG . LYS A 374 ? 0.9047 1.2075 0.8588 -0.0126 0.1392 0.0544 373 LYS A CG 2978 C CD . LYS A 374 ? 0.9207 1.2803 0.8942 -0.0367 0.1341 0.0551 373 LYS A CD 2979 C CE . LYS A 374 ? 0.9514 1.3294 0.9345 -0.0470 0.1480 0.0559 373 LYS A CE 2980 N NZ . LYS A 374 ? 0.9658 1.3974 0.9654 -0.0745 0.1434 0.0546 373 LYS A NZ 2981 N N . ARG A 375 ? 0.8846 1.1742 0.8591 0.0598 0.1394 0.0838 374 ARG A N 2982 C CA . ARG A 375 ? 0.9133 1.2209 0.9092 0.0846 0.1515 0.0997 374 ARG A CA 2983 C C . ARG A 375 ? 0.8936 1.1412 0.8670 0.1029 0.1634 0.0956 374 ARG A C 2984 O O . ARG A 375 ? 0.9188 1.1642 0.8987 0.1165 0.1803 0.1017 374 ARG A O 2985 C CB . ARG A 375 ? 0.9488 1.2962 0.9678 0.0957 0.1423 0.1144 374 ARG A CB 2986 C CG . ARG A 375 ? 1.0097 1.4045 1.0632 0.1156 0.1535 0.1354 374 ARG A CG 2987 C CD . ARG A 375 ? 1.0432 1.4724 1.1171 0.1294 0.1451 0.1516 374 ARG A CD 2988 N NE . ARG A 375 ? 1.1095 1.4871 1.1636 0.1445 0.1442 0.1488 374 ARG A NE 2989 C CZ . ARG A 375 ? 1.1268 1.5175 1.1934 0.1615 0.1411 0.1629 374 ARG A CZ 2990 N NH1 . ARG A 375 ? 1.1262 1.4653 1.1722 0.1723 0.1413 0.1582 374 ARG A NH1 2991 N NH2 . ARG A 375 ? 1.1332 1.5890 1.2325 0.1677 0.1380 0.1825 374 ARG A NH2 2992 N N . VAL A 376 ? 0.8686 1.0690 0.8156 0.1023 0.1549 0.0852 375 VAL A N 2993 C CA . VAL A 376 ? 0.8751 1.0175 0.7969 0.1157 0.1640 0.0793 375 VAL A CA 2994 C C . VAL A 376 ? 0.8880 1.0026 0.7908 0.1086 0.1754 0.0700 375 VAL A C 2995 O O . VAL A 376 ? 0.8911 0.9825 0.7867 0.1222 0.1909 0.0714 375 VAL A O 2996 C CB . VAL A 376 ? 0.8702 0.9713 0.7673 0.1124 0.1507 0.0689 375 VAL A CB 2997 C CG1 . VAL A 376 ? 0.8865 0.9285 0.7541 0.1208 0.1588 0.0604 375 VAL A CG1 2998 C CG2 . VAL A 376 ? 0.8586 0.9796 0.7715 0.1225 0.1422 0.0786 375 VAL A CG2 2999 N N . LEU A 377 ? 0.8904 1.0062 0.7839 0.0872 0.1687 0.0607 376 LEU A N 3000 C CA . LEU A 377 ? 0.9113 0.9953 0.7822 0.0790 0.1781 0.0514 376 LEU A CA 3001 C C . LEU A 377 ? 0.9506 1.0650 0.8391 0.0785 0.1936 0.0580 376 LEU A C 3002 O O . LEU A 377 ? 0.9617 1.0486 0.8354 0.0840 0.2080 0.0555 376 LEU A O 3003 C CB . LEU A 377 ? 0.8920 0.9602 0.7443 0.0572 0.1666 0.0394 376 LEU A CB 3004 C CG . LEU A 377 ? 0.8835 0.9174 0.7158 0.0568 0.1524 0.0319 376 LEU A CG 3005 C CD1 . LEU A 377 ? 0.8824 0.9046 0.7000 0.0362 0.1437 0.0218 376 LEU A CD1 3006 C CD2 . LEU A 377 ? 0.9054 0.8892 0.7121 0.0699 0.1572 0.0278 376 LEU A CD2 3007 N N . LEU A 378 ? 0.9733 1.1455 0.8926 0.0704 0.1907 0.0661 377 LEU A N 3008 C CA . LEU A 378 ? 0.9984 1.2066 0.9372 0.0654 0.2037 0.0719 377 LEU A CA 3009 C C . LEU A 378 ? 1.0462 1.2971 1.0187 0.0857 0.2145 0.0893 377 LEU A C 3010 O O . LEU A 378 ? 1.0503 1.3277 1.0394 0.0863 0.2285 0.0955 377 LEU A O 3011 C CB . LEU A 378 ? 0.9711 1.2169 0.9208 0.0389 0.1945 0.0685 377 LEU A CB 3012 C CG . LEU A 378 ? 0.9806 1.1910 0.9022 0.0178 0.1953 0.0539 377 LEU A CG 3013 C CD1 . LEU A 378 ? 0.9921 1.1378 0.8769 0.0215 0.1897 0.0429 377 LEU A CD1 3014 C CD2 . LEU A 378 ? 0.9701 1.2135 0.9006 -0.0086 0.1851 0.0493 377 LEU A CD2 3015 N N . GLY A 379 ? 1.1119 1.3683 1.0944 0.1027 0.2092 0.0977 378 GLY A N 3016 C CA . GLY A 379 ? 1.1852 1.4672 1.1940 0.1272 0.2225 0.1145 378 GLY A CA 3017 C C . GLY A 379 ? 1.2661 1.6249 1.3177 0.1278 0.2195 0.1316 378 GLY A C 3018 O O . GLY A 379 ? 1.3059 1.6877 1.3816 0.1509 0.2313 0.1479 378 GLY A O 3019 N N . PRO A 380 ? 1.3370 1.7369 1.3988 0.1031 0.2052 0.1288 379 PRO A N 3020 C CA . PRO A 380 ? 1.3493 1.8264 1.4509 0.0982 0.2060 0.1434 379 PRO A CA 3021 C C . PRO A 380 ? 1.3086 1.8346 1.4394 0.1126 0.1972 0.1616 379 PRO A C 3022 O O . PRO A 380 ? 1.2651 1.7878 1.4076 0.1406 0.2080 0.1752 379 PRO A O 3023 C CB . PRO A 380 ? 1.3566 1.8485 1.4502 0.0639 0.1931 0.1302 379 PRO A CB 3024 C CG . PRO A 380 ? 1.3470 1.7874 1.4072 0.0562 0.1789 0.1153 379 PRO A CG 3025 C CD . PRO A 380 ? 1.3443 1.7290 1.3859 0.0816 0.1856 0.1151 379 PRO A CD 3026 N N . ARG B 4 ? 0.8239 2.2621 1.7274 -0.0628 0.2309 -0.3308 3 ARG B N 3027 C CA . ARG B 4 ? 0.8394 2.2107 1.6832 -0.0882 0.2527 -0.3168 3 ARG B CA 3028 C C . ARG B 4 ? 0.8159 2.1051 1.6046 -0.0960 0.2319 -0.2963 3 ARG B C 3029 O O . ARG B 4 ? 0.7955 2.0867 1.5939 -0.0960 0.2059 -0.2932 3 ARG B O 3030 C CB . ARG B 4 ? 0.8678 2.2759 1.7259 -0.1339 0.2811 -0.3210 3 ARG B CB 3031 C CG . ARG B 4 ? 0.9017 2.2486 1.7014 -0.1584 0.3059 -0.3082 3 ARG B CG 3032 C CD . ARG B 4 ? 0.9295 2.3224 1.7481 -0.1973 0.3386 -0.3151 3 ARG B CD 3033 N NE . ARG B 4 ? 0.9613 2.2951 1.7213 -0.2181 0.3620 -0.3026 3 ARG B NE 3034 C CZ . ARG B 4 ? 0.9898 2.3475 1.7499 -0.2483 0.3949 -0.3060 3 ARG B CZ 3035 N NH1 . ARG B 4 ? 0.9972 2.4402 1.8157 -0.2633 0.4105 -0.3221 3 ARG B NH1 3036 N NH2 . ARG B 4 ? 1.0093 2.3059 1.7101 -0.2641 0.4124 -0.2929 3 ARG B NH2 3037 N N . HIS B 5 ? 0.8028 2.0212 1.5334 -0.1021 0.2434 -0.2829 4 HIS B N 3038 C CA . HIS B 5 ? 0.7790 1.9191 1.4567 -0.1072 0.2259 -0.2640 4 HIS B CA 3039 C C . HIS B 5 ? 0.7712 1.8486 1.3923 -0.1276 0.2466 -0.2514 4 HIS B C 3040 O O . HIS B 5 ? 0.7705 1.8464 1.3814 -0.1210 0.2680 -0.2555 4 HIS B O 3041 C CB . HIS B 5 ? 0.7728 1.8818 1.4391 -0.0655 0.2002 -0.2601 4 HIS B CB 3042 C CG . HIS B 5 ? 0.7797 1.8878 1.4456 -0.0321 0.2096 -0.2671 4 HIS B CG 3043 N ND1 . HIS B 5 ? 0.7801 1.9395 1.4908 0.0016 0.2015 -0.2815 4 HIS B ND1 3044 C CD2 . HIS B 5 ? 0.7826 1.8430 1.4077 -0.0265 0.2252 -0.2622 4 HIS B CD2 3045 C CE1 . HIS B 5 ? 0.7915 1.9330 1.4885 0.0265 0.2126 -0.2856 4 HIS B CE1 3046 N NE2 . HIS B 5 ? 0.7888 1.8709 1.4339 0.0094 0.2270 -0.2742 4 HIS B NE2 3047 N N . PRO B 6 ? 0.7512 1.7737 1.3328 -0.1505 0.2386 -0.2361 5 PRO B N 3048 C CA . PRO B 6 ? 0.7530 1.7208 1.2838 -0.1718 0.2573 -0.2244 5 PRO B CA 3049 C C . PRO B 6 ? 0.7273 1.6322 1.2132 -0.1457 0.2520 -0.2152 5 PRO B C 3050 O O . PRO B 6 ? 0.7092 1.5955 1.1929 -0.1184 0.2294 -0.2125 5 PRO B O 3051 C CB . PRO B 6 ? 0.7621 1.6974 1.2721 -0.2032 0.2477 -0.2127 5 PRO B CB 3052 C CG . PRO B 6 ? 0.7447 1.6868 1.2730 -0.1857 0.2174 -0.2134 5 PRO B CG 3053 C CD . PRO B 6 ? 0.7375 1.7454 1.3179 -0.1574 0.2126 -0.2294 5 PRO B CD 3054 N N . PRO B 7 ? 0.7257 1.5969 1.1745 -0.1553 0.2726 -0.2102 6 PRO B N 3055 C CA . PRO B 7 ? 0.7159 1.5244 1.1198 -0.1343 0.2670 -0.2012 6 PRO B CA 3056 C C . PRO B 7 ? 0.7007 1.4475 1.0684 -0.1369 0.2454 -0.1849 6 PRO B C 3057 O O . PRO B 7 ? 0.7023 1.4395 1.0637 -0.1635 0.2414 -0.1778 6 PRO B O 3058 C CB . PRO B 7 ? 0.7410 1.5302 1.1124 -0.1516 0.2940 -0.1990 6 PRO B CB 3059 C CG . PRO B 7 ? 0.7533 1.5739 1.1385 -0.1891 0.3101 -0.1999 6 PRO B CG 3060 C CD . PRO B 7 ? 0.7428 1.6310 1.1874 -0.1866 0.3016 -0.2122 6 PRO B CD 3061 N N . VAL B 8 ? 0.6935 1.4006 1.0394 -0.1093 0.2317 -0.1800 7 VAL B N 3062 C CA . VAL B 8 ? 0.6771 1.3328 0.9947 -0.1065 0.2100 -0.1664 7 VAL B CA 3063 C C . VAL B 8 ? 0.6831 1.2758 0.9519 -0.1003 0.2120 -0.1562 7 VAL B C 3064 O O . VAL B 8 ? 0.6852 1.2732 0.9489 -0.0796 0.2180 -0.1614 7 VAL B O 3065 C CB . VAL B 8 ? 0.6674 1.3377 1.0093 -0.0780 0.1863 -0.1696 7 VAL B CB 3066 C CG1 . VAL B 8 ? 0.6671 1.2799 0.9746 -0.0714 0.1660 -0.1554 7 VAL B CG1 3067 C CG2 . VAL B 8 ? 0.6576 1.3869 1.0454 -0.0864 0.1799 -0.1784 7 VAL B CG2 3068 N N . VAL B 9 ? 0.6829 1.2282 0.9169 -0.1176 0.2062 -0.1427 8 VAL B N 3069 C CA . VAL B 9 ? 0.6838 1.1684 0.8722 -0.1121 0.2040 -0.1320 8 VAL B CA 3070 C C . VAL B 9 ? 0.6727 1.1228 0.8482 -0.1032 0.1807 -0.1221 8 VAL B C 3071 O O . VAL B 9 ? 0.6658 1.1172 0.8459 -0.1172 0.1714 -0.1180 8 VAL B O 3072 C CB . VAL B 9 ? 0.7005 1.1565 0.8554 -0.1400 0.2187 -0.1242 8 VAL B CB 3073 C CG1 . VAL B 9 ? 0.7154 1.1095 0.8250 -0.1350 0.2124 -0.1126 8 VAL B CG1 3074 C CG2 . VAL B 9 ? 0.7135 1.1995 0.8751 -0.1481 0.2433 -0.1332 8 VAL B CG2 3075 N N . LEU B 10 ? 0.6650 1.0848 0.8241 -0.0801 0.1721 -0.1190 9 LEU B N 3076 C CA . LEU B 10 ? 0.6457 1.0329 0.7914 -0.0693 0.1516 -0.1098 9 LEU B CA 3077 C C . LEU B 10 ? 0.6598 0.9910 0.7626 -0.0774 0.1512 -0.0980 9 LEU B C 3078 O O . LEU B 10 ? 0.6622 0.9725 0.7447 -0.0734 0.1604 -0.0980 9 LEU B O 3079 C CB . LEU B 10 ? 0.6423 1.0330 0.7995 -0.0383 0.1415 -0.1139 9 LEU B CB 3080 C CG . LEU B 10 ? 0.6468 1.0932 0.8475 -0.0245 0.1405 -0.1265 9 LEU B CG 3081 C CD1 . LEU B 10 ? 0.6519 1.0926 0.8578 0.0076 0.1310 -0.1295 9 LEU B CD1 3082 C CD2 . LEU B 10 ? 0.6381 1.1127 0.8617 -0.0333 0.1281 -0.1264 9 LEU B CD2 3083 N N . VAL B 11 ? 0.6646 0.9726 0.7542 -0.0877 0.1399 -0.0889 10 VAL B N 3084 C CA . VAL B 11 ? 0.6594 0.9178 0.7119 -0.0951 0.1377 -0.0780 10 VAL B CA 3085 C C . VAL B 11 ? 0.6382 0.8728 0.6830 -0.0811 0.1198 -0.0713 10 VAL B C 3086 O O . VAL B 11 ? 0.6225 0.8666 0.6781 -0.0829 0.1089 -0.0702 10 VAL B O 3087 C CB . VAL B 11 ? 0.6632 0.9120 0.7039 -0.1217 0.1420 -0.0731 10 VAL B CB 3088 C CG1 . VAL B 11 ? 0.6623 0.8611 0.6653 -0.1268 0.1401 -0.0626 10 VAL B CG1 3089 C CG2 . VAL B 11 ? 0.6719 0.9492 0.7232 -0.1384 0.1603 -0.0795 10 VAL B CG2 3090 N N . PRO B 12 ? 0.6418 0.8451 0.6668 -0.0680 0.1171 -0.0671 11 PRO B N 3091 C CA . PRO B 12 ? 0.6286 0.8108 0.6467 -0.0546 0.1018 -0.0608 11 PRO B CA 3092 C C . PRO B 12 ? 0.6152 0.7644 0.6098 -0.0658 0.0957 -0.0511 11 PRO B C 3093 O O . PRO B 12 ? 0.6072 0.7445 0.5880 -0.0823 0.1025 -0.0487 11 PRO B O 3094 C CB . PRO B 12 ? 0.6413 0.8048 0.6490 -0.0382 0.1035 -0.0616 11 PRO B CB 3095 C CG . PRO B 12 ? 0.6568 0.8112 0.6491 -0.0495 0.1179 -0.0635 11 PRO B CG 3096 C CD . PRO B 12 ? 0.6580 0.8447 0.6657 -0.0655 0.1281 -0.0686 11 PRO B CD 3097 N N . GLY B 13 ? 0.6105 0.7450 0.6003 -0.0561 0.0831 -0.0456 12 GLY B N 3098 C CA . GLY B 13 ? 0.6127 0.7174 0.5818 -0.0635 0.0772 -0.0374 12 GLY B CA 3099 C C . GLY B 13 ? 0.6329 0.7045 0.5810 -0.0572 0.0768 -0.0319 12 GLY B C 3100 O O . GLY B 13 ? 0.6341 0.7020 0.5798 -0.0502 0.0825 -0.0347 12 GLY B O 3101 N N . ASP B 14 ? 0.6549 0.7039 0.5887 -0.0599 0.0699 -0.0249 13 ASP B N 3102 C CA . ASP B 14 ? 0.6801 0.6999 0.5963 -0.0553 0.0679 -0.0195 13 ASP B CA 3103 C C . ASP B 14 ? 0.6755 0.6936 0.5962 -0.0392 0.0642 -0.0196 13 ASP B C 3104 O O . ASP B 14 ? 0.6661 0.6976 0.5983 -0.0303 0.0580 -0.0198 13 ASP B O 3105 C CB . ASP B 14 ? 0.7099 0.7129 0.6153 -0.0597 0.0610 -0.0131 13 ASP B CB 3106 C CG . ASP B 14 ? 0.7492 0.7250 0.6375 -0.0602 0.0606 -0.0083 13 ASP B CG 3107 O OD1 . ASP B 14 ? 0.7601 0.7277 0.6430 -0.0574 0.0647 -0.0098 13 ASP B OD1 3108 O OD2 . ASP B 14 ? 0.7642 0.7281 0.6450 -0.0634 0.0560 -0.0040 13 ASP B OD2 3109 N N . LEU B 15 ? 0.6776 0.6770 0.5875 -0.0353 0.0671 -0.0194 14 LEU B N 3110 C CA . LEU B 15 ? 0.6777 0.6702 0.5894 -0.0204 0.0646 -0.0203 14 LEU B CA 3111 C C . LEU B 15 ? 0.6634 0.6800 0.5927 -0.0101 0.0679 -0.0284 14 LEU B C 3112 O O . LEU B 15 ? 0.6805 0.6923 0.6131 0.0045 0.0644 -0.0294 14 LEU B O 3113 C CB . LEU B 15 ? 0.6913 0.6731 0.6007 -0.0135 0.0547 -0.0131 14 LEU B CB 3114 C CG . LEU B 15 ? 0.7058 0.6688 0.6017 -0.0218 0.0511 -0.0055 14 LEU B CG 3115 C CD1 . LEU B 15 ? 0.7289 0.6843 0.6225 -0.0141 0.0432 0.0010 14 LEU B CD1 3116 C CD2 . LEU B 15 ? 0.7016 0.6423 0.5838 -0.0267 0.0543 -0.0049 14 LEU B CD2 3117 N N . GLY B 16 ? 0.6472 0.6886 0.5874 -0.0177 0.0752 -0.0342 15 GLY B N 3118 C CA . GLY B 16 ? 0.6337 0.7076 0.5970 -0.0091 0.0773 -0.0421 15 GLY B CA 3119 C C . GLY B 16 ? 0.6286 0.7113 0.5967 -0.0028 0.0877 -0.0513 15 GLY B C 3120 O O . GLY B 16 ? 0.6292 0.7434 0.6190 0.0034 0.0914 -0.0593 15 GLY B O 3121 N N . ASN B 17 ? 0.6223 0.6788 0.5709 -0.0038 0.0924 -0.0512 16 ASN B N 3122 C CA . ASN B 17 ? 0.6356 0.6959 0.5854 0.0048 0.1015 -0.0608 16 ASN B CA 3123 C C . ASN B 17 ? 0.6421 0.6655 0.5694 0.0090 0.1000 -0.0595 16 ASN B C 3124 O O . ASN B 17 ? 0.6488 0.6465 0.5589 0.0008 0.0944 -0.0512 16 ASN B O 3125 C CB . ASN B 17 ? 0.6318 0.7150 0.5849 -0.0074 0.1160 -0.0676 16 ASN B CB 3126 C CG . ASN B 17 ? 0.6298 0.6955 0.5611 -0.0273 0.1193 -0.0612 16 ASN B CG 3127 O OD1 . ASN B 17 ? 0.6128 0.6925 0.5491 -0.0412 0.1212 -0.0585 16 ASN B OD1 3128 N ND2 . ASN B 17 ? 0.6427 0.6774 0.5495 -0.0287 0.1195 -0.0592 16 ASN B ND2 3129 N N . GLN B 18 ? 0.6600 0.6817 0.5886 0.0224 0.1046 -0.0685 17 GLN B N 3130 C CA . GLN B 18 ? 0.6862 0.6725 0.5936 0.0264 0.1031 -0.0692 17 GLN B CA 3131 C C . GLN B 18 ? 0.6966 0.6682 0.5813 0.0096 0.1088 -0.0679 17 GLN B C 3132 O O . GLN B 18 ? 0.6943 0.6841 0.5789 -0.0018 0.1179 -0.0697 17 GLN B O 3133 C CB . GLN B 18 ? 0.7134 0.7015 0.6255 0.0435 0.1084 -0.0813 17 GLN B CB 3134 C CG . GLN B 18 ? 0.7240 0.7180 0.6545 0.0632 0.1000 -0.0818 17 GLN B CG 3135 C CD . GLN B 18 ? 0.7489 0.7429 0.6844 0.0826 0.1048 -0.0947 17 GLN B CD 3136 O OE1 . GLN B 18 ? 0.7714 0.7503 0.6911 0.0817 0.1127 -0.1027 17 GLN B OE1 3137 N NE2 . GLN B 18 ? 0.7481 0.7586 0.7050 0.1012 0.0994 -0.0974 17 GLN B NE2 3138 N N . LEU B 19 ? 0.7157 0.6538 0.5810 0.0078 0.1027 -0.0642 18 LEU B N 3139 C CA . LEU B 19 ? 0.7251 0.6452 0.5668 -0.0041 0.1059 -0.0645 18 LEU B CA 3140 C C . LEU B 19 ? 0.7505 0.6434 0.5776 0.0037 0.1043 -0.0711 18 LEU B C 3141 O O . LEU B 19 ? 0.7483 0.6255 0.5795 0.0138 0.0966 -0.0697 18 LEU B O 3142 C CB . LEU B 19 ? 0.7055 0.6123 0.5385 -0.0170 0.0975 -0.0530 18 LEU B CB 3143 C CG . LEU B 19 ? 0.6806 0.6073 0.5222 -0.0273 0.0985 -0.0468 18 LEU B CG 3144 C CD1 . LEU B 19 ? 0.6761 0.5864 0.5091 -0.0363 0.0894 -0.0368 18 LEU B CD1 3145 C CD2 . LEU B 19 ? 0.6913 0.6315 0.5259 -0.0370 0.1099 -0.0509 18 LEU B CD2 3146 N N . GLU B 20 ? 0.7721 0.6569 0.5798 -0.0018 0.1111 -0.0777 19 GLU B N 3147 C CA . GLU B 20 ? 0.8003 0.6580 0.5909 0.0037 0.1097 -0.0856 19 GLU B CA 3148 C C . GLU B 20 ? 0.8105 0.6470 0.5766 -0.0101 0.1052 -0.0823 19 GLU B C 3149 O O . GLU B 20 ? 0.8247 0.6701 0.5830 -0.0223 0.1079 -0.0775 19 GLU B O 3150 C CB . GLU B 20 ? 0.8399 0.7086 0.6287 0.0132 0.1223 -0.1001 19 GLU B CB 3151 C CG . GLU B 20 ? 0.8469 0.7362 0.6616 0.0306 0.1252 -0.1054 19 GLU B CG 3152 C CD . GLU B 20 ? 0.8767 0.7813 0.6925 0.0411 0.1390 -0.1212 19 GLU B CD 3153 O OE1 . GLU B 20 ? 0.8919 0.7962 0.6880 0.0325 0.1487 -0.1272 19 GLU B OE1 3154 O OE2 . GLU B 20 ? 0.8823 0.8003 0.7184 0.0587 0.1403 -0.1278 19 GLU B OE2 3155 N N . ALA B 21 ? 0.8106 0.6183 0.5642 -0.0086 0.0977 -0.0849 20 ALA B N 3156 C CA . ALA B 21 ? 0.7983 0.5872 0.5305 -0.0209 0.0914 -0.0828 20 ALA B CA 3157 C C . ALA B 21 ? 0.8206 0.5852 0.5328 -0.0178 0.0908 -0.0945 20 ALA B C 3158 O O . ALA B 21 ? 0.8429 0.5968 0.5590 -0.0058 0.0919 -0.1024 20 ALA B O 3159 C CB . ALA B 21 ? 0.7901 0.5700 0.5295 -0.0276 0.0792 -0.0712 20 ALA B CB 3160 N N . LYS B 22 ? 0.8260 0.5804 0.5152 -0.0284 0.0882 -0.0958 21 LYS B N 3161 C CA . LYS B 22 ? 0.8578 0.5869 0.5242 -0.0283 0.0851 -0.1071 21 LYS B CA 3162 C C . LYS B 22 ? 0.8518 0.5665 0.5068 -0.0411 0.0719 -0.1012 21 LYS B C 3163 O O . LYS B 22 ? 0.8329 0.5590 0.4864 -0.0500 0.0694 -0.0919 21 LYS B O 3164 C CB . LYS B 22 ? 0.8833 0.6181 0.5285 -0.0272 0.0972 -0.1179 21 LYS B CB 3165 C CG . LYS B 22 ? 0.9259 0.6343 0.5443 -0.0269 0.0942 -0.1310 21 LYS B CG 3166 C CD . LYS B 22 ? 0.9570 0.6727 0.5579 -0.0212 0.1094 -0.1443 21 LYS B CD 3167 C CE . LYS B 22 ? 1.0019 0.6903 0.5728 -0.0211 0.1062 -0.1585 21 LYS B CE 3168 N NZ . LYS B 22 ? 1.0404 0.7383 0.5916 -0.0166 0.1225 -0.1711 21 LYS B NZ 3169 N N . LEU B 23 ? 0.8694 0.5592 0.5167 -0.0422 0.0630 -0.1070 22 LEU B N 3170 C CA . LEU B 23 ? 0.8801 0.5598 0.5244 -0.0541 0.0490 -0.1014 22 LEU B CA 3171 C C . LEU B 23 ? 0.9211 0.5808 0.5382 -0.0597 0.0428 -0.1122 22 LEU B C 3172 O O . LEU B 23 ? 0.9419 0.5841 0.5470 -0.0537 0.0459 -0.1251 22 LEU B O 3173 C CB . LEU B 23 ? 0.8646 0.5335 0.5286 -0.0543 0.0416 -0.0964 22 LEU B CB 3174 C CG . LEU B 23 ? 0.8419 0.5244 0.5310 -0.0474 0.0459 -0.0868 22 LEU B CG 3175 C CD1 . LEU B 23 ? 0.8478 0.5135 0.5488 -0.0495 0.0383 -0.0824 22 LEU B CD1 3176 C CD2 . LEU B 23 ? 0.8053 0.5135 0.5052 -0.0520 0.0469 -0.0752 22 LEU B CD2 3177 N N . ASP B 24 ? 0.9402 0.6022 0.5478 -0.0704 0.0330 -0.1074 23 ASP B N 3178 C CA . ASP B 24 ? 0.9857 0.6293 0.5713 -0.0779 0.0217 -0.1160 23 ASP B CA 3179 C C . ASP B 24 ? 0.9665 0.6181 0.5604 -0.0882 0.0077 -0.1059 23 ASP B C 3180 O O . ASP B 24 ? 0.9696 0.6266 0.5471 -0.0927 0.0026 -0.1033 23 ASP B O 3181 C CB . ASP B 24 ? 1.0410 0.6807 0.5931 -0.0768 0.0274 -0.1253 23 ASP B CB 3182 C CG . ASP B 24 ? 1.1092 0.7262 0.6357 -0.0824 0.0165 -0.1379 23 ASP B CG 3183 O OD1 . ASP B 24 ? 1.1288 0.7359 0.6647 -0.0894 0.0029 -0.1381 23 ASP B OD1 3184 O OD2 . ASP B 24 ? 1.1766 0.7862 0.6727 -0.0805 0.0220 -0.1481 23 ASP B OD2 3185 N N . LYS B 25 ? 0.9670 0.6203 0.5866 -0.0913 0.0018 -0.0997 24 LYS B N 3186 C CA . LYS B 25 ? 0.9440 0.6119 0.5796 -0.0988 -0.0084 -0.0890 24 LYS B CA 3187 C C . LYS B 25 ? 0.9643 0.6225 0.5930 -0.1088 -0.0240 -0.0953 24 LYS B C 3188 O O . LYS B 25 ? 0.9557 0.5949 0.5802 -0.1118 -0.0269 -0.1049 24 LYS B O 3189 C CB . LYS B 25 ? 0.9092 0.5851 0.5753 -0.0980 -0.0058 -0.0800 24 LYS B CB 3190 C CG . LYS B 25 ? 0.9003 0.5880 0.5760 -0.0885 0.0073 -0.0738 24 LYS B CG 3191 C CD . LYS B 25 ? 0.8857 0.5725 0.5840 -0.0857 0.0105 -0.0685 24 LYS B CD 3192 C CE . LYS B 25 ? 0.8583 0.5589 0.5776 -0.0925 0.0043 -0.0578 24 LYS B CE 3193 N NZ . LYS B 25 ? 0.8214 0.5440 0.5499 -0.0892 0.0085 -0.0484 24 LYS B NZ 3194 N N . PRO B 26 ? 0.9769 0.6477 0.6051 -0.1140 -0.0350 -0.0902 25 PRO B N 3195 C CA . PRO B 26 ? 1.0046 0.6717 0.6323 -0.1237 -0.0514 -0.0958 25 PRO B CA 3196 C C . PRO B 26 ? 1.0085 0.6801 0.6673 -0.1312 -0.0557 -0.0931 25 PRO B C 3197 O O . PRO B 26 ? 1.0459 0.7068 0.7049 -0.1403 -0.0650 -0.1014 25 PRO B O 3198 C CB . PRO B 26 ? 1.0053 0.6880 0.6276 -0.1242 -0.0613 -0.0892 25 PRO B CB 3199 C CG . PRO B 26 ? 0.9905 0.6876 0.6242 -0.1172 -0.0507 -0.0770 25 PRO B CG 3200 C CD . PRO B 26 ? 0.9826 0.6710 0.6114 -0.1108 -0.0337 -0.0794 25 PRO B CD 3201 N N . THR B 27 ? 0.9723 0.6591 0.6556 -0.1283 -0.0486 -0.0818 26 THR B N 3202 C CA . THR B 27 ? 0.9614 0.6543 0.6729 -0.1357 -0.0505 -0.0776 26 THR B CA 3203 C C . THR B 27 ? 0.9257 0.6207 0.6513 -0.1292 -0.0369 -0.0690 26 THR B C 3204 O O . THR B 27 ? 0.9264 0.6262 0.6460 -0.1192 -0.0278 -0.0649 26 THR B O 3205 C CB . THR B 27 ? 0.9543 0.6726 0.6857 -0.1412 -0.0610 -0.0717 26 THR B CB 3206 O OG1 . THR B 27 ? 0.9314 0.6666 0.6666 -0.1323 -0.0563 -0.0621 26 THR B OG1 3207 C CG2 . THR B 27 ? 0.9714 0.6901 0.6905 -0.1471 -0.0772 -0.0800 26 THR B CG2 3208 N N . VAL B 28 ? 0.8993 0.5911 0.6432 -0.1355 -0.0358 -0.0661 27 VAL B N 3209 C CA . VAL B 28 ? 0.8726 0.5662 0.6295 -0.1300 -0.0247 -0.0569 27 VAL B CA 3210 C C . VAL B 28 ? 0.8423 0.5539 0.6247 -0.1380 -0.0263 -0.0483 27 VAL B C 3211 O O . VAL B 28 ? 0.8187 0.5366 0.6108 -0.1495 -0.0351 -0.0509 27 VAL B O 3212 C CB . VAL B 28 ? 0.8952 0.5604 0.6441 -0.1275 -0.0190 -0.0610 27 VAL B CB 3213 C CG1 . VAL B 28 ? 0.9096 0.5643 0.6383 -0.1147 -0.0123 -0.0674 27 VAL B CG1 3214 C CG2 . VAL B 28 ? 0.9151 0.5597 0.6606 -0.1401 -0.0271 -0.0693 27 VAL B CG2 3215 N N . VAL B 29 ? 0.8280 0.5489 0.6214 -0.1323 -0.0175 -0.0385 28 VAL B N 3216 C CA . VAL B 29 ? 0.8113 0.5502 0.6274 -0.1390 -0.0166 -0.0301 28 VAL B CA 3217 C C . VAL B 29 ? 0.8419 0.5653 0.6648 -0.1497 -0.0147 -0.0283 28 VAL B C 3218 O O . VAL B 29 ? 0.8390 0.5777 0.6802 -0.1602 -0.0159 -0.0243 28 VAL B O 3219 C CB . VAL B 29 ? 0.7720 0.5264 0.5952 -0.1295 -0.0082 -0.0207 28 VAL B CB 3220 C CG1 . VAL B 29 ? 0.7482 0.5166 0.5653 -0.1211 -0.0099 -0.0214 28 VAL B CG1 3221 C CG2 . VAL B 29 ? 0.7749 0.5120 0.5906 -0.1218 0.0004 -0.0175 28 VAL B CG2 3222 N N . HIS B 30 ? 0.8737 0.5677 0.6823 -0.1468 -0.0115 -0.0310 29 HIS B N 3223 C CA . HIS B 30 ? 0.8977 0.5696 0.7081 -0.1560 -0.0095 -0.0282 29 HIS B CA 3224 C C . HIS B 30 ? 0.9097 0.5472 0.7010 -0.1561 -0.0130 -0.0390 29 HIS B C 3225 O O . HIS B 30 ? 0.9197 0.5498 0.6954 -0.1440 -0.0125 -0.0461 29 HIS B O 3226 C CB . HIS B 30 ? 0.9210 0.5888 0.7324 -0.1476 0.0000 -0.0173 29 HIS B CB 3227 C CG . HIS B 30 ? 0.9865 0.6381 0.8021 -0.1588 0.0027 -0.0099 29 HIS B CG 3228 N ND1 . HIS B 30 ? 1.0276 0.6993 0.8605 -0.1714 0.0046 -0.0027 29 HIS B ND1 3229 C CD2 . HIS B 30 ? 1.0393 0.6554 0.8427 -0.1592 0.0045 -0.0083 29 HIS B CD2 3230 C CE1 . HIS B 30 ? 1.0538 0.7032 0.8841 -0.1809 0.0081 0.0036 29 HIS B CE1 3231 N NE2 . HIS B 30 ? 1.0792 0.6928 0.8910 -0.1736 0.0075 0.0007 29 HIS B NE2 3232 N N . TYR B 31 ? 0.9051 0.5212 0.6968 -0.1700 -0.0161 -0.0409 30 TYR B N 3233 C CA . TYR B 31 ? 0.9319 0.5122 0.7046 -0.1701 -0.0196 -0.0519 30 TYR B CA 3234 C C . TYR B 31 ? 0.9475 0.5002 0.7044 -0.1541 -0.0133 -0.0520 30 TYR B C 3235 O O . TYR B 31 ? 0.9764 0.5059 0.7158 -0.1479 -0.0152 -0.0636 30 TYR B O 3236 C CB . TYR B 31 ? 0.9536 0.5150 0.7312 -0.1907 -0.0243 -0.0531 30 TYR B CB 3237 C CG . TYR B 31 ? 0.9508 0.4998 0.7357 -0.1979 -0.0175 -0.0401 30 TYR B CG 3238 C CD1 . TYR B 31 ? 0.9790 0.4891 0.7481 -0.1904 -0.0132 -0.0372 30 TYR B CD1 3239 C CD2 . TYR B 31 ? 0.9293 0.5039 0.7356 -0.2128 -0.0157 -0.0311 30 TYR B CD2 3240 C CE1 . TYR B 31 ? 0.9942 0.4892 0.7657 -0.1976 -0.0077 -0.0242 30 TYR B CE1 3241 C CE2 . TYR B 31 ? 0.9338 0.4961 0.7435 -0.2208 -0.0085 -0.0188 30 TYR B CE2 3242 C CZ . TYR B 31 ? 0.9770 0.4980 0.7678 -0.2136 -0.0049 -0.0148 30 TYR B CZ 3243 O OH . TYR B 31 ? 0.9939 0.4986 0.7839 -0.2217 0.0015 -0.0014 30 TYR B OH 3244 N N . LEU B 32 ? 0.9416 0.5000 0.7043 -0.1451 -0.0057 -0.0401 31 LEU B N 3245 C CA . LEU B 32 ? 0.9571 0.4944 0.7076 -0.1272 -0.0005 -0.0400 31 LEU B CA 3246 C C . LEU B 32 ? 0.9504 0.5070 0.6965 -0.1103 0.0027 -0.0457 31 LEU B C 3247 O O . LEU B 32 ? 0.9661 0.5096 0.7039 -0.0946 0.0069 -0.0483 31 LEU B O 3248 C CB . LEU B 32 ? 0.9423 0.4782 0.6992 -0.1234 0.0050 -0.0250 31 LEU B CB 3249 C CG . LEU B 32 ? 0.9700 0.4798 0.7265 -0.1386 0.0041 -0.0174 31 LEU B CG 3250 C CD1 . LEU B 32 ? 0.9542 0.4709 0.7162 -0.1354 0.0100 -0.0012 31 LEU B CD1 3251 C CD2 . LEU B 32 ? 1.0052 0.4669 0.7436 -0.1364 0.0012 -0.0246 31 LEU B CD2 3252 N N . CYS B 33 ? 0.9351 0.5218 0.6868 -0.1137 0.0009 -0.0475 32 CYS B N 3253 C CA . CYS B 33 ? 0.9315 0.5368 0.6784 -0.1002 0.0050 -0.0512 32 CYS B CA 3254 C C . CYS B 33 ? 0.9549 0.5444 0.6826 -0.0967 0.0031 -0.0662 32 CYS B C 3255 O O . CYS B 33 ? 0.9722 0.5535 0.6934 -0.1080 -0.0042 -0.0735 32 CYS B O 3256 C CB . CYS B 33 ? 0.9166 0.5562 0.6739 -0.1050 0.0034 -0.0465 32 CYS B CB 3257 S SG . CYS B 33 ? 0.9525 0.6160 0.7315 -0.1083 0.0063 -0.0308 32 CYS B SG 3258 N N . SER B 34 ? 0.9562 0.5437 0.6752 -0.0812 0.0100 -0.0715 33 SER B N 3259 C CA . SER B 34 ? 0.9712 0.5480 0.6705 -0.0765 0.0105 -0.0863 33 SER B CA 3260 C C . SER B 34 ? 0.9591 0.5583 0.6522 -0.0822 0.0081 -0.0886 33 SER B C 3261 O O . SER B 34 ? 0.9407 0.5666 0.6428 -0.0801 0.0115 -0.0804 33 SER B O 3262 C CB . SER B 34 ? 0.9762 0.5539 0.6714 -0.0578 0.0204 -0.0910 33 SER B CB 3263 O OG . SER B 34 ? 1.0193 0.5652 0.7076 -0.0493 0.0211 -0.0979 33 SER B OG 3264 N N . LYS B 35 ? 0.9951 0.5809 0.6707 -0.0888 0.0018 -0.1000 34 LYS B N 3265 C CA . LYS B 35 ? 1.0086 0.6105 0.6721 -0.0929 -0.0016 -0.1030 34 LYS B CA 3266 C C . LYS B 35 ? 1.0201 0.6249 0.6654 -0.0812 0.0082 -0.1106 34 LYS B C 3267 O O . LYS B 35 ? 1.0102 0.6348 0.6499 -0.0813 0.0102 -0.1073 34 LYS B O 3268 C CB . LYS B 35 ? 1.0549 0.6424 0.7061 -0.1056 -0.0141 -0.1120 34 LYS B CB 3269 C CG . LYS B 35 ? 1.0866 0.6717 0.7568 -0.1191 -0.0230 -0.1064 34 LYS B CG 3270 C CD . LYS B 35 ? 1.1300 0.7088 0.7917 -0.1329 -0.0368 -0.1152 34 LYS B CD 3271 C CE . LYS B 35 ? 1.1264 0.7320 0.7869 -0.1357 -0.0438 -0.1119 34 LYS B CE 3272 N NZ . LYS B 35 ? 1.1544 0.7630 0.8200 -0.1507 -0.0593 -0.1160 34 LYS B NZ 3273 N N . LYS B 36 ? 1.0535 0.6387 0.6898 -0.0713 0.0145 -0.1208 35 LYS B N 3274 C CA . LYS B 36 ? 1.0652 0.6518 0.6822 -0.0617 0.0238 -0.1314 35 LYS B CA 3275 C C . LYS B 36 ? 1.0535 0.6337 0.6762 -0.0456 0.0346 -0.1362 35 LYS B C 3276 O O . LYS B 36 ? 1.0793 0.6372 0.7080 -0.0422 0.0318 -0.1378 35 LYS B O 3277 C CB . LYS B 36 ? 1.1121 0.6773 0.7011 -0.0672 0.0176 -0.1463 35 LYS B CB 3278 C CG . LYS B 36 ? 1.1474 0.7174 0.7117 -0.0600 0.0273 -0.1568 35 LYS B CG 3279 C CD . LYS B 36 ? 1.1989 0.7458 0.7330 -0.0659 0.0199 -0.1721 35 LYS B CD 3280 C CE . LYS B 36 ? 1.2275 0.7816 0.7330 -0.0616 0.0292 -0.1807 35 LYS B CE 3281 N NZ . LYS B 36 ? 1.2815 0.8145 0.7545 -0.0688 0.0199 -0.1946 35 LYS B NZ 3282 N N . THR B 37 ? 1.0300 0.6303 0.6510 -0.0358 0.0467 -0.1382 36 THR B N 3283 C CA . THR B 37 ? 1.0293 0.6274 0.6548 -0.0185 0.0574 -0.1460 36 THR B CA 3284 C C . THR B 37 ? 1.0569 0.6600 0.6605 -0.0128 0.0679 -0.1604 36 THR B C 3285 O O . THR B 37 ? 1.0356 0.6542 0.6259 -0.0210 0.0703 -0.1588 36 THR B O 3286 C CB . THR B 37 ? 0.9827 0.6077 0.6347 -0.0103 0.0640 -0.1345 36 THR B CB 3287 O OG1 . THR B 37 ? 0.9504 0.6063 0.6027 -0.0146 0.0709 -0.1296 36 THR B OG1 3288 C CG2 . THR B 37 ? 0.9620 0.5840 0.6330 -0.0165 0.0547 -0.1198 36 THR B CG2 3289 N N . GLU B 38 ? 1.0961 0.6842 0.6940 0.0013 0.0744 -0.1745 37 GLU B N 3290 C CA . GLU B 38 ? 1.1439 0.7373 0.7216 0.0086 0.0866 -0.1900 37 GLU B CA 3291 C C . GLU B 38 ? 1.1162 0.7480 0.7081 0.0163 0.1019 -0.1870 37 GLU B C 3292 O O . GLU B 38 ? 1.1012 0.7468 0.6761 0.0160 0.1132 -0.1949 37 GLU B O 3293 C CB . GLU B 38 ? 1.2115 0.7760 0.7803 0.0233 0.0887 -0.2076 37 GLU B CB 3294 C CG . GLU B 38 ? 1.2778 0.8010 0.8278 0.0149 0.0750 -0.2147 37 GLU B CG 3295 C CD . GLU B 38 ? 1.3160 0.8319 0.8323 0.0041 0.0733 -0.2255 37 GLU B CD 3296 O OE1 . GLU B 38 ? 1.3822 0.8743 0.8758 0.0109 0.0758 -0.2443 37 GLU B OE1 3297 O OE2 . GLU B 38 ? 1.2962 0.8286 0.8070 -0.0103 0.0689 -0.2156 37 GLU B OE2 3298 N N . SER B 39 ? 1.0896 0.7385 0.7115 0.0221 0.1022 -0.1757 38 SER B N 3299 C CA . SER B 39 ? 1.0699 0.7565 0.7090 0.0281 0.1152 -0.1728 38 SER B CA 3300 C C . SER B 39 ? 0.9941 0.6998 0.6580 0.0217 0.1097 -0.1541 38 SER B C 3301 O O . SER B 39 ? 0.9579 0.6483 0.6253 0.0135 0.0968 -0.1436 38 SER B O 3302 C CB . SER B 39 ? 1.1105 0.8010 0.7621 0.0499 0.1245 -0.1857 38 SER B CB 3303 O OG . SER B 39 ? 1.1425 0.8725 0.8069 0.0545 0.1396 -0.1876 38 SER B OG 3304 N N . TYR B 40 ? 0.9545 0.6950 0.6356 0.0248 0.1200 -0.1507 39 TYR B N 3305 C CA . TYR B 40 ? 0.9043 0.6644 0.6094 0.0207 0.1158 -0.1350 39 TYR B CA 3306 C C . TYR B 40 ? 0.9014 0.6542 0.6282 0.0348 0.1094 -0.1325 39 TYR B C 3307 O O . TYR B 40 ? 0.9305 0.6756 0.6600 0.0511 0.1129 -0.1439 39 TYR B O 3308 C CB . TYR B 40 ? 0.8781 0.6767 0.5945 0.0186 0.1285 -0.1333 39 TYR B CB 3309 C CG . TYR B 40 ? 0.8731 0.6763 0.5678 0.0017 0.1323 -0.1298 39 TYR B CG 3310 C CD1 . TYR B 40 ? 0.8860 0.6832 0.5538 -0.0001 0.1411 -0.1413 39 TYR B CD1 3311 C CD2 . TYR B 40 ? 0.8505 0.6616 0.5490 -0.0117 0.1266 -0.1151 39 TYR B CD2 3312 C CE1 . TYR B 40 ? 0.8847 0.6830 0.5290 -0.0153 0.1436 -0.1369 39 TYR B CE1 3313 C CE2 . TYR B 40 ? 0.8402 0.6517 0.5169 -0.0260 0.1289 -0.1110 39 TYR B CE2 3314 C CZ . TYR B 40 ? 0.8653 0.6699 0.5142 -0.0279 0.1371 -0.1213 39 TYR B CZ 3315 O OH . TYR B 40 ? 0.8578 0.6599 0.4817 -0.0417 0.1384 -0.1162 39 TYR B OH 3316 N N . PHE B 41 ? 0.8654 0.6185 0.6054 0.0290 0.0998 -0.1179 40 PHE B N 3317 C CA . PHE B 41 ? 0.8595 0.6076 0.6182 0.0408 0.0936 -0.1126 40 PHE B CA 3318 C C . PHE B 41 ? 0.8356 0.6127 0.6146 0.0364 0.0926 -0.0995 40 PHE B C 3319 O O . PHE B 41 ? 0.8298 0.6214 0.6061 0.0223 0.0940 -0.0934 40 PHE B O 3320 C CB . PHE B 41 ? 0.8697 0.5805 0.6192 0.0366 0.0815 -0.1077 40 PHE B CB 3321 C CG . PHE B 41 ? 0.8588 0.5681 0.6049 0.0180 0.0741 -0.0955 40 PHE B CG 3322 C CD1 . PHE B 41 ? 0.8646 0.5671 0.5921 0.0047 0.0730 -0.0986 40 PHE B CD1 3323 C CD2 . PHE B 41 ? 0.8366 0.5527 0.5977 0.0148 0.0681 -0.0814 40 PHE B CD2 3324 C CE1 . PHE B 41 ? 0.8476 0.5513 0.5744 -0.0104 0.0657 -0.0882 40 PHE B CE1 3325 C CE2 . PHE B 41 ? 0.8166 0.5336 0.5760 -0.0009 0.0622 -0.0715 40 PHE B CE2 3326 C CZ . PHE B 41 ? 0.8216 0.5331 0.5653 -0.0130 0.0608 -0.0750 40 PHE B CZ 3327 N N . THR B 42 ? 0.8274 0.6111 0.6251 0.0489 0.0894 -0.0956 41 THR B N 3328 C CA . THR B 42 ? 0.7961 0.6061 0.6123 0.0456 0.0873 -0.0843 41 THR B CA 3329 C C . THR B 42 ? 0.7962 0.5915 0.6079 0.0326 0.0775 -0.0706 41 THR B C 3330 O O . THR B 42 ? 0.8269 0.5961 0.6348 0.0352 0.0695 -0.0660 41 THR B O 3331 C CB . THR B 42 ? 0.7862 0.6086 0.6228 0.0639 0.0853 -0.0844 41 THR B CB 3332 O OG1 . THR B 42 ? 0.7884 0.6329 0.6340 0.0758 0.0955 -0.0978 41 THR B OG1 3333 C CG2 . THR B 42 ? 0.7623 0.6101 0.6157 0.0594 0.0815 -0.0730 41 THR B CG2 3334 N N . ILE B 43 ? 0.7798 0.5918 0.5919 0.0186 0.0786 -0.0643 42 ILE B N 3335 C CA . ILE B 43 ? 0.7698 0.5734 0.5799 0.0067 0.0705 -0.0523 42 ILE B CA 3336 C C . ILE B 43 ? 0.7579 0.5816 0.5848 0.0078 0.0678 -0.0427 42 ILE B C 3337 O O . ILE B 43 ? 0.7502 0.5664 0.5774 0.0020 0.0612 -0.0331 42 ILE B O 3338 C CB . ILE B 43 ? 0.7641 0.5666 0.5606 -0.0087 0.0713 -0.0517 42 ILE B CB 3339 C CG1 . ILE B 43 ? 0.7624 0.5492 0.5550 -0.0187 0.0621 -0.0428 42 ILE B CG1 3340 C CG2 . ILE B 43 ? 0.7468 0.5768 0.5487 -0.0147 0.0773 -0.0497 42 ILE B CG2 3341 C CD1 . ILE B 43 ? 0.7650 0.5491 0.5446 -0.0316 0.0604 -0.0427 42 ILE B CD1 3342 N N . TRP B 44 ? 0.7608 0.6117 0.6017 0.0146 0.0731 -0.0462 43 TRP B N 3343 C CA . TRP B 44 ? 0.7554 0.6255 0.6127 0.0186 0.0694 -0.0395 43 TRP B CA 3344 C C . TRP B 44 ? 0.7689 0.6600 0.6421 0.0339 0.0733 -0.0475 43 TRP B C 3345 O O . TRP B 44 ? 0.7560 0.6654 0.6327 0.0333 0.0827 -0.0564 43 TRP B O 3346 C CB . TRP B 44 ? 0.7449 0.6347 0.6058 0.0051 0.0709 -0.0344 43 TRP B CB 3347 C CG . TRP B 44 ? 0.7357 0.6441 0.6113 0.0080 0.0663 -0.0285 43 TRP B CG 3348 C CD1 . TRP B 44 ? 0.7282 0.6666 0.6204 0.0115 0.0693 -0.0321 43 TRP B CD1 3349 C CD2 . TRP B 44 ? 0.7328 0.6316 0.6072 0.0072 0.0580 -0.0185 43 TRP B CD2 3350 N NE1 . TRP B 44 ? 0.7212 0.6685 0.6218 0.0133 0.0619 -0.0253 43 TRP B NE1 3351 C CE2 . TRP B 44 ? 0.7251 0.6478 0.6136 0.0109 0.0554 -0.0167 43 TRP B CE2 3352 C CE3 . TRP B 44 ? 0.7612 0.6350 0.6240 0.0027 0.0528 -0.0114 43 TRP B CE3 3353 C CZ2 . TRP B 44 ? 0.7319 0.6522 0.6202 0.0113 0.0479 -0.0079 43 TRP B CZ2 3354 C CZ3 . TRP B 44 ? 0.7486 0.6215 0.6126 0.0025 0.0467 -0.0023 43 TRP B CZ3 3355 C CH2 . TRP B 44 ? 0.7350 0.6300 0.6101 0.0071 0.0443 -0.0006 43 TRP B CH2 3356 N N . LEU B 45 ? 0.8097 0.7003 0.6927 0.0479 0.0666 -0.0447 44 LEU B N 3357 C CA . LEU B 45 ? 0.8348 0.7031 0.7116 0.0491 0.0565 -0.0336 44 LEU B CA 3358 C C . LEU B 45 ? 0.8831 0.7186 0.7500 0.0608 0.0531 -0.0358 44 LEU B C 3359 O O . LEU B 45 ? 0.8958 0.7348 0.7705 0.0778 0.0537 -0.0434 44 LEU B O 3360 C CB . LEU B 45 ? 0.8356 0.7245 0.7269 0.0567 0.0503 -0.0280 44 LEU B CB 3361 C CG . LEU B 45 ? 0.8504 0.7177 0.7342 0.0612 0.0401 -0.0164 44 LEU B CG 3362 C CD1 . LEU B 45 ? 0.8395 0.6912 0.7100 0.0441 0.0389 -0.0071 44 LEU B CD1 3363 C CD2 . LEU B 45 ? 0.8417 0.7328 0.7391 0.0705 0.0337 -0.0129 44 LEU B CD2 3364 N N . ASN B 46 ? 0.9262 0.7304 0.7770 0.0518 0.0495 -0.0300 45 ASN B N 3365 C CA . ASN B 46 ? 0.9863 0.7542 0.8258 0.0603 0.0454 -0.0308 45 ASN B CA 3366 C C . ASN B 46 ? 1.0173 0.7620 0.8473 0.0521 0.0382 -0.0173 45 ASN B C 3367 O O . ASN B 46 ? 0.9800 0.7176 0.8024 0.0355 0.0387 -0.0134 45 ASN B O 3368 C CB . ASN B 46 ? 1.0113 0.7621 0.8384 0.0552 0.0504 -0.0414 45 ASN B CB 3369 C CG . ASN B 46 ? 1.0515 0.7628 0.8663 0.0640 0.0466 -0.0448 45 ASN B CG 3370 O OD1 . ASN B 46 ? 1.0412 0.7308 0.8529 0.0698 0.0395 -0.0364 45 ASN B OD1 3371 N ND2 . ASN B 46 ? 1.0812 0.7807 0.8866 0.0647 0.0513 -0.0575 45 ASN B ND2 3372 N N . LEU B 47 ? 1.0965 0.8309 0.9269 0.0641 0.0317 -0.0102 46 LEU B N 3373 C CA . LEU B 47 ? 1.1417 0.8593 0.9631 0.0566 0.0259 0.0040 46 LEU B CA 3374 C C . LEU B 47 ? 1.1556 0.8358 0.9610 0.0452 0.0252 0.0069 46 LEU B C 3375 O O . LEU B 47 ? 1.1101 0.7832 0.9095 0.0313 0.0241 0.0167 46 LEU B O 3376 C CB . LEU B 47 ? 1.2019 0.9125 1.0232 0.0734 0.0183 0.0112 46 LEU B CB 3377 C CG . LEU B 47 ? 1.1941 0.9434 1.0316 0.0820 0.0165 0.0113 46 LEU B CG 3378 C CD1 . LEU B 47 ? 1.2320 0.9725 1.0692 0.1026 0.0073 0.0158 46 LEU B CD1 3379 C CD2 . LEU B 47 ? 1.1583 0.9257 0.9960 0.0664 0.0169 0.0199 46 LEU B CD2 3380 N N . GLU B 48 ? 1.1751 0.8323 0.9739 0.0506 0.0261 -0.0026 47 GLU B N 3381 C CA . GLU B 48 ? 1.2156 0.8354 0.9994 0.0395 0.0245 -0.0014 47 GLU B CA 3382 C C . GLU B 48 ? 1.1448 0.7739 0.9280 0.0182 0.0277 -0.0024 47 GLU B C 3383 O O . GLU B 48 ? 1.1731 0.7786 0.9474 0.0046 0.0257 0.0017 47 GLU B O 3384 C CB . GLU B 48 ? 1.3337 0.9278 1.1101 0.0508 0.0249 -0.0143 47 GLU B CB 3385 C CG . GLU B 48 ? 1.4078 0.9836 1.1828 0.0735 0.0202 -0.0142 47 GLU B CG 3386 C CD . GLU B 48 ? 1.5006 1.0549 1.2699 0.0866 0.0217 -0.0297 47 GLU B CD 3387 O OE1 . GLU B 48 ? 1.5182 1.0941 1.2930 0.0869 0.0285 -0.0431 47 GLU B OE1 3388 O OE2 . GLU B 48 ? 1.5357 1.0498 1.2933 0.0968 0.0162 -0.0286 47 GLU B OE2 3389 N N . LEU B 49 ? 1.0702 0.7334 0.8632 0.0151 0.0322 -0.0076 48 LEU B N 3390 C CA . LEU B 49 ? 0.9997 0.6725 0.7920 -0.0023 0.0340 -0.0088 48 LEU B CA 3391 C C . LEU B 49 ? 0.9484 0.6350 0.7460 -0.0139 0.0327 0.0032 48 LEU B C 3392 O O . LEU B 49 ? 0.8842 0.5765 0.6823 -0.0286 0.0328 0.0037 48 LEU B O 3393 C CB . LEU B 49 ? 0.9567 0.6563 0.7540 -0.0008 0.0392 -0.0185 48 LEU B CB 3394 C CG . LEU B 49 ? 0.9734 0.6678 0.7669 0.0117 0.0430 -0.0318 48 LEU B CG 3395 C CD1 . LEU B 49 ? 0.9482 0.6722 0.7459 0.0104 0.0498 -0.0390 48 LEU B CD1 3396 C CD2 . LEU B 49 ? 1.0091 0.6698 0.7877 0.0080 0.0409 -0.0391 48 LEU B CD2 3397 N N . LEU B 50 ? 0.9771 0.6699 0.7784 -0.0066 0.0313 0.0120 49 LEU B N 3398 C CA . LEU B 50 ? 0.9960 0.7055 0.8018 -0.0153 0.0313 0.0220 49 LEU B CA 3399 C C . LEU B 50 ? 1.0129 0.7004 0.8104 -0.0220 0.0290 0.0336 49 LEU B C 3400 O O . LEU B 50 ? 1.0119 0.7119 0.8112 -0.0284 0.0298 0.0420 49 LEU B O 3401 C CB . LEU B 50 ? 1.0141 0.7498 0.8286 -0.0045 0.0314 0.0235 49 LEU B CB 3402 C CG . LEU B 50 ? 1.0340 0.7913 0.8572 0.0025 0.0347 0.0125 49 LEU B CG 3403 C CD1 . LEU B 50 ? 1.0467 0.8289 0.8801 0.0129 0.0338 0.0138 49 LEU B CD1 3404 C CD2 . LEU B 50 ? 0.9965 0.7676 0.8215 -0.0100 0.0383 0.0079 49 LEU B CD2 3405 N N . LEU B 51 ? 1.0454 0.6985 0.8323 -0.0216 0.0268 0.0336 50 LEU B N 3406 C CA . LEU B 51 ? 1.0656 0.6941 0.8428 -0.0320 0.0258 0.0446 50 LEU B CA 3407 C C . LEU B 51 ? 1.0599 0.6982 0.8421 -0.0523 0.0285 0.0459 50 LEU B C 3408 O O . LEU B 51 ? 1.0627 0.7158 0.8523 -0.0577 0.0293 0.0370 50 LEU B O 3409 C CB . LEU B 51 ? 1.1196 0.7062 0.8840 -0.0282 0.0227 0.0428 50 LEU B CB 3410 C CG . LEU B 51 ? 1.1328 0.7067 0.8932 -0.0057 0.0192 0.0393 50 LEU B CG 3411 C CD1 . LEU B 51 ? 1.1843 0.7125 0.9307 -0.0033 0.0161 0.0362 50 LEU B CD1 3412 C CD2 . LEU B 51 ? 1.1369 0.7165 0.8950 0.0047 0.0164 0.0511 50 LEU B CD2 3413 N N . PRO B 52 ? 1.0834 0.7136 0.8613 -0.0640 0.0301 0.0568 51 PRO B N 3414 C CA . PRO B 52 ? 1.0709 0.7224 0.8588 -0.0814 0.0336 0.0581 51 PRO B CA 3415 C C . PRO B 52 ? 1.0539 0.7177 0.8528 -0.0958 0.0336 0.0497 51 PRO B C 3416 O O . PRO B 52 ? 1.0898 0.7834 0.9003 -0.1015 0.0360 0.0504 51 PRO B O 3417 C CB . PRO B 52 ? 1.0995 0.7333 0.8781 -0.0915 0.0362 0.0712 51 PRO B CB 3418 C CG . PRO B 52 ? 1.1140 0.7359 0.8803 -0.0759 0.0342 0.0790 51 PRO B CG 3419 C CD . PRO B 52 ? 1.1134 0.7249 0.8787 -0.0592 0.0293 0.0696 51 PRO B CD 3420 N N . VAL B 53 ? 1.0158 0.6573 0.8109 -0.1023 0.0307 0.0432 52 VAL B N 3421 C CA . VAL B 53 ? 0.9953 0.6466 0.7987 -0.1133 0.0284 0.0343 52 VAL B CA 3422 C C . VAL B 53 ? 0.9476 0.6013 0.7482 -0.1016 0.0255 0.0227 52 VAL B C 3423 O O . VAL B 53 ? 0.9467 0.6209 0.7541 -0.1044 0.0237 0.0155 52 VAL B O 3424 C CB . VAL B 53 ? 1.0316 0.6537 0.8301 -0.1287 0.0264 0.0340 52 VAL B CB 3425 C CG1 . VAL B 53 ? 1.0248 0.6569 0.8322 -0.1412 0.0221 0.0238 52 VAL B CG1 3426 C CG2 . VAL B 53 ? 1.0261 0.6431 0.8246 -0.1405 0.0312 0.0471 52 VAL B CG2 3427 N N . ILE B 54 ? 0.9413 0.5721 0.7307 -0.0887 0.0249 0.0200 53 ILE B N 3428 C CA . ILE B 54 ? 0.9160 0.5508 0.7024 -0.0775 0.0241 0.0083 53 ILE B CA 3429 C C . ILE B 54 ? 0.8668 0.5358 0.6617 -0.0703 0.0268 0.0083 53 ILE B C 3430 O O . ILE B 54 ? 0.8351 0.5147 0.6294 -0.0676 0.0269 -0.0001 53 ILE B O 3431 C CB . ILE B 54 ? 0.9553 0.5608 0.7294 -0.0653 0.0231 0.0009 53 ILE B CB 3432 C CG1 . ILE B 54 ? 0.9712 0.5735 0.7439 -0.0482 0.0247 0.0063 53 ILE B CG1 3433 C CG2 . ILE B 54 ? 1.0055 0.5748 0.7699 -0.0758 0.0195 -0.0010 53 ILE B CG2 3434 C CD1 . ILE B 54 ? 1.0105 0.5926 0.7748 -0.0327 0.0242 -0.0040 53 ILE B CD1 3435 N N . ILE B 55 ? 0.8418 0.5271 0.6433 -0.0684 0.0291 0.0179 54 ILE B N 3436 C CA . ILE B 55 ? 0.8052 0.5220 0.6151 -0.0641 0.0312 0.0181 54 ILE B CA 3437 C C . ILE B 55 ? 0.7746 0.5085 0.5898 -0.0735 0.0299 0.0133 54 ILE B C 3438 O O . ILE B 55 ? 0.7560 0.5077 0.5734 -0.0694 0.0310 0.0097 54 ILE B O 3439 C CB . ILE B 55 ? 0.8019 0.5308 0.6165 -0.0646 0.0330 0.0291 54 ILE B CB 3440 C CG1 . ILE B 55 ? 0.7826 0.5400 0.6044 -0.0589 0.0348 0.0288 54 ILE B CG1 3441 C CG2 . ILE B 55 ? 0.7898 0.5209 0.6087 -0.0795 0.0335 0.0346 54 ILE B CG2 3442 C CD1 . ILE B 55 ? 0.8123 0.5729 0.6331 -0.0447 0.0352 0.0260 54 ILE B CD1 3443 N N . ASP B 56 ? 0.7736 0.5019 0.5910 -0.0863 0.0272 0.0134 55 ASP B N 3444 C CA . ASP B 56 ? 0.7683 0.5123 0.5909 -0.0938 0.0239 0.0085 55 ASP B CA 3445 C C . ASP B 56 ? 0.7833 0.5204 0.5956 -0.0901 0.0215 -0.0018 55 ASP B C 3446 O O . ASP B 56 ? 0.7724 0.5245 0.5847 -0.0900 0.0199 -0.0050 55 ASP B O 3447 C CB . ASP B 56 ? 0.7956 0.5381 0.6252 -0.1084 0.0206 0.0094 55 ASP B CB 3448 C CG . ASP B 56 ? 0.8106 0.5681 0.6517 -0.1138 0.0243 0.0187 55 ASP B CG 3449 O OD1 . ASP B 56 ? 0.7998 0.5758 0.6452 -0.1074 0.0273 0.0225 55 ASP B OD1 3450 O OD2 . ASP B 56 ? 0.8720 0.6225 0.7173 -0.1255 0.0246 0.0218 55 ASP B OD2 3451 N N . CYS B 57 ? 0.7897 0.5026 0.5917 -0.0868 0.0214 -0.0070 56 CYS B N 3452 C CA . CYS B 57 ? 0.7997 0.5049 0.5894 -0.0818 0.0209 -0.0177 56 CYS B CA 3453 C C . CYS B 57 ? 0.7664 0.4887 0.5557 -0.0706 0.0264 -0.0183 56 CYS B C 3454 O O . CYS B 57 ? 0.7565 0.4873 0.5392 -0.0704 0.0267 -0.0238 56 CYS B O 3455 C CB . CYS B 57 ? 0.8519 0.5266 0.6307 -0.0781 0.0207 -0.0237 56 CYS B CB 3456 S SG . CYS B 57 ? 0.9036 0.5531 0.6821 -0.0931 0.0150 -0.0225 56 CYS B SG 3457 N N . TRP B 58 ? 0.7447 0.4712 0.5400 -0.0619 0.0304 -0.0129 57 TRP B N 3458 C CA . TRP B 58 ? 0.7161 0.4606 0.5141 -0.0525 0.0355 -0.0136 57 TRP B CA 3459 C C . TRP B 58 ? 0.6887 0.4560 0.4916 -0.0579 0.0355 -0.0104 57 TRP B C 3460 O O . TRP B 58 ? 0.6800 0.4572 0.4784 -0.0564 0.0383 -0.0147 57 TRP B O 3461 C CB . TRP B 58 ? 0.7038 0.4500 0.5088 -0.0430 0.0375 -0.0076 57 TRP B CB 3462 C CG . TRP B 58 ? 0.6940 0.4617 0.5051 -0.0340 0.0419 -0.0088 57 TRP B CG 3463 C CD1 . TRP B 58 ? 0.7107 0.4817 0.5205 -0.0244 0.0462 -0.0168 57 TRP B CD1 3464 C CD2 . TRP B 58 ? 0.6686 0.4586 0.4891 -0.0346 0.0427 -0.0026 57 TRP B CD2 3465 N NE1 . TRP B 58 ? 0.6909 0.4868 0.5104 -0.0201 0.0497 -0.0157 57 TRP B NE1 3466 C CE2 . TRP B 58 ? 0.6631 0.4693 0.4884 -0.0264 0.0471 -0.0070 57 TRP B CE2 3467 C CE3 . TRP B 58 ? 0.6537 0.4521 0.4793 -0.0414 0.0406 0.0054 57 TRP B CE3 3468 C CZ2 . TRP B 58 ? 0.6561 0.4850 0.4906 -0.0259 0.0483 -0.0036 57 TRP B CZ2 3469 C CZ3 . TRP B 58 ? 0.6441 0.4632 0.4769 -0.0395 0.0419 0.0083 57 TRP B CZ3 3470 C CH2 . TRP B 58 ? 0.6412 0.4745 0.4782 -0.0324 0.0453 0.0039 57 TRP B CH2 3471 N N . ILE B 59 ? 0.6710 0.4454 0.4821 -0.0642 0.0328 -0.0030 58 ILE B N 3472 C CA . ILE B 59 ? 0.6559 0.4488 0.4718 -0.0686 0.0318 -0.0002 58 ILE B CA 3473 C C . ILE B 59 ? 0.6635 0.4545 0.4704 -0.0735 0.0284 -0.0060 58 ILE B C 3474 O O . ILE B 59 ? 0.6364 0.4371 0.4396 -0.0730 0.0293 -0.0066 58 ILE B O 3475 C CB . ILE B 59 ? 0.6427 0.4414 0.4686 -0.0754 0.0291 0.0063 58 ILE B CB 3476 C CG1 . ILE B 59 ? 0.6562 0.4569 0.4878 -0.0718 0.0322 0.0135 58 ILE B CG1 3477 C CG2 . ILE B 59 ? 0.6127 0.4279 0.4431 -0.0785 0.0268 0.0074 58 ILE B CG2 3478 C CD1 . ILE B 59 ? 0.6653 0.4818 0.5001 -0.0652 0.0352 0.0157 58 ILE B CD1 3479 N N . ASP B 60 ? 0.6913 0.4683 0.4932 -0.0788 0.0238 -0.0100 59 ASP B N 3480 C CA . ASP B 60 ? 0.7060 0.4804 0.4975 -0.0835 0.0185 -0.0155 59 ASP B CA 3481 C C . ASP B 60 ? 0.7312 0.5021 0.5071 -0.0786 0.0228 -0.0217 59 ASP B C 3482 O O . ASP B 60 ? 0.7492 0.5221 0.5142 -0.0813 0.0199 -0.0236 59 ASP B O 3483 C CB . ASP B 60 ? 0.7222 0.4825 0.5110 -0.0910 0.0118 -0.0202 59 ASP B CB 3484 C CG . ASP B 60 ? 0.7334 0.4964 0.5146 -0.0965 0.0036 -0.0242 59 ASP B CG 3485 O OD1 . ASP B 60 ? 0.7347 0.5133 0.5228 -0.0974 0.0004 -0.0196 59 ASP B OD1 3486 O OD2 . ASP B 60 ? 0.7596 0.5084 0.5267 -0.0990 -0.0003 -0.0322 59 ASP B OD2 3487 N N . ASN B 61 ? 0.7203 0.4863 0.4946 -0.0711 0.0297 -0.0246 60 ASN B N 3488 C CA . ASN B 61 ? 0.7253 0.4911 0.4868 -0.0662 0.0359 -0.0314 60 ASN B CA 3489 C C . ASN B 61 ? 0.7269 0.5116 0.4936 -0.0628 0.0428 -0.0278 60 ASN B C 3490 O O . ASN B 61 ? 0.7346 0.5235 0.4898 -0.0637 0.0473 -0.0310 60 ASN B O 3491 C CB . ASN B 61 ? 0.7369 0.4887 0.4948 -0.0586 0.0400 -0.0387 60 ASN B CB 3492 C CG . ASN B 61 ? 0.7524 0.4817 0.4987 -0.0628 0.0341 -0.0457 60 ASN B CG 3493 O OD1 . ASN B 61 ? 0.7557 0.4821 0.4917 -0.0706 0.0283 -0.0481 60 ASN B OD1 3494 N ND2 . ASN B 61 ? 0.7667 0.4788 0.5141 -0.0577 0.0346 -0.0491 60 ASN B ND2 3495 N N . ILE B 62 ? 0.6995 0.4950 0.4821 -0.0598 0.0439 -0.0214 61 ILE B N 3496 C CA . ILE B 62 ? 0.6771 0.4907 0.4661 -0.0571 0.0499 -0.0191 61 ILE B CA 3497 C C . ILE B 62 ? 0.6701 0.4933 0.4610 -0.0635 0.0472 -0.0127 61 ILE B C 3498 O O . ILE B 62 ? 0.6482 0.4838 0.4414 -0.0639 0.0517 -0.0114 61 ILE B O 3499 C CB . ILE B 62 ? 0.6687 0.4898 0.4723 -0.0488 0.0523 -0.0169 61 ILE B CB 3500 C CG1 . ILE B 62 ? 0.6574 0.4976 0.4667 -0.0451 0.0596 -0.0191 61 ILE B CG1 3501 C CG2 . ILE B 62 ? 0.6560 0.4798 0.4697 -0.0510 0.0473 -0.0084 61 ILE B CG2 3502 C CD1 . ILE B 62 ? 0.6689 0.5185 0.4924 -0.0354 0.0606 -0.0183 61 ILE B CD1 3503 N N . ARG B 63 ? 0.6825 0.5002 0.4738 -0.0683 0.0397 -0.0093 62 ARG B N 3504 C CA . ARG B 63 ? 0.6711 0.4955 0.4631 -0.0726 0.0362 -0.0045 62 ARG B CA 3505 C C . ARG B 63 ? 0.6871 0.5080 0.4623 -0.0760 0.0373 -0.0063 62 ARG B C 3506 O O . ARG B 63 ? 0.6951 0.5068 0.4564 -0.0766 0.0384 -0.0115 62 ARG B O 3507 C CB . ARG B 63 ? 0.6696 0.4915 0.4670 -0.0760 0.0280 -0.0019 62 ARG B CB 3508 C CG . ARG B 63 ? 0.6857 0.4963 0.4716 -0.0798 0.0218 -0.0061 62 ARG B CG 3509 C CD . ARG B 63 ? 0.6936 0.5060 0.4899 -0.0836 0.0139 -0.0045 62 ARG B CD 3510 N NE . ARG B 63 ? 0.7393 0.5408 0.5256 -0.0877 0.0074 -0.0100 62 ARG B NE 3511 C CZ . ARG B 63 ? 0.7703 0.5705 0.5476 -0.0901 -0.0007 -0.0114 62 ARG B CZ 3512 N NH1 . ARG B 63 ? 0.7835 0.5906 0.5600 -0.0884 -0.0036 -0.0072 62 ARG B NH1 3513 N NH2 . ARG B 63 ? 0.7916 0.5817 0.5591 -0.0940 -0.0070 -0.0174 62 ARG B NH2 3514 N N . LEU B 64 ? 0.6811 0.5075 0.4558 -0.0783 0.0374 -0.0020 63 LEU B N 3515 C CA . LEU B 64 ? 0.6974 0.5162 0.4538 -0.0827 0.0362 -0.0011 63 LEU B CA 3516 C C . LEU B 64 ? 0.7012 0.5137 0.4551 -0.0837 0.0251 0.0021 63 LEU B C 3517 O O . LEU B 64 ? 0.7079 0.5272 0.4772 -0.0818 0.0209 0.0047 63 LEU B O 3518 C CB . LEU B 64 ? 0.6877 0.5127 0.4433 -0.0854 0.0424 0.0017 63 LEU B CB 3519 C CG . LEU B 64 ? 0.6962 0.5326 0.4569 -0.0850 0.0535 -0.0018 63 LEU B CG 3520 C CD1 . LEU B 64 ? 0.6922 0.5353 0.4544 -0.0901 0.0578 0.0012 63 LEU B CD1 3521 C CD2 . LEU B 64 ? 0.7174 0.5490 0.4626 -0.0859 0.0596 -0.0075 63 LEU B CD2 3522 N N . VAL B 65 ? 0.7217 0.5225 0.4560 -0.0863 0.0202 0.0016 64 VAL B N 3523 C CA . VAL B 65 ? 0.7568 0.5524 0.4875 -0.0859 0.0083 0.0045 64 VAL B CA 3524 C C . VAL B 65 ? 0.7797 0.5681 0.4979 -0.0872 0.0079 0.0101 64 VAL B C 3525 O O . VAL B 65 ? 0.7842 0.5643 0.4831 -0.0913 0.0138 0.0109 64 VAL B O 3526 C CB . VAL B 65 ? 0.8016 0.5870 0.5162 -0.0875 0.0008 0.0005 64 VAL B CB 3527 C CG1 . VAL B 65 ? 0.8155 0.5968 0.5255 -0.0861 -0.0130 0.0035 64 VAL B CG1 3528 C CG2 . VAL B 65 ? 0.8064 0.5956 0.5333 -0.0875 0.0004 -0.0052 64 VAL B CG2 3529 N N . TYR B 66 ? 0.7667 0.5579 0.4958 -0.0840 0.0018 0.0138 65 TYR B N 3530 C CA . TYR B 66 ? 0.7834 0.5633 0.4998 -0.0846 0.0000 0.0191 65 TYR B CA 3531 C C . TYR B 66 ? 0.8169 0.5829 0.5164 -0.0822 -0.0129 0.0216 65 TYR B C 3532 O O . TYR B 66 ? 0.8110 0.5832 0.5223 -0.0770 -0.0232 0.0202 65 TYR B O 3533 C CB . TYR B 66 ? 0.7554 0.5428 0.4898 -0.0813 0.0005 0.0208 65 TYR B CB 3534 C CG . TYR B 66 ? 0.7745 0.5470 0.4944 -0.0836 0.0009 0.0255 65 TYR B CG 3535 C CD1 . TYR B 66 ? 0.7758 0.5472 0.4902 -0.0908 0.0118 0.0263 65 TYR B CD1 3536 C CD2 . TYR B 66 ? 0.7867 0.5453 0.4981 -0.0789 -0.0098 0.0291 65 TYR B CD2 3537 C CE1 . TYR B 66 ? 0.7888 0.5443 0.4890 -0.0952 0.0125 0.0307 65 TYR B CE1 3538 C CE2 . TYR B 66 ? 0.7937 0.5334 0.4892 -0.0814 -0.0098 0.0339 65 TYR B CE2 3539 C CZ . TYR B 66 ? 0.8039 0.5413 0.4933 -0.0906 0.0016 0.0349 65 TYR B CZ 3540 O OH . TYR B 66 ? 0.8430 0.5595 0.5158 -0.0953 0.0019 0.0398 65 TYR B OH 3541 N N . ASN B 67 ? 0.8530 0.6009 0.5245 -0.0863 -0.0123 0.0255 66 ASN B N 3542 C CA . ASN B 67 ? 0.9138 0.6448 0.5644 -0.0834 -0.0257 0.0294 66 ASN B CA 3543 C C . ASN B 67 ? 0.9285 0.6453 0.5731 -0.0807 -0.0299 0.0361 66 ASN B C 3544 O O . ASN B 67 ? 0.9431 0.6467 0.5718 -0.0872 -0.0218 0.0404 66 ASN B O 3545 C CB . ASN B 67 ? 0.9669 0.6833 0.5850 -0.0897 -0.0229 0.0301 66 ASN B CB 3546 C CG . ASN B 67 ? 1.0221 0.7203 0.6151 -0.0864 -0.0383 0.0342 66 ASN B CG 3547 O OD1 . ASN B 67 ? 1.0113 0.7005 0.6038 -0.0803 -0.0490 0.0394 66 ASN B OD1 3548 N ND2 . ASN B 67 ? 1.0932 0.7855 0.6643 -0.0894 -0.0403 0.0314 66 ASN B ND2 3549 N N . LYS B 68 ? 0.9369 0.6565 0.5948 -0.0713 -0.0423 0.0363 67 LYS B N 3550 C CA . LYS B 68 ? 0.9722 0.6781 0.6278 -0.0660 -0.0474 0.0410 67 LYS B CA 3551 C C . LYS B 68 ? 1.0291 0.7032 0.6482 -0.0673 -0.0539 0.0492 67 LYS B C 3552 O O . LYS B 68 ? 1.0589 0.7139 0.6677 -0.0678 -0.0532 0.0543 67 LYS B O 3553 C CB . LYS B 68 ? 0.9937 0.7114 0.6715 -0.0535 -0.0604 0.0383 67 LYS B CB 3554 C CG . LYS B 68 ? 0.9817 0.7288 0.6949 -0.0513 -0.0552 0.0315 67 LYS B CG 3555 C CD . LYS B 68 ? 1.0103 0.7706 0.7435 -0.0396 -0.0681 0.0286 67 LYS B CD 3556 C CE . LYS B 68 ? 1.0111 0.7999 0.7781 -0.0381 -0.0617 0.0226 67 LYS B CE 3557 N NZ . LYS B 68 ? 1.0093 0.8128 0.7846 -0.0468 -0.0543 0.0194 67 LYS B NZ 3558 N N . THR B 69 ? 1.0584 0.7252 0.6564 -0.0683 -0.0608 0.0504 68 THR B N 3559 C CA . THR B 69 ? 1.1012 0.7360 0.6595 -0.0697 -0.0679 0.0592 68 THR B CA 3560 C C . THR B 69 ? 1.1115 0.7315 0.6459 -0.0838 -0.0518 0.0637 68 THR B C 3561 O O . THR B 69 ? 1.1408 0.7348 0.6536 -0.0871 -0.0515 0.0717 68 THR B O 3562 C CB . THR B 69 ? 1.1413 0.7738 0.6826 -0.0663 -0.0812 0.0584 68 THR B CB 3563 O OG1 . THR B 69 ? 1.1228 0.7742 0.6917 -0.0544 -0.0957 0.0532 68 THR B OG1 3564 C CG2 . THR B 69 ? 1.1767 0.7743 0.6745 -0.0662 -0.0906 0.0686 68 THR B CG2 3565 N N . SER B 70 ? 1.0953 0.7319 0.6339 -0.0922 -0.0382 0.0582 69 SER B N 3566 C CA . SER B 70 ? 1.0862 0.7153 0.6068 -0.1056 -0.0215 0.0608 69 SER B CA 3567 C C . SER B 70 ? 1.0474 0.6876 0.5915 -0.1104 -0.0092 0.0593 69 SER B C 3568 O O . SER B 70 ? 1.0349 0.6698 0.5671 -0.1222 0.0039 0.0619 69 SER B O 3569 C CB . SER B 70 ? 1.0838 0.7266 0.5989 -0.1111 -0.0118 0.0544 69 SER B CB 3570 O OG . SER B 70 ? 1.0367 0.7078 0.5867 -0.1066 -0.0088 0.0450 69 SER B OG 3571 N N . ARG B 71 ? 1.0009 0.6580 0.5780 -0.1020 -0.0133 0.0547 70 ARG B N 3572 C CA . ARG B 71 ? 0.9750 0.6461 0.5758 -0.1055 -0.0030 0.0517 70 ARG B CA 3573 C C . ARG B 71 ? 0.9588 0.6488 0.5662 -0.1147 0.0131 0.0470 70 ARG B C 3574 O O . ARG B 71 ? 0.9702 0.6612 0.5775 -0.1243 0.0243 0.0478 70 ARG B O 3575 C CB . ARG B 71 ? 0.9910 0.6383 0.5786 -0.1103 -0.0028 0.0582 70 ARG B CB 3576 C CG . ARG B 71 ? 1.0061 0.6322 0.5871 -0.0991 -0.0191 0.0625 70 ARG B CG 3577 C CD . ARG B 71 ? 0.9824 0.6291 0.5967 -0.0864 -0.0257 0.0559 70 ARG B CD 3578 N NE . ARG B 71 ? 0.9744 0.6316 0.6086 -0.0897 -0.0169 0.0520 70 ARG B NE 3579 C CZ . ARG B 71 ? 0.9626 0.6055 0.5984 -0.0864 -0.0206 0.0526 70 ARG B CZ 3580 N NH1 . ARG B 71 ? 0.9870 0.6034 0.6071 -0.0783 -0.0330 0.0573 70 ARG B NH1 3581 N NH2 . ARG B 71 ? 0.9486 0.6033 0.6016 -0.0906 -0.0124 0.0479 70 ARG B NH2 3582 N N . ALA B 72 ? 0.9324 0.6375 0.5461 -0.1115 0.0139 0.0414 71 ALA B N 3583 C CA . ALA B 72 ? 0.9113 0.6328 0.5292 -0.1176 0.0281 0.0360 71 ALA B CA 3584 C C . ALA B 72 ? 0.8747 0.6155 0.5144 -0.1098 0.0259 0.0284 71 ALA B C 3585 O O . ALA B 72 ? 0.8676 0.6061 0.5105 -0.1027 0.0138 0.0280 71 ALA B O 3586 C CB . ALA B 72 ? 0.9257 0.6333 0.5105 -0.1252 0.0335 0.0382 71 ALA B CB 3587 N N . THR B 73 ? 0.8468 0.6062 0.5019 -0.1112 0.0372 0.0227 72 THR B N 3588 C CA . THR B 73 ? 0.8347 0.6079 0.5073 -0.1047 0.0360 0.0161 72 THR B CA 3589 C C . THR B 73 ? 0.8534 0.6223 0.5080 -0.1060 0.0392 0.0114 72 THR B C 3590 O O . THR B 73 ? 0.8786 0.6417 0.5125 -0.1124 0.0476 0.0118 72 THR B O 3591 C CB . THR B 73 ? 0.8013 0.5953 0.5004 -0.1030 0.0445 0.0122 72 THR B CB 3592 O OG1 . THR B 73 ? 0.8008 0.6016 0.4959 -0.1094 0.0573 0.0108 72 THR B OG1 3593 C CG2 . THR B 73 ? 0.7782 0.5770 0.4952 -0.1004 0.0398 0.0154 72 THR B CG2 3594 N N . GLN B 74 ? 0.8528 0.6245 0.5150 -0.1006 0.0333 0.0064 73 GLN B N 3595 C CA . GLN B 74 ? 0.8948 0.6625 0.5422 -0.1008 0.0362 -0.0003 73 GLN B CA 3596 C C . GLN B 74 ? 0.8463 0.6239 0.5154 -0.0952 0.0364 -0.0070 73 GLN B C 3597 O O . GLN B 74 ? 0.8016 0.5871 0.4932 -0.0919 0.0320 -0.0051 73 GLN B O 3598 C CB . GLN B 74 ? 0.9449 0.6951 0.5666 -0.1018 0.0244 0.0010 73 GLN B CB 3599 C CG . GLN B 74 ? 0.9561 0.7048 0.5891 -0.0977 0.0085 0.0046 73 GLN B CG 3600 C CD . GLN B 74 ? 0.9830 0.7150 0.5902 -0.0980 -0.0044 0.0085 73 GLN B CD 3601 O OE1 . GLN B 74 ? 0.9969 0.7159 0.5825 -0.1011 -0.0036 0.0152 73 GLN B OE1 3602 N NE2 . GLN B 74 ? 0.9770 0.7088 0.5860 -0.0952 -0.0171 0.0045 73 GLN B NE2 3603 N N . PHE B 75 ? 0.8442 0.6203 0.5051 -0.0942 0.0425 -0.0149 74 PHE B N 3604 C CA . PHE B 75 ? 0.8032 0.5826 0.4802 -0.0889 0.0418 -0.0212 74 PHE B CA 3605 C C . PHE B 75 ? 0.8112 0.5801 0.4848 -0.0893 0.0281 -0.0228 74 PHE B C 3606 O O . PHE B 75 ? 0.8119 0.5711 0.4659 -0.0925 0.0203 -0.0214 74 PHE B O 3607 C CB . PHE B 75 ? 0.8160 0.5960 0.4857 -0.0862 0.0530 -0.0304 74 PHE B CB 3608 C CG . PHE B 75 ? 0.8031 0.5971 0.4761 -0.0867 0.0671 -0.0303 74 PHE B CG 3609 C CD1 . PHE B 75 ? 0.7848 0.5928 0.4775 -0.0872 0.0696 -0.0242 74 PHE B CD1 3610 C CD2 . PHE B 75 ? 0.8297 0.6246 0.4867 -0.0870 0.0785 -0.0377 74 PHE B CD2 3611 C CE1 . PHE B 75 ? 0.7781 0.6014 0.4758 -0.0891 0.0820 -0.0251 74 PHE B CE1 3612 C CE2 . PHE B 75 ? 0.8198 0.6317 0.4827 -0.0885 0.0922 -0.0385 74 PHE B CE2 3613 C CZ . PHE B 75 ? 0.8014 0.6279 0.4856 -0.0900 0.0936 -0.0322 74 PHE B CZ 3614 N N . PRO B 76 ? 0.8049 0.5758 0.4972 -0.0867 0.0245 -0.0252 75 PRO B N 3615 C CA . PRO B 76 ? 0.8157 0.5786 0.5064 -0.0892 0.0121 -0.0279 75 PRO B CA 3616 C C . PRO B 76 ? 0.8662 0.6145 0.5307 -0.0910 0.0104 -0.0364 75 PRO B C 3617 O O . PRO B 76 ? 0.8811 0.6262 0.5335 -0.0889 0.0210 -0.0418 75 PRO B O 3618 C CB . PRO B 76 ? 0.7869 0.5524 0.4999 -0.0873 0.0127 -0.0294 75 PRO B CB 3619 C CG . PRO B 76 ? 0.7682 0.5460 0.4974 -0.0833 0.0215 -0.0241 75 PRO B CG 3620 C CD . PRO B 76 ? 0.7755 0.5564 0.4915 -0.0824 0.0304 -0.0243 75 PRO B CD 3621 N N . ASP B 77 ? 0.9159 0.6574 0.5725 -0.0946 -0.0027 -0.0384 76 ASP B N 3622 C CA . ASP B 77 ? 0.9664 0.6932 0.5961 -0.0969 -0.0064 -0.0471 76 ASP B CA 3623 C C . ASP B 77 ? 0.9200 0.6386 0.5496 -0.0946 0.0015 -0.0571 76 ASP B C 3624 O O . ASP B 77 ? 0.9133 0.6321 0.5638 -0.0941 0.0005 -0.0584 76 ASP B O 3625 C CB . ASP B 77 ? 1.0720 0.7953 0.7003 -0.1013 -0.0240 -0.0492 76 ASP B CB 3626 C CG . ASP B 77 ? 1.1545 0.8830 0.7779 -0.1016 -0.0345 -0.0408 76 ASP B CG 3627 O OD1 . ASP B 77 ? 1.2567 0.9821 0.8624 -0.1001 -0.0292 -0.0353 76 ASP B OD1 3628 O OD2 . ASP B 77 ? 1.2175 0.9527 0.8550 -0.1032 -0.0481 -0.0400 76 ASP B OD2 3629 N N . GLY B 78 ? 0.9004 0.6107 0.5052 -0.0930 0.0097 -0.0642 77 GLY B N 3630 C CA . GLY B 78 ? 0.8895 0.5901 0.4905 -0.0888 0.0174 -0.0756 77 GLY B CA 3631 C C . GLY B 78 ? 0.8534 0.5634 0.4756 -0.0814 0.0305 -0.0747 77 GLY B C 3632 O O . GLY B 78 ? 0.8549 0.5560 0.4801 -0.0760 0.0348 -0.0832 77 GLY B O 3633 N N . VAL B 79 ? 0.8043 0.5312 0.4407 -0.0805 0.0360 -0.0649 78 VAL B N 3634 C CA . VAL B 79 ? 0.7867 0.5255 0.4428 -0.0733 0.0472 -0.0641 78 VAL B CA 3635 C C . VAL B 79 ? 0.7986 0.5502 0.4463 -0.0726 0.0600 -0.0637 78 VAL B C 3636 O O . VAL B 79 ? 0.7998 0.5558 0.4381 -0.0789 0.0590 -0.0565 78 VAL B O 3637 C CB . VAL B 79 ? 0.7528 0.5023 0.4363 -0.0732 0.0431 -0.0539 78 VAL B CB 3638 C CG1 . VAL B 79 ? 0.7401 0.5029 0.4418 -0.0654 0.0535 -0.0530 78 VAL B CG1 3639 C CG2 . VAL B 79 ? 0.7454 0.4833 0.4381 -0.0752 0.0327 -0.0545 78 VAL B CG2 3640 N N . ASP B 80 ? 0.8092 0.5667 0.4602 -0.0652 0.0720 -0.0714 79 ASP B N 3641 C CA . ASP B 80 ? 0.8121 0.5887 0.4646 -0.0650 0.0858 -0.0706 79 ASP B CA 3642 C C . ASP B 80 ? 0.7902 0.5843 0.4722 -0.0568 0.0915 -0.0698 79 ASP B C 3643 O O . ASP B 80 ? 0.8011 0.5898 0.4941 -0.0475 0.0903 -0.0752 79 ASP B O 3644 C CB . ASP B 80 ? 0.8519 0.6265 0.4808 -0.0638 0.0972 -0.0816 79 ASP B CB 3645 C CG . ASP B 80 ? 0.8569 0.6528 0.4854 -0.0674 0.1120 -0.0797 79 ASP B CG 3646 O OD1 . ASP B 80 ? 0.8629 0.6633 0.4897 -0.0765 0.1102 -0.0688 79 ASP B OD1 3647 O OD2 . ASP B 80 ? 0.8614 0.6694 0.4917 -0.0615 0.1257 -0.0894 79 ASP B OD2 3648 N N . VAL B 81 ? 0.8024 0.6162 0.4958 -0.0602 0.0972 -0.0631 80 VAL B N 3649 C CA . VAL B 81 ? 0.7899 0.6237 0.5112 -0.0531 0.1018 -0.0622 80 VAL B CA 3650 C C . VAL B 81 ? 0.8100 0.6668 0.5337 -0.0549 0.1164 -0.0656 80 VAL B C 3651 O O . VAL B 81 ? 0.8262 0.6860 0.5379 -0.0661 0.1198 -0.0603 80 VAL B O 3652 C CB . VAL B 81 ? 0.7506 0.5888 0.4882 -0.0567 0.0930 -0.0505 80 VAL B CB 3653 C CG1 . VAL B 81 ? 0.7402 0.5997 0.5041 -0.0498 0.0968 -0.0498 80 VAL B CG1 3654 C CG2 . VAL B 81 ? 0.7530 0.5721 0.4906 -0.0559 0.0802 -0.0474 80 VAL B CG2 3655 N N . ARG B 82 ? 0.8233 0.6961 0.5628 -0.0443 0.1248 -0.0741 81 ARG B N 3656 C CA . ARG B 82 ? 0.8475 0.7478 0.5946 -0.0461 0.1395 -0.0784 81 ARG B CA 3657 C C . ARG B 82 ? 0.8260 0.7523 0.6064 -0.0373 0.1408 -0.0791 81 ARG B C 3658 O O . ARG B 82 ? 0.8175 0.7378 0.6120 -0.0265 0.1316 -0.0780 81 ARG B O 3659 C CB . ARG B 82 ? 0.9028 0.8032 0.6344 -0.0415 0.1515 -0.0916 81 ARG B CB 3660 C CG . ARG B 82 ? 0.9388 0.8424 0.6857 -0.0232 0.1530 -0.1029 81 ARG B CG 3661 C CD . ARG B 82 ? 0.9941 0.8931 0.7219 -0.0180 0.1641 -0.1172 81 ARG B CD 3662 N NE . ARG B 82 ? 1.0365 0.9357 0.7791 0.0012 0.1648 -0.1286 81 ARG B NE 3663 C CZ . ARG B 82 ? 1.1118 1.0030 0.8406 0.0105 0.1724 -0.1433 81 ARG B CZ 3664 N NH1 . ARG B 82 ? 1.1473 1.0310 0.8457 0.0014 0.1806 -0.1485 81 ARG B NH1 3665 N NH2 . ARG B 82 ? 1.1206 1.0092 0.8640 0.0296 0.1715 -0.1531 81 ARG B NH2 3666 N N . VAL B 83 ? 0.8076 0.7628 0.5997 -0.0425 0.1521 -0.0807 82 VAL B N 3667 C CA . VAL B 83 ? 0.7697 0.7547 0.5945 -0.0356 0.1533 -0.0820 82 VAL B CA 3668 C C . VAL B 83 ? 0.7748 0.7827 0.6116 -0.0239 0.1659 -0.0959 82 VAL B C 3669 O O . VAL B 83 ? 0.7952 0.8187 0.6256 -0.0316 0.1803 -0.1012 82 VAL B O 3670 C CB . VAL B 83 ? 0.7400 0.7446 0.5729 -0.0511 0.1569 -0.0749 82 VAL B CB 3671 C CG1 . VAL B 83 ? 0.7199 0.7584 0.5874 -0.0446 0.1572 -0.0775 82 VAL B CG1 3672 C CG2 . VAL B 83 ? 0.7288 0.7098 0.5487 -0.0614 0.1449 -0.0623 82 VAL B CG2 3673 N N . PRO B 84 ? 0.7859 0.7953 0.6392 -0.0049 0.1610 -0.1020 83 PRO B N 3674 C CA . PRO B 84 ? 0.8095 0.8436 0.6782 0.0089 0.1724 -0.1162 83 PRO B CA 3675 C C . PRO B 84 ? 0.8089 0.8880 0.7113 0.0091 0.1778 -0.1180 83 PRO B C 3676 O O . PRO B 84 ? 0.7857 0.8726 0.7006 0.0020 0.1695 -0.1083 83 PRO B O 3677 C CB . PRO B 84 ? 0.8204 0.8339 0.6936 0.0295 0.1617 -0.1198 83 PRO B CB 3678 C CG . PRO B 84 ? 0.7961 0.7951 0.6735 0.0264 0.1456 -0.1059 83 PRO B CG 3679 C CD . PRO B 84 ? 0.7821 0.7712 0.6412 0.0049 0.1449 -0.0957 83 PRO B CD 3680 N N . GLY B 85 ? 0.8189 0.9287 0.7361 0.0169 0.1918 -0.1312 84 GLY B N 3681 C CA . GLY B 85 ? 0.8034 0.9589 0.7590 0.0233 0.1948 -0.1361 84 GLY B CA 3682 C C . GLY B 85 ? 0.7953 0.9830 0.7625 0.0023 0.2037 -0.1324 84 GLY B C 3683 O O . GLY B 85 ? 0.7839 1.0071 0.7838 0.0046 0.2013 -0.1337 84 GLY B O 3684 N N . PHE B 86 ? 0.8021 0.9772 0.7424 -0.0183 0.2131 -0.1279 85 PHE B N 3685 C CA . PHE B 86 ? 0.8025 1.0043 0.7508 -0.0401 0.2228 -0.1242 85 PHE B CA 3686 C C . PHE B 86 ? 0.8101 1.0623 0.7868 -0.0369 0.2403 -0.1383 85 PHE B C 3687 O O . PHE B 86 ? 0.8100 1.0674 0.7795 -0.0289 0.2534 -0.1495 85 PHE B O 3688 C CB . PHE B 86 ? 0.8208 0.9955 0.7310 -0.0620 0.2295 -0.1160 85 PHE B CB 3689 C CG . PHE B 86 ? 0.8244 1.0174 0.7397 -0.0857 0.2366 -0.1095 85 PHE B CG 3690 C CD1 . PHE B 86 ? 0.8053 0.9842 0.7208 -0.0960 0.2231 -0.0972 85 PHE B CD1 3691 C CD2 . PHE B 86 ? 0.8369 1.0619 0.7579 -0.0980 0.2573 -0.1164 85 PHE B CD2 3692 C CE1 . PHE B 86 ? 0.8071 0.9997 0.7268 -0.1181 0.2290 -0.0919 85 PHE B CE1 3693 C CE2 . PHE B 86 ? 0.8380 1.0781 0.7638 -0.1216 0.2639 -0.1103 85 PHE B CE2 3694 C CZ . PHE B 86 ? 0.8241 1.0464 0.7488 -0.1317 0.2492 -0.0980 85 PHE B CZ 3695 N N . GLY B 87 ? 0.8161 1.1071 0.8262 -0.0429 0.2403 -0.1386 86 GLY B N 3696 C CA . GLY B 87 ? 0.8291 1.1743 0.8725 -0.0401 0.2559 -0.1524 86 GLY B CA 3697 C C . GLY B 87 ? 0.8330 1.2015 0.9100 -0.0111 0.2475 -0.1628 86 GLY B C 3698 O O . GLY B 87 ? 0.8318 1.2510 0.9445 -0.0054 0.2568 -0.1747 86 GLY B O 3699 N N . LYS B 88 ? 0.8494 1.1822 0.9164 0.0074 0.2296 -0.1584 87 LYS B N 3700 C CA . LYS B 88 ? 0.8558 1.2007 0.9490 0.0365 0.2186 -0.1659 87 LYS B CA 3701 C C . LYS B 88 ? 0.8330 1.1688 0.9358 0.0385 0.1967 -0.1541 87 LYS B C 3702 O O . LYS B 88 ? 0.8246 1.1498 0.9166 0.0175 0.1925 -0.1425 87 LYS B O 3703 C CB . LYS B 88 ? 0.8829 1.1881 0.9522 0.0562 0.2160 -0.1703 87 LYS B CB 3704 C CG . LYS B 88 ? 0.9181 1.2198 0.9663 0.0526 0.2360 -0.1806 87 LYS B CG 3705 C CD . LYS B 88 ? 0.9359 1.2924 1.0157 0.0605 0.2540 -0.1977 87 LYS B CD 3706 C CE . LYS B 88 ? 0.9646 1.3150 1.0191 0.0576 0.2745 -0.2084 87 LYS B CE 3707 N NZ . LYS B 88 ? 0.9843 1.3931 1.0677 0.0575 0.2963 -0.2236 87 LYS B NZ 3708 N N . THR B 89 ? 0.8327 1.1728 0.9547 0.0636 0.1831 -0.1571 88 THR B N 3709 C CA . THR B 89 ? 0.8294 1.1620 0.9586 0.0663 0.1627 -0.1461 88 THR B CA 3710 C C . THR B 89 ? 0.8337 1.1185 0.9422 0.0838 0.1469 -0.1391 88 THR B C 3711 O O . THR B 89 ? 0.8316 1.0993 0.9350 0.0819 0.1313 -0.1274 88 THR B O 3712 C CB . THR B 89 ? 0.8280 1.2129 1.0010 0.0775 0.1567 -0.1531 88 THR B CB 3713 O OG1 . THR B 89 ? 0.8551 1.2563 1.0469 0.1055 0.1583 -0.1661 88 THR B OG1 3714 C CG2 . THR B 89 ? 0.8251 1.2572 1.0197 0.0551 0.1705 -0.1582 88 THR B CG2 3715 N N . PHE B 90 ? 0.8449 1.1066 0.9398 0.0993 0.1512 -0.1459 89 PHE B N 3716 C CA . PHE B 90 ? 0.8480 1.0666 0.9271 0.1170 0.1363 -0.1403 89 PHE B CA 3717 C C . PHE B 90 ? 0.8416 1.0167 0.8911 0.1016 0.1260 -0.1239 89 PHE B C 3718 O O . PHE B 90 ? 0.8457 0.9972 0.8903 0.1107 0.1103 -0.1148 89 PHE B O 3719 C CB . PHE B 90 ? 0.8602 1.0570 0.9268 0.1340 0.1433 -0.1515 89 PHE B CB 3720 C CG . PHE B 90 ? 0.8589 1.0274 0.8925 0.1176 0.1550 -0.1519 89 PHE B CG 3721 C CD1 . PHE B 90 ? 0.8563 0.9731 0.8576 0.1122 0.1463 -0.1422 89 PHE B CD1 3722 C CD2 . PHE B 90 ? 0.8568 1.0513 0.8913 0.1076 0.1746 -0.1623 89 PHE B CD2 3723 C CE1 . PHE B 90 ? 0.8611 0.9534 0.8325 0.0979 0.1552 -0.1430 89 PHE B CE1 3724 C CE2 . PHE B 90 ? 0.8628 1.0301 0.8638 0.0932 0.1841 -0.1623 89 PHE B CE2 3725 C CZ . PHE B 90 ? 0.8632 0.9796 0.8329 0.0888 0.1735 -0.1528 89 PHE B CZ 3726 N N . SER B 91 ? 0.8280 0.9926 0.8573 0.0787 0.1349 -0.1199 90 SER B N 3727 C CA . SER B 91 ? 0.8235 0.9463 0.8242 0.0657 0.1265 -0.1064 90 SER B CA 3728 C C . SER B 91 ? 0.8029 0.9333 0.8101 0.0541 0.1165 -0.0950 90 SER B C 3729 O O . SER B 91 ? 0.7784 0.8768 0.7659 0.0470 0.1078 -0.0839 90 SER B O 3730 C CB . SER B 91 ? 0.8246 0.9315 0.7994 0.0473 0.1383 -0.1066 90 SER B CB 3731 O OG . SER B 91 ? 0.8198 0.9550 0.8014 0.0284 0.1481 -0.1063 90 SER B OG 3732 N N . LEU B 92 ? 0.8034 0.9757 0.8374 0.0515 0.1181 -0.0983 91 LEU B N 3733 C CA . LEU B 92 ? 0.8042 0.9847 0.8466 0.0451 0.1062 -0.0895 91 LEU B CA 3734 C C . LEU B 92 ? 0.7910 0.9885 0.8555 0.0654 0.0929 -0.0905 91 LEU B C 3735 O O . LEU B 92 ? 0.7838 0.9794 0.8490 0.0634 0.0805 -0.0822 91 LEU B O 3736 C CB . LEU B 92 ? 0.8173 1.0221 0.8663 0.0220 0.1133 -0.0889 91 LEU B CB 3737 C CG . LEU B 92 ? 0.8394 1.0842 0.9076 0.0144 0.1291 -0.0999 91 LEU B CG 3738 C CD1 . LEU B 92 ? 0.8639 1.1535 0.9695 0.0291 0.1251 -0.1086 91 LEU B CD1 3739 C CD2 . LEU B 92 ? 0.8417 1.0913 0.9036 -0.0125 0.1352 -0.0951 91 LEU B CD2 3740 N N . GLU B 93 ? 0.8069 1.0200 0.8880 0.0859 0.0948 -0.1006 92 GLU B N 3741 C CA . GLU B 93 ? 0.8234 1.0498 0.9240 0.1084 0.0802 -0.1010 92 GLU B CA 3742 C C . GLU B 93 ? 0.8405 1.0184 0.9159 0.1182 0.0667 -0.0895 92 GLU B C 3743 O O . GLU B 93 ? 0.8051 0.9803 0.8819 0.1242 0.0521 -0.0815 92 GLU B O 3744 C CB . GLU B 93 ? 0.8425 1.0960 0.9671 0.1303 0.0856 -0.1156 92 GLU B CB 3745 C CG . GLU B 93 ? 0.8296 1.1426 0.9889 0.1245 0.0957 -0.1273 92 GLU B CG 3746 C CD . GLU B 93 ? 0.8431 1.1856 1.0286 0.1487 0.1009 -0.1426 92 GLU B CD 3747 O OE1 . GLU B 93 ? 0.8468 1.2011 1.0508 0.1718 0.0867 -0.1441 92 GLU B OE1 3748 O OE2 . GLU B 93 ? 0.8290 1.1827 1.0158 0.1453 0.1191 -0.1533 92 GLU B OE2 3749 N N . PHE B 94 ? 0.8720 1.0119 0.9238 0.1192 0.0721 -0.0892 93 PHE B N 3750 C CA . PHE B 94 ? 0.9034 0.9953 0.9310 0.1268 0.0618 -0.0795 93 PHE B CA 3751 C C . PHE B 94 ? 0.9007 0.9588 0.9001 0.1076 0.0681 -0.0741 93 PHE B C 3752 O O . PHE B 94 ? 0.9101 0.9660 0.9028 0.1018 0.0806 -0.0820 93 PHE B O 3753 C CB . PHE B 94 ? 0.9531 1.0305 0.9827 0.1523 0.0594 -0.0867 93 PHE B CB 3754 C CG . PHE B 94 ? 0.9873 1.0870 1.0397 0.1749 0.0475 -0.0883 93 PHE B CG 3755 C CD1 . PHE B 94 ? 0.9998 1.0803 1.0435 0.1814 0.0309 -0.0753 93 PHE B CD1 3756 C CD2 . PHE B 94 ? 1.0144 1.1550 1.0966 0.1904 0.0526 -0.1028 93 PHE B CD2 3757 C CE1 . PHE B 94 ? 1.0153 1.1151 1.0778 0.2032 0.0181 -0.0761 93 PHE B CE1 3758 C CE2 . PHE B 94 ? 1.0256 1.1885 1.1304 0.2129 0.0399 -0.1046 93 PHE B CE2 3759 C CZ . PHE B 94 ? 1.0276 1.1689 1.1215 0.2196 0.0218 -0.0909 93 PHE B CZ 3760 N N . LEU B 95 ? 0.8896 0.9239 0.8725 0.0976 0.0598 -0.0611 94 LEU B N 3761 C CA . LEU B 95 ? 0.8876 0.8935 0.8467 0.0799 0.0641 -0.0558 94 LEU B CA 3762 C C . LEU B 95 ? 0.9271 0.8926 0.8672 0.0873 0.0634 -0.0564 94 LEU B C 3763 O O . LEU B 95 ? 0.8897 0.8369 0.8136 0.0769 0.0699 -0.0585 94 LEU B O 3764 C CB . LEU B 95 ? 0.8689 0.8658 0.8191 0.0673 0.0563 -0.0430 94 LEU B CB 3765 C CG . LEU B 95 ? 0.8438 0.8751 0.8091 0.0572 0.0563 -0.0425 94 LEU B CG 3766 C CD1 . LEU B 95 ? 0.8239 0.8427 0.7781 0.0476 0.0480 -0.0309 94 LEU B CD1 3767 C CD2 . LEU B 95 ? 0.8330 0.8808 0.8005 0.0420 0.0690 -0.0490 94 LEU B CD2 3768 N N . ASP B 96 ? 0.9935 0.9436 0.9345 0.1055 0.0543 -0.0543 95 ASP B N 3769 C CA . ASP B 96 ? 1.0502 0.9596 0.9743 0.1146 0.0521 -0.0552 95 ASP B CA 3770 C C . ASP B 96 ? 1.0782 0.9974 1.0142 0.1344 0.0569 -0.0695 95 ASP B C 3771 O O . ASP B 96 ? 1.0953 1.0352 1.0501 0.1520 0.0518 -0.0721 95 ASP B O 3772 C CB . ASP B 96 ? 1.0898 0.9713 1.0044 0.1221 0.0388 -0.0426 95 ASP B CB 3773 C CG . ASP B 96 ? 1.1471 0.9798 1.0406 0.1264 0.0362 -0.0412 95 ASP B CG 3774 O OD1 . ASP B 96 ? 1.1803 1.0029 1.0717 0.1345 0.0418 -0.0530 95 ASP B OD1 3775 O OD2 . ASP B 96 ? 1.1601 0.9641 1.0384 0.1209 0.0288 -0.0287 95 ASP B OD2 3776 N N . PRO B 97 ? 1.1077 1.0123 1.0326 0.1328 0.0661 -0.0794 96 PRO B N 3777 C CA . PRO B 97 ? 1.1453 1.0604 1.0810 0.1523 0.0723 -0.0949 96 PRO B CA 3778 C C . PRO B 97 ? 1.1965 1.0861 1.1325 0.1772 0.0620 -0.0955 96 PRO B C 3779 O O . PRO B 97 ? 1.1973 1.1012 1.1477 0.1974 0.0653 -0.1082 96 PRO B O 3780 C CB . PRO B 97 ? 1.1394 1.0366 1.0559 0.1426 0.0832 -0.1039 96 PRO B CB 3781 C CG . PRO B 97 ? 1.1382 1.0008 1.0313 0.1242 0.0775 -0.0920 96 PRO B CG 3782 C CD . PRO B 97 ? 1.1148 0.9923 1.0161 0.1145 0.0703 -0.0777 96 PRO B CD 3783 N N . SER B 98 ? 1.2524 1.1055 1.1728 0.1762 0.0499 -0.0818 97 SER B N 3784 C CA . SER B 98 ? 1.3102 1.1404 1.2307 0.1995 0.0380 -0.0788 97 SER B CA 3785 C C . SER B 98 ? 1.3404 1.2101 1.2872 0.2151 0.0312 -0.0777 97 SER B C 3786 O O . SER B 98 ? 1.4102 1.2697 1.3618 0.2389 0.0215 -0.0780 97 SER B O 3787 C CB . SER B 98 ? 1.3293 1.1118 1.2251 0.1916 0.0276 -0.0626 97 SER B CB 3788 O OG . SER B 98 ? 1.3162 1.1139 1.2151 0.1818 0.0210 -0.0483 97 SER B OG 3789 N N . LYS B 99 ? 1.3236 1.2370 1.2865 0.2015 0.0352 -0.0764 98 LYS B N 3790 C CA . LYS B 99 ? 1.3027 1.2616 1.2935 0.2118 0.0296 -0.0773 98 LYS B CA 3791 C C . LYS B 99 ? 1.3115 1.2550 1.2951 0.2174 0.0128 -0.0618 98 LYS B C 3792 O O . LYS B 99 ? 1.2952 1.2639 1.2974 0.2341 0.0032 -0.0621 98 LYS B O 3793 C CB . LYS B 99 ? 1.3284 1.3152 1.3444 0.2367 0.0327 -0.0935 98 LYS B CB 3794 C CG . LYS B 99 ? 1.3288 1.3444 1.3556 0.2285 0.0513 -0.1092 98 LYS B CG 3795 C CD . LYS B 99 ? 1.3363 1.3909 1.3937 0.2522 0.0556 -0.1258 98 LYS B CD 3796 C CE . LYS B 99 ? 1.3283 1.4099 1.3927 0.2424 0.0761 -0.1410 98 LYS B CE 3797 N NZ . LYS B 99 ? 1.3514 1.4709 1.4457 0.2662 0.0824 -0.1590 98 LYS B NZ 3798 N N . SER B 100 ? 1.3191 1.2225 1.2753 0.2030 0.0094 -0.0483 99 SER B N 3799 C CA . SER B 100 ? 1.3691 1.2566 1.3137 0.2040 -0.0044 -0.0322 99 SER B CA 3800 C C . SER B 100 ? 1.3581 1.2893 1.3186 0.1950 -0.0074 -0.0289 99 SER B C 3801 O O . SER B 100 ? 1.3561 1.3173 1.3274 0.1776 0.0025 -0.0343 99 SER B O 3802 C CB . SER B 100 ? 1.4093 1.2501 1.3232 0.1867 -0.0044 -0.0195 99 SER B CB 3803 O OG . SER B 100 ? 1.4399 1.2934 1.3513 0.1611 0.0046 -0.0183 99 SER B OG 3804 N N . SER B 101 ? 1.3618 1.2935 1.3212 0.2063 -0.0218 -0.0196 100 SER B N 3805 C CA . SER B 101 ? 1.3264 1.2979 1.2996 0.1998 -0.0273 -0.0172 100 SER B CA 3806 C C . SER B 101 ? 1.2853 1.2538 1.2447 0.1718 -0.0212 -0.0098 100 SER B C 3807 O O . SER B 101 ? 1.2464 1.2511 1.2201 0.1605 -0.0195 -0.0129 100 SER B O 3808 C CB . SER B 101 ? 1.3351 1.3017 1.3038 0.2178 -0.0455 -0.0076 100 SER B CB 3809 O OG . SER B 101 ? 1.3499 1.2663 1.2853 0.2148 -0.0509 0.0078 100 SER B OG 3810 N N . VAL B 102 ? 1.2665 1.1929 1.1999 0.1609 -0.0178 -0.0011 101 VAL B N 3811 C CA . VAL B 102 ? 1.2413 1.1639 1.1626 0.1363 -0.0116 0.0047 101 VAL B CA 3812 C C . VAL B 102 ? 1.1522 1.1044 1.0889 0.1214 0.0007 -0.0060 101 VAL B C 3813 O O . VAL B 102 ? 1.0612 1.0281 0.9978 0.1048 0.0031 -0.0037 101 VAL B O 3814 C CB . VAL B 102 ? 1.2923 1.1673 1.1871 0.1273 -0.0087 0.0134 101 VAL B CB 3815 C CG1 . VAL B 102 ? 1.2596 1.1341 1.1442 0.1039 -0.0035 0.0195 101 VAL B CG1 3816 C CG2 . VAL B 102 ? 1.3292 1.1697 1.2058 0.1408 -0.0199 0.0249 101 VAL B CG2 3817 N N . GLY B 103 ? 1.1068 1.0684 1.0560 0.1280 0.0085 -0.0181 102 GLY B N 3818 C CA . GLY B 103 ? 1.0479 1.0354 1.0087 0.1138 0.0208 -0.0275 102 GLY B CA 3819 C C . GLY B 103 ? 0.9861 1.0217 0.9761 0.1196 0.0228 -0.0382 102 GLY B C 3820 O O . GLY B 103 ? 0.9248 0.9817 0.9246 0.1092 0.0346 -0.0469 102 GLY B O 3821 N N . SER B 104 ? 0.9623 1.0163 0.9662 0.1354 0.0115 -0.0376 103 SER B N 3822 C CA . SER B 104 ? 0.9129 1.0167 0.9482 0.1408 0.0127 -0.0487 103 SER B CA 3823 C C . SER B 104 ? 0.8307 0.9613 0.8728 0.1191 0.0153 -0.0481 103 SER B C 3824 O O . SER B 104 ? 0.7931 0.9193 0.8264 0.1135 0.0059 -0.0393 103 SER B O 3825 C CB . SER B 104 ? 0.9273 1.0446 0.9764 0.1646 -0.0024 -0.0484 103 SER B CB 3826 O OG . SER B 104 ? 0.9174 1.0871 1.0011 0.1705 -0.0007 -0.0610 103 SER B OG 3827 N N . TYR B 105 ? 0.7801 0.9377 0.8367 0.1069 0.0284 -0.0577 104 TYR B N 3828 C CA . TYR B 105 ? 0.7279 0.9021 0.7863 0.0836 0.0328 -0.0568 104 TYR B CA 3829 C C . TYR B 105 ? 0.7079 0.9348 0.7995 0.0814 0.0368 -0.0684 104 TYR B C 3830 O O . TYR B 105 ? 0.6888 0.9408 0.7953 0.0835 0.0262 -0.0686 104 TYR B O 3831 C CB . TYR B 105 ? 0.7179 0.8653 0.7548 0.0660 0.0452 -0.0545 104 TYR B CB 3832 C CG . TYR B 105 ? 0.6862 0.8407 0.7193 0.0423 0.0498 -0.0524 104 TYR B CG 3833 C CD1 . TYR B 105 ? 0.6636 0.8177 0.6924 0.0354 0.0400 -0.0455 104 TYR B CD1 3834 C CD2 . TYR B 105 ? 0.6773 0.8354 0.7079 0.0271 0.0639 -0.0570 104 TYR B CD2 3835 C CE1 . TYR B 105 ? 0.6452 0.8024 0.6696 0.0147 0.0439 -0.0444 104 TYR B CE1 3836 C CE2 . TYR B 105 ? 0.6616 0.8216 0.6867 0.0061 0.0675 -0.0543 104 TYR B CE2 3837 C CZ . TYR B 105 ? 0.6363 0.7954 0.6589 0.0003 0.0573 -0.0484 104 TYR B CZ 3838 O OH . TYR B 105 ? 0.6231 0.7811 0.6395 -0.0195 0.0607 -0.0467 104 TYR B OH 3839 N N . PHE B 106 ? 0.7100 0.9547 0.8130 0.0770 0.0519 -0.0783 105 PHE B N 3840 C CA . PHE B 106 ? 0.7155 1.0131 0.8526 0.0751 0.0573 -0.0901 105 PHE B CA 3841 C C . PHE B 106 ? 0.7258 1.0509 0.8896 0.1016 0.0530 -0.0997 105 PHE B C 3842 O O . PHE B 106 ? 0.7069 1.0814 0.9037 0.1022 0.0573 -0.1108 105 PHE B O 3843 C CB . PHE B 106 ? 0.7239 1.0322 0.8613 0.0558 0.0772 -0.0965 105 PHE B CB 3844 C CG . PHE B 106 ? 0.7199 1.0285 0.8495 0.0284 0.0805 -0.0917 105 PHE B CG 3845 C CD1 . PHE B 106 ? 0.7159 1.0664 0.8711 0.0165 0.0806 -0.0972 105 PHE B CD1 3846 C CD2 . PHE B 106 ? 0.7386 1.0054 0.8358 0.0146 0.0830 -0.0822 105 PHE B CD2 3847 C CE1 . PHE B 106 ? 0.7162 1.0627 0.8626 -0.0086 0.0834 -0.0931 105 PHE B CE1 3848 C CE2 . PHE B 106 ? 0.7357 1.0000 0.8249 -0.0085 0.0854 -0.0780 105 PHE B CE2 3849 C CZ . PHE B 106 ? 0.7269 1.0290 0.8396 -0.0203 0.0857 -0.0834 105 PHE B CZ 3850 N N . HIS B 107 ? 0.7493 1.0430 0.8999 0.1235 0.0446 -0.0958 106 HIS B N 3851 C CA . HIS B 107 ? 0.7794 1.0934 0.9528 0.1509 0.0411 -0.1053 106 HIS B CA 3852 C C . HIS B 107 ? 0.7712 1.1346 0.9794 0.1618 0.0290 -0.1108 106 HIS B C 3853 O O . HIS B 107 ? 0.7737 1.1802 1.0145 0.1726 0.0344 -0.1243 106 HIS B O 3854 C CB . HIS B 107 ? 0.8195 1.0852 0.9695 0.1719 0.0311 -0.0981 106 HIS B CB 3855 C CG . HIS B 107 ? 0.8597 1.1395 1.0302 0.2024 0.0263 -0.1076 106 HIS B CG 3856 N ND1 . HIS B 107 ? 0.8654 1.1678 1.0541 0.2107 0.0408 -0.1229 106 HIS B ND1 3857 C CD2 . HIS B 107 ? 0.8821 1.1566 1.0572 0.2278 0.0084 -0.1042 106 HIS B CD2 3858 C CE1 . HIS B 107 ? 0.8992 1.2101 1.1047 0.2408 0.0320 -0.1293 106 HIS B CE1 3859 N NE2 . HIS B 107 ? 0.9124 1.2057 1.1097 0.2519 0.0117 -0.1177 106 HIS B NE2 3860 N N . THR B 108 ? 0.7637 1.1234 0.9658 0.1585 0.0129 -0.1012 107 THR B N 3861 C CA . THR B 108 ? 0.7550 1.1598 0.9879 0.1696 -0.0014 -0.1061 107 THR B CA 3862 C C . THR B 108 ? 0.7380 1.2000 1.0051 0.1518 0.0095 -0.1185 107 THR B C 3863 O O . THR B 108 ? 0.7421 1.2528 1.0459 0.1640 0.0065 -0.1298 107 THR B O 3864 C CB . THR B 108 ? 0.7545 1.1426 0.9695 0.1664 -0.0202 -0.0934 107 THR B CB 3865 O OG1 . THR B 108 ? 0.7761 1.1073 0.9551 0.1769 -0.0270 -0.0804 107 THR B OG1 3866 C CG2 . THR B 108 ? 0.7554 1.1850 0.9986 0.1836 -0.0388 -0.0980 107 THR B CG2 3867 N N . MET B 109 ? 0.7268 1.1807 0.9807 0.1224 0.0220 -0.1159 108 MET B N 3868 C CA . MET B 109 ? 0.7276 1.2295 1.0092 0.1012 0.0338 -0.1260 108 MET B CA 3869 C C . MET B 109 ? 0.7359 1.2700 1.0426 0.1079 0.0515 -0.1401 108 MET B C 3870 O O . MET B 109 ? 0.7222 1.3135 1.0681 0.1062 0.0553 -0.1523 108 MET B O 3871 C CB . MET B 109 ? 0.7321 1.2102 0.9891 0.0694 0.0438 -0.1191 108 MET B CB 3872 C CG . MET B 109 ? 0.7385 1.2609 1.0207 0.0448 0.0552 -0.1280 108 MET B CG 3873 S SD . MET B 109 ? 0.7540 1.2436 1.0054 0.0091 0.0653 -0.1193 108 MET B SD 3874 C CE . MET B 109 ? 0.7483 1.2229 0.9876 0.0068 0.0425 -0.1105 108 MET B CE 3875 N N . VAL B 110 ? 0.7517 1.2504 1.0359 0.1142 0.0630 -0.1391 109 VAL B N 3876 C CA . VAL B 110 ? 0.7664 1.2911 1.0691 0.1205 0.0812 -0.1528 109 VAL B CA 3877 C C . VAL B 110 ? 0.7824 1.3429 1.1197 0.1529 0.0723 -0.1638 109 VAL B C 3878 O O . VAL B 110 ? 0.7912 1.4044 1.1643 0.1555 0.0837 -0.1786 109 VAL B O 3879 C CB . VAL B 110 ? 0.7807 1.2565 1.0483 0.1208 0.0939 -0.1499 109 VAL B CB 3880 C CG1 . VAL B 110 ? 0.7937 1.2959 1.0792 0.1318 0.1116 -0.1655 109 VAL B CG1 3881 C CG2 . VAL B 110 ? 0.7758 1.2244 1.0141 0.0894 0.1039 -0.1410 109 VAL B CG2 3882 N N . GLU B 111 ? 0.8044 1.3378 1.1317 0.1772 0.0525 -0.1569 110 GLU B N 3883 C CA . GLU B 111 ? 0.8311 1.3968 1.1905 0.2095 0.0401 -0.1659 110 GLU B CA 3884 C C . GLU B 111 ? 0.8090 1.4438 1.2135 0.2048 0.0347 -0.1750 110 GLU B C 3885 O O . GLU B 111 ? 0.7979 1.4830 1.2420 0.2212 0.0384 -0.1901 110 GLU B O 3886 C CB . GLU B 111 ? 0.8638 1.3851 1.2001 0.2323 0.0171 -0.1534 110 GLU B CB 3887 C CG . GLU B 111 ? 0.9007 1.3618 1.2029 0.2459 0.0206 -0.1485 110 GLU B CG 3888 C CD . GLU B 111 ? 0.9225 1.3987 1.2452 0.2735 0.0275 -0.1636 110 GLU B CD 3889 O OE1 . GLU B 111 ? 0.9467 1.4439 1.2929 0.3020 0.0126 -0.1683 110 GLU B OE1 3890 O OE2 . GLU B 111 ? 0.9252 1.3919 1.2397 0.2676 0.0473 -0.1711 110 GLU B OE2 3891 N N . SER B 112 ? 0.7862 1.4239 1.1851 0.1821 0.0267 -0.1670 111 SER B N 3892 C CA . SER B 112 ? 0.7637 1.4672 1.2048 0.1724 0.0218 -0.1763 111 SER B CA 3893 C C . SER B 112 ? 0.7486 1.5013 1.2197 0.1531 0.0458 -0.1904 111 SER B C 3894 O O . SER B 112 ? 0.7457 1.5625 1.2641 0.1617 0.0462 -0.2049 111 SER B O 3895 C CB . SER B 112 ? 0.7471 1.4376 1.1713 0.1502 0.0090 -0.1653 111 SER B CB 3896 O OG . SER B 112 ? 0.7514 1.4073 1.1533 0.1696 -0.0140 -0.1539 111 SER B OG 3897 N N . LEU B 113 ? 0.7486 1.4720 1.1924 0.1283 0.0654 -0.1860 112 LEU B N 3898 C CA . LEU B 113 ? 0.7415 1.5042 1.2059 0.1070 0.0908 -0.1974 112 LEU B CA 3899 C C . LEU B 113 ? 0.7518 1.5511 1.2463 0.1311 0.1026 -0.2134 112 LEU B C 3900 O O . LEU B 113 ? 0.7448 1.6080 1.2820 0.1263 0.1132 -0.2276 112 LEU B O 3901 C CB . LEU B 113 ? 0.7460 1.4617 1.1687 0.0805 0.1085 -0.1884 112 LEU B CB 3902 C CG . LEU B 113 ? 0.7478 1.4358 1.1457 0.0519 0.1021 -0.1755 112 LEU B CG 3903 C CD1 . LEU B 113 ? 0.7581 1.3948 1.1128 0.0322 0.1173 -0.1663 112 LEU B CD1 3904 C CD2 . LEU B 113 ? 0.7432 1.4842 1.1741 0.0278 0.1043 -0.1824 112 LEU B CD2 3905 N N . VAL B 114 ? 0.7604 1.5188 1.2328 0.1572 0.1005 -0.2115 113 VAL B N 3906 C CA . VAL B 114 ? 0.7754 1.5603 1.2717 0.1839 0.1103 -0.2270 113 VAL B CA 3907 C C . VAL B 114 ? 0.7822 1.6271 1.3296 0.2089 0.0952 -0.2384 113 VAL B C 3908 O O . VAL B 114 ? 0.7881 1.6913 1.3769 0.2177 0.1075 -0.2558 113 VAL B O 3909 C CB . VAL B 114 ? 0.7910 1.5138 1.2506 0.2071 0.1090 -0.2226 113 VAL B CB 3910 C CG1 . VAL B 114 ? 0.7919 1.5424 1.2790 0.2400 0.1151 -0.2399 113 VAL B CG1 3911 C CG2 . VAL B 114 ? 0.7966 1.4731 1.2132 0.1825 0.1276 -0.2158 113 VAL B CG2 3912 N N . GLY B 115 ? 0.7884 1.6220 1.3340 0.2211 0.0679 -0.2292 114 GLY B N 3913 C CA . GLY B 115 ? 0.7991 1.6897 1.3914 0.2428 0.0498 -0.2384 114 GLY B CA 3914 C C . GLY B 115 ? 0.7925 1.7589 1.4312 0.2194 0.0580 -0.2502 114 GLY B C 3915 O O . GLY B 115 ? 0.7894 1.8199 1.4784 0.2376 0.0531 -0.2649 114 GLY B O 3916 N N . TRP B 116 ? 0.7837 1.7439 1.4072 0.1796 0.0708 -0.2444 115 TRP B N 3917 C CA . TRP B 116 ? 0.7644 1.7901 1.4274 0.1518 0.0815 -0.2547 115 TRP B CA 3918 C C . TRP B 116 ? 0.7571 1.8191 1.4399 0.1404 0.1137 -0.2685 115 TRP B C 3919 O O . TRP B 116 ? 0.7495 1.8673 1.4657 0.1155 0.1264 -0.2777 115 TRP B O 3920 C CB . TRP B 116 ? 0.7528 1.7544 1.3906 0.1139 0.0791 -0.2423 115 TRP B CB 3921 C CG . TRP B 116 ? 0.7594 1.7270 1.3756 0.1214 0.0501 -0.2294 115 TRP B CG 3922 C CD1 . TRP B 116 ? 0.7738 1.7540 1.4056 0.1525 0.0241 -0.2302 115 TRP B CD1 3923 C CD2 . TRP B 116 ? 0.7483 1.6638 1.3219 0.0976 0.0442 -0.2138 115 TRP B CD2 3924 N NE1 . TRP B 116 ? 0.7705 1.7088 1.3698 0.1483 0.0032 -0.2156 115 TRP B NE1 3925 C CE2 . TRP B 116 ? 0.7576 1.6571 1.3222 0.1151 0.0155 -0.2060 115 TRP B CE2 3926 C CE3 . TRP B 116 ? 0.7389 1.6191 1.2803 0.0641 0.0602 -0.2056 115 TRP B CE3 3927 C CZ2 . TRP B 116 ? 0.7548 1.6067 1.2804 0.0998 0.0040 -0.1915 115 TRP B CZ2 3928 C CZ3 . TRP B 116 ? 0.7369 1.5696 1.2414 0.0504 0.0477 -0.1915 115 TRP B CZ3 3929 C CH2 . TRP B 116 ? 0.7421 1.5620 1.2394 0.0680 0.0206 -0.1850 115 TRP B CH2 3930 N N . GLY B 117 ? 0.7561 1.7849 1.4163 0.1574 0.1273 -0.2701 116 GLY B N 3931 C CA . GLY B 117 ? 0.7478 1.8098 1.4241 0.1514 0.1577 -0.2843 116 GLY B CA 3932 C C . GLY B 117 ? 0.7401 1.7522 1.3686 0.1264 0.1809 -0.2764 116 GLY B C 3933 O O . GLY B 117 ? 0.7384 1.7774 1.3762 0.1181 0.2078 -0.2877 116 GLY B O 3934 N N . TYR B 118 ? 0.7242 1.6656 1.3019 0.1152 0.1712 -0.2579 117 TYR B N 3935 C CA . TYR B 118 ? 0.7234 1.6128 1.2530 0.0941 0.1898 -0.2494 117 TYR B CA 3936 C C . TYR B 118 ? 0.7496 1.6014 1.2554 0.1217 0.1952 -0.2528 117 TYR B C 3937 O O . TYR B 118 ? 0.7543 1.6028 1.2711 0.1565 0.1798 -0.2569 117 TYR B O 3938 C CB . TYR B 118 ? 0.7032 1.5351 1.1908 0.0725 0.1773 -0.2297 117 TYR B CB 3939 C CG . TYR B 118 ? 0.6836 1.5417 1.1832 0.0370 0.1795 -0.2265 117 TYR B CG 3940 C CD1 . TYR B 118 ? 0.6751 1.5694 1.2071 0.0374 0.1603 -0.2280 117 TYR B CD1 3941 C CD2 . TYR B 118 ? 0.6835 1.5278 1.1603 0.0030 0.1999 -0.2219 117 TYR B CD2 3942 C CE1 . TYR B 118 ? 0.6658 1.5817 1.2082 0.0040 0.1617 -0.2261 117 TYR B CE1 3943 C CE2 . TYR B 118 ? 0.6780 1.5417 1.1641 -0.0300 0.2017 -0.2189 117 TYR B CE2 3944 C CZ . TYR B 118 ? 0.6683 1.5676 1.1877 -0.0297 0.1827 -0.2215 117 TYR B CZ 3945 O OH . TYR B 118 ? 0.6685 1.5850 1.1966 -0.0633 0.1838 -0.2195 117 TYR B OH 3946 N N . THR B 119 ? 0.7694 1.5917 1.2415 0.1054 0.2165 -0.2512 118 THR B N 3947 C CA . THR B 119 ? 0.7959 1.5801 1.2404 0.1259 0.2247 -0.2553 118 THR B CA 3948 C C . THR B 119 ? 0.8018 1.5138 1.1878 0.1075 0.2263 -0.2395 118 THR B C 3949 O O . THR B 119 ? 0.7943 1.5022 1.1626 0.0758 0.2407 -0.2340 118 THR B O 3950 C CB . THR B 119 ? 0.8163 1.6461 1.2810 0.1269 0.2529 -0.2740 118 THR B CB 3951 O OG1 . THR B 119 ? 0.8033 1.7066 1.3272 0.1427 0.2517 -0.2895 118 THR B OG1 3952 C CG2 . THR B 119 ? 0.8467 1.6371 1.2833 0.1507 0.2601 -0.2805 118 THR B CG2 3953 N N . ARG B 120 ? 0.8170 1.4730 1.1740 0.1278 0.2109 -0.2321 119 ARG B N 3954 C CA . ARG B 120 ? 0.8195 1.4073 1.1237 0.1147 0.2095 -0.2179 119 ARG B CA 3955 C C . ARG B 120 ? 0.8411 1.4212 1.1212 0.0982 0.2345 -0.2228 119 ARG B C 3956 O O . ARG B 120 ? 0.8612 1.4564 1.1481 0.1141 0.2485 -0.2377 119 ARG B O 3957 C CB . ARG B 120 ? 0.8272 1.3628 1.1092 0.1423 0.1929 -0.2138 119 ARG B CB 3958 C CG . ARG B 120 ? 0.8106 1.3354 1.1010 0.1555 0.1661 -0.2036 119 ARG B CG 3959 C CD . ARG B 120 ? 0.8288 1.3013 1.0961 0.1820 0.1525 -0.2001 119 ARG B CD 3960 N NE . ARG B 120 ? 0.8251 1.2741 1.0871 0.1885 0.1280 -0.1859 119 ARG B NE 3961 C CZ . ARG B 120 ? 0.8185 1.2934 1.1094 0.2094 0.1116 -0.1877 119 ARG B CZ 3962 N NH1 . ARG B 120 ? 0.8249 1.3530 1.1562 0.2276 0.1159 -0.2037 119 ARG B NH1 3963 N NH2 . ARG B 120 ? 0.8039 1.2524 1.0829 0.2127 0.0903 -0.1734 119 ARG B NH2 3964 N N . GLY B 121 ? 0.8340 1.3890 1.0843 0.0675 0.2397 -0.2106 120 GLY B N 3965 C CA . GLY B 121 ? 0.8608 1.3987 1.0793 0.0517 0.2611 -0.2126 120 GLY B CA 3966 C C . GLY B 121 ? 0.8664 1.4591 1.1067 0.0331 0.2854 -0.2226 120 GLY B C 3967 O O . GLY B 121 ? 0.8865 1.4685 1.0996 0.0170 0.3046 -0.2235 120 GLY B O 3968 N N . GLU B 122 ? 0.8517 1.5035 1.1407 0.0351 0.2843 -0.2300 121 GLU B N 3969 C CA . GLU B 122 ? 0.8481 1.5576 1.1637 0.0145 0.3066 -0.2391 121 GLU B CA 3970 C C . GLU B 122 ? 0.8172 1.5406 1.1445 -0.0137 0.2995 -0.2283 121 GLU B C 3971 O O . GLU B 122 ? 0.8207 1.5098 1.1135 -0.0414 0.3034 -0.2152 121 GLU B O 3972 C CB . GLU B 122 ? 0.8593 1.6322 1.2249 0.0389 0.3140 -0.2596 121 GLU B CB 3973 C CG . GLU B 122 ? 0.8853 1.6442 1.2367 0.0649 0.3246 -0.2722 121 GLU B CG 3974 C CD . GLU B 122 ? 0.8938 1.7186 1.2958 0.0892 0.3346 -0.2942 121 GLU B CD 3975 O OE1 . GLU B 122 ? 0.8732 1.7610 1.3220 0.0814 0.3373 -0.3003 121 GLU B OE1 3976 O OE2 . GLU B 122 ? 0.9143 1.7282 1.3097 0.1163 0.3396 -0.3063 121 GLU B OE2 3977 N N . ASP B 123 ? 0.7932 1.5624 1.1666 -0.0062 0.2871 -0.2333 122 ASP B N 3978 C CA . ASP B 123 ? 0.7761 1.5626 1.1633 -0.0342 0.2808 -0.2255 122 ASP B CA 3979 C C . ASP B 123 ? 0.7481 1.4892 1.1165 -0.0320 0.2530 -0.2100 122 ASP B C 3980 O O . ASP B 123 ? 0.7248 1.4730 1.1005 -0.0531 0.2451 -0.2034 122 ASP B O 3981 C CB . ASP B 123 ? 0.7683 1.6359 1.2164 -0.0355 0.2852 -0.2400 122 ASP B CB 3982 C CG . ASP B 123 ? 0.7647 1.6626 1.2509 0.0025 0.2679 -0.2506 122 ASP B CG 3983 O OD1 . ASP B 123 ? 0.7897 1.6453 1.2546 0.0303 0.2546 -0.2474 122 ASP B OD1 3984 O OD2 . ASP B 123 ? 0.7498 1.7144 1.2878 0.0041 0.2671 -0.2623 122 ASP B OD2 3985 N N . VAL B 124 ? 0.7451 1.4408 1.0902 -0.0063 0.2386 -0.2052 123 VAL B N 3986 C CA . VAL B 124 ? 0.7297 1.3706 1.0438 -0.0079 0.2177 -0.1889 123 VAL B CA 3987 C C . VAL B 124 ? 0.7330 1.3119 0.9980 -0.0047 0.2215 -0.1812 123 VAL B C 3988 O O . VAL B 124 ? 0.7540 1.3230 1.0138 0.0180 0.2247 -0.1882 123 VAL B O 3989 C CB . VAL B 124 ? 0.7175 1.3625 1.0516 0.0183 0.1919 -0.1881 123 VAL B CB 3990 C CG1 . VAL B 124 ? 0.7334 1.3760 1.0742 0.0543 0.1886 -0.1967 123 VAL B CG1 3991 C CG2 . VAL B 124 ? 0.7057 1.2967 1.0067 0.0127 0.1731 -0.1711 123 VAL B CG2 3992 N N . ARG B 125 ? 0.7277 1.2666 0.9577 -0.0286 0.2219 -0.1679 124 ARG B N 3993 C CA . ARG B 125 ? 0.7359 1.2170 0.9193 -0.0284 0.2240 -0.1600 124 ARG B CA 3994 C C . ARG B 125 ? 0.7347 1.1670 0.8894 -0.0366 0.2070 -0.1437 124 ARG B C 3995 O O . ARG B 125 ? 0.7298 1.1690 0.8913 -0.0537 0.2004 -0.1374 124 ARG B O 3996 C CB . ARG B 125 ? 0.7532 1.2336 0.9159 -0.0502 0.2476 -0.1615 124 ARG B CB 3997 C CG . ARG B 125 ? 0.7622 1.2918 0.9507 -0.0435 0.2679 -0.1784 124 ARG B CG 3998 C CD . ARG B 125 ? 0.7811 1.2997 0.9391 -0.0619 0.2911 -0.1791 124 ARG B CD 3999 N NE . ARG B 125 ? 0.7956 1.3708 0.9823 -0.0630 0.3136 -0.1949 124 ARG B NE 4000 C CZ . ARG B 125 ? 0.8080 1.3856 0.9740 -0.0760 0.3373 -0.1992 124 ARG B CZ 4001 N NH1 . ARG B 125 ? 0.8198 1.3451 0.9346 -0.0884 0.3405 -0.1888 124 ARG B NH1 4002 N NH2 . ARG B 125 ? 0.8243 1.4586 1.0209 -0.0762 0.3580 -0.2144 124 ARG B NH2 4003 N N . GLY B 126 ? 0.7462 1.1306 0.8698 -0.0248 0.2001 -0.1380 125 GLY B N 4004 C CA . GLY B 126 ? 0.7323 1.0697 0.8265 -0.0333 0.1865 -0.1231 125 GLY B CA 4005 C C . GLY B 126 ? 0.7401 1.0467 0.7985 -0.0554 0.1967 -0.1158 125 GLY B C 4006 O O . GLY B 126 ? 0.7469 1.0520 0.7912 -0.0584 0.2124 -0.1211 125 GLY B O 4007 N N . ALA B 127 ? 0.7378 1.0180 0.7798 -0.0698 0.1869 -0.1036 126 ALA B N 4008 C CA . ALA B 127 ? 0.7436 0.9876 0.7492 -0.0882 0.1918 -0.0945 126 ALA B CA 4009 C C . ALA B 127 ? 0.7289 0.9272 0.7107 -0.0814 0.1752 -0.0841 126 ALA B C 4010 O O . ALA B 127 ? 0.7206 0.9005 0.6920 -0.0933 0.1671 -0.0746 126 ALA B O 4011 C CB . ALA B 127 ? 0.7500 1.0053 0.7582 -0.1139 0.1968 -0.0901 126 ALA B CB 4012 N N . PRO B 128 ? 0.7196 0.8992 0.6928 -0.0624 0.1708 -0.0863 127 PRO B N 4013 C CA . PRO B 128 ? 0.7040 0.8415 0.6546 -0.0576 0.1571 -0.0771 127 PRO B CA 4014 C C . PRO B 128 ? 0.7026 0.8072 0.6190 -0.0733 0.1601 -0.0695 127 PRO B C 4015 O O . PRO B 128 ? 0.7183 0.8257 0.6215 -0.0838 0.1739 -0.0724 127 PRO B O 4016 C CB . PRO B 128 ? 0.7124 0.8411 0.6625 -0.0362 0.1554 -0.0836 127 PRO B CB 4017 C CG . PRO B 128 ? 0.7331 0.8850 0.6877 -0.0356 0.1726 -0.0952 127 PRO B CG 4018 C CD . PRO B 128 ? 0.7320 0.9263 0.7137 -0.0460 0.1795 -0.0982 127 PRO B CD 4019 N N . TYR B 129 ? 0.6632 0.7371 0.5646 -0.0741 0.1472 -0.0600 128 TYR B N 4020 C CA . TYR B 129 ? 0.6695 0.7121 0.5404 -0.0866 0.1467 -0.0524 128 TYR B CA 4021 C C . TYR B 129 ? 0.6702 0.6821 0.5290 -0.0786 0.1328 -0.0462 128 TYR B C 4022 O O . TYR B 129 ? 0.6524 0.6662 0.5254 -0.0660 0.1239 -0.0463 128 TYR B O 4023 C CB . TYR B 129 ? 0.6657 0.7106 0.5349 -0.1051 0.1475 -0.0459 128 TYR B CB 4024 C CG . TYR B 129 ? 0.6516 0.7045 0.5396 -0.1039 0.1363 -0.0424 128 TYR B CG 4025 C CD1 . TYR B 129 ? 0.6410 0.7291 0.5589 -0.1008 0.1374 -0.0484 128 TYR B CD1 4026 C CD2 . TYR B 129 ? 0.6419 0.6686 0.5179 -0.1052 0.1243 -0.0339 128 TYR B CD2 4027 C CE1 . TYR B 129 ? 0.6267 0.7214 0.5590 -0.0996 0.1262 -0.0457 128 TYR B CE1 4028 C CE2 . TYR B 129 ? 0.6220 0.6554 0.5124 -0.1039 0.1147 -0.0316 128 TYR B CE2 4029 C CZ . TYR B 129 ? 0.6166 0.6830 0.5338 -0.1014 0.1154 -0.0374 128 TYR B CZ 4030 O OH . TYR B 129 ? 0.5817 0.6543 0.5107 -0.1002 0.1052 -0.0355 128 TYR B OH 4031 N N . ASP B 130 ? 0.6895 0.6732 0.5215 -0.0863 0.1306 -0.0405 129 ASP B N 4032 C CA . ASP B 130 ? 0.6837 0.6409 0.5055 -0.0814 0.1177 -0.0345 129 ASP B CA 4033 C C . ASP B 130 ? 0.6563 0.6125 0.4858 -0.0863 0.1090 -0.0270 129 ASP B C 4034 O O . ASP B 130 ? 0.6591 0.6033 0.4755 -0.0975 0.1076 -0.0212 129 ASP B O 4035 C CB . ASP B 130 ? 0.6969 0.6277 0.4889 -0.0873 0.1174 -0.0321 129 ASP B CB 4036 C CG . ASP B 130 ? 0.7134 0.6206 0.4978 -0.0818 0.1046 -0.0279 129 ASP B CG 4037 O OD1 . ASP B 130 ? 0.7125 0.6217 0.5123 -0.0761 0.0965 -0.0248 129 ASP B OD1 4038 O OD2 . ASP B 130 ? 0.7309 0.6185 0.4937 -0.0837 0.1025 -0.0278 129 ASP B OD2 4039 N N . TRP B 131 ? 0.6366 0.6039 0.4858 -0.0769 0.1028 -0.0273 130 TRP B N 4040 C CA . TRP B 131 ? 0.6188 0.5899 0.4774 -0.0801 0.0954 -0.0223 130 TRP B CA 4041 C C . TRP B 131 ? 0.6168 0.5633 0.4626 -0.0811 0.0857 -0.0150 130 TRP B C 4042 O O . TRP B 131 ? 0.6093 0.5561 0.4597 -0.0836 0.0800 -0.0112 130 TRP B O 4043 C CB . TRP B 131 ? 0.6025 0.5936 0.4837 -0.0690 0.0913 -0.0249 130 TRP B CB 4044 C CG . TRP B 131 ? 0.6101 0.5970 0.4939 -0.0543 0.0898 -0.0280 130 TRP B CG 4045 C CD1 . TRP B 131 ? 0.6186 0.6216 0.5135 -0.0451 0.0957 -0.0358 130 TRP B CD1 4046 C CD2 . TRP B 131 ? 0.6259 0.5898 0.5008 -0.0474 0.0821 -0.0238 130 TRP B CD2 4047 N NE1 . TRP B 131 ? 0.6243 0.6120 0.5158 -0.0323 0.0915 -0.0365 130 TRP B NE1 4048 C CE2 . TRP B 131 ? 0.6285 0.5921 0.5078 -0.0346 0.0833 -0.0288 130 TRP B CE2 4049 C CE3 . TRP B 131 ? 0.6282 0.5726 0.4930 -0.0509 0.0747 -0.0166 130 TRP B CE3 4050 C CZ2 . TRP B 131 ? 0.6433 0.5849 0.5155 -0.0270 0.0771 -0.0262 130 TRP B CZ2 4051 C CZ3 . TRP B 131 ? 0.6273 0.5543 0.4873 -0.0438 0.0694 -0.0143 130 TRP B CZ3 4052 C CH2 . TRP B 131 ? 0.6397 0.5638 0.5024 -0.0329 0.0705 -0.0188 130 TRP B CH2 4053 N N . ARG B 132 ? 0.6345 0.5611 0.4649 -0.0790 0.0839 -0.0139 131 ARG B N 4054 C CA . ARG B 132 ? 0.6332 0.5395 0.4527 -0.0808 0.0753 -0.0079 131 ARG B CA 4055 C C . ARG B 132 ? 0.6511 0.5479 0.4570 -0.0918 0.0756 -0.0040 131 ARG B C 4056 O O . ARG B 132 ? 0.6442 0.5290 0.4456 -0.0930 0.0683 0.0006 131 ARG B O 4057 C CB . ARG B 132 ? 0.6401 0.5301 0.4483 -0.0765 0.0728 -0.0090 131 ARG B CB 4058 C CG . ARG B 132 ? 0.6429 0.5355 0.4613 -0.0658 0.0719 -0.0123 131 ARG B CG 4059 C CD . ARG B 132 ? 0.6597 0.5346 0.4653 -0.0636 0.0699 -0.0148 131 ARG B CD 4060 N NE . ARG B 132 ? 0.6872 0.5592 0.4777 -0.0675 0.0768 -0.0197 131 ARG B NE 4061 C CZ . ARG B 132 ? 0.6958 0.5517 0.4696 -0.0681 0.0754 -0.0228 131 ARG B CZ 4062 N NH1 . ARG B 132 ? 0.6873 0.5288 0.4595 -0.0658 0.0670 -0.0219 131 ARG B NH1 4063 N NH2 . ARG B 132 ? 0.7116 0.5663 0.4695 -0.0720 0.0826 -0.0272 131 ARG B NH2 4064 N N . ARG B 133 ? 0.6921 0.5928 0.4903 -0.0996 0.0844 -0.0060 132 ARG B N 4065 C CA . ARG B 133 ? 0.7237 0.6116 0.5054 -0.1109 0.0854 -0.0016 132 ARG B CA 4066 C C . ARG B 133 ? 0.7231 0.6239 0.5153 -0.1194 0.0892 -0.0015 132 ARG B C 4067 O O . ARG B 133 ? 0.7003 0.6247 0.5121 -0.1176 0.0933 -0.0062 132 ARG B O 4068 C CB . ARG B 133 ? 0.7611 0.6403 0.5217 -0.1164 0.0927 -0.0025 132 ARG B CB 4069 C CG . ARG B 133 ? 0.7778 0.6367 0.5218 -0.1112 0.0851 -0.0009 132 ARG B CG 4070 C CD . ARG B 133 ? 0.8182 0.6728 0.5437 -0.1130 0.0925 -0.0049 132 ARG B CD 4071 N NE . ARG B 133 ? 0.8508 0.6823 0.5539 -0.1123 0.0838 -0.0018 132 ARG B NE 4072 C CZ . ARG B 133 ? 0.8603 0.6827 0.5418 -0.1133 0.0870 -0.0050 132 ARG B CZ 4073 N NH1 . ARG B 133 ? 0.8554 0.6898 0.5351 -0.1145 0.1000 -0.0116 132 ARG B NH1 4074 N NH2 . ARG B 133 ? 0.8777 0.6800 0.5398 -0.1125 0.0767 -0.0022 132 ARG B NH2 4075 N N . ALA B 134 ? 0.7405 0.6242 0.5192 -0.1283 0.0865 0.0037 133 ALA B N 4076 C CA . ALA B 134 ? 0.7358 0.6253 0.5192 -0.1397 0.0901 0.0041 133 ALA B CA 4077 C C . ALA B 134 ? 0.7682 0.6570 0.5376 -0.1527 0.1019 0.0044 133 ALA B C 4078 O O . ALA B 134 ? 0.7815 0.6617 0.5342 -0.1519 0.1057 0.0051 133 ALA B O 4079 C CB . ALA B 134 ? 0.7455 0.6125 0.5195 -0.1418 0.0809 0.0093 133 ALA B CB 4080 N N . PRO B 135 ? 0.7868 0.6841 0.5616 -0.1661 0.1079 0.0039 134 PRO B N 4081 C CA . PRO B 135 ? 0.8072 0.7083 0.5710 -0.1802 0.1215 0.0040 134 PRO B CA 4082 C C . PRO B 135 ? 0.8345 0.7034 0.5629 -0.1871 0.1228 0.0116 134 PRO B C 4083 O O . PRO B 135 ? 0.8676 0.7402 0.5833 -0.1945 0.1346 0.0111 134 PRO B O 4084 C CB . PRO B 135 ? 0.8213 0.7328 0.5972 -0.1949 0.1248 0.0030 134 PRO B CB 4085 C CG . PRO B 135 ? 0.8040 0.7350 0.6073 -0.1843 0.1162 -0.0020 134 PRO B CG 4086 C CD . PRO B 135 ? 0.7833 0.6939 0.5783 -0.1690 0.1041 0.0014 134 PRO B CD 4087 N N . ASN B 136 ? 0.8303 0.6686 0.5423 -0.1837 0.1106 0.0184 135 ASN B N 4088 C CA . ASN B 136 ? 0.8736 0.6791 0.5507 -0.1879 0.1087 0.0264 135 ASN B CA 4089 C C . ASN B 136 ? 0.8632 0.6684 0.5266 -0.1805 0.1108 0.0249 135 ASN B C 4090 O O . ASN B 136 ? 0.9200 0.7042 0.5527 -0.1869 0.1133 0.0303 135 ASN B O 4091 C CB . ASN B 136 ? 0.8833 0.6594 0.5499 -0.1817 0.0933 0.0326 135 ASN B CB 4092 C CG . ASN B 136 ? 0.8797 0.6637 0.5634 -0.1641 0.0823 0.0290 135 ASN B CG 4093 O OD1 . ASN B 136 ? 0.8818 0.6924 0.5918 -0.1581 0.0841 0.0224 135 ASN B OD1 4094 N ND2 . ASN B 136 ? 0.8929 0.6542 0.5621 -0.1559 0.0705 0.0336 135 ASN B ND2 4095 N N . GLU B 137 ? 0.8367 0.6622 0.5203 -0.1674 0.1091 0.0177 136 GLU B N 4096 C CA . GLU B 137 ? 0.8557 0.6809 0.5278 -0.1603 0.1109 0.0144 136 GLU B CA 4097 C C . GLU B 137 ? 0.8339 0.6888 0.5217 -0.1591 0.1245 0.0050 136 GLU B C 4098 O O . GLU B 137 ? 0.8189 0.6774 0.5058 -0.1493 0.1246 -0.0004 136 GLU B O 4099 C CB . GLU B 137 ? 0.8526 0.6695 0.5295 -0.1457 0.0965 0.0140 136 GLU B CB 4100 C CG . GLU B 137 ? 0.8736 0.6636 0.5361 -0.1451 0.0831 0.0222 136 GLU B CG 4101 C CD . GLU B 137 ? 0.8909 0.6748 0.5566 -0.1324 0.0700 0.0215 136 GLU B CD 4102 O OE1 . GLU B 137 ? 0.9095 0.6781 0.5531 -0.1308 0.0652 0.0230 136 GLU B OE1 4103 O OE2 . GLU B 137 ? 0.8666 0.6617 0.5562 -0.1246 0.0644 0.0193 136 GLU B OE2 4104 N N . ASN B 138 ? 0.8395 0.7152 0.5415 -0.1690 0.1355 0.0027 137 ASN B N 4105 C CA . ASN B 138 ? 0.8304 0.7377 0.5497 -0.1674 0.1489 -0.0068 137 ASN B CA 4106 C C . ASN B 138 ? 0.8614 0.7789 0.5724 -0.1849 0.1655 -0.0067 137 ASN B C 4107 O O . ASN B 138 ? 0.8694 0.8203 0.6051 -0.1885 0.1764 -0.0137 137 ASN B O 4108 C CB . ASN B 138 ? 0.8030 0.7385 0.5602 -0.1578 0.1454 -0.0129 137 ASN B CB 4109 C CG . ASN B 138 ? 0.7960 0.7320 0.5623 -0.1392 0.1373 -0.0173 137 ASN B CG 4110 O OD1 . ASN B 138 ? 0.8061 0.7377 0.5606 -0.1331 0.1409 -0.0215 137 ASN B OD1 4111 N ND2 . ASN B 138 ? 0.7774 0.7179 0.5635 -0.1308 0.1267 -0.0167 137 ASN B ND2 4112 N N . GLY B 139 ? 0.8884 0.7774 0.5641 -0.1963 0.1673 0.0014 138 GLY B N 4113 C CA . GLY B 139 ? 0.9094 0.8023 0.5702 -0.2156 0.1841 0.0036 138 GLY B CA 4114 C C . GLY B 139 ? 0.9052 0.8314 0.5762 -0.2153 0.2020 -0.0071 138 GLY B C 4115 O O . GLY B 139 ? 0.9132 0.8680 0.6022 -0.2271 0.2160 -0.0111 138 GLY B O 4116 N N . PRO B 140 ? 0.8971 0.8209 0.5578 -0.2018 0.2019 -0.0129 139 PRO B N 4117 C CA . PRO B 140 ? 0.9083 0.8632 0.5788 -0.1986 0.2190 -0.0249 139 PRO B CA 4118 C C . PRO B 140 ? 0.8733 0.8716 0.5908 -0.1915 0.2235 -0.0352 139 PRO B C 4119 O O . PRO B 140 ? 0.8933 0.9238 0.6245 -0.1971 0.2405 -0.0430 139 PRO B O 4120 C CB . PRO B 140 ? 0.9062 0.8448 0.5598 -0.1821 0.2122 -0.0296 139 PRO B CB 4121 C CG . PRO B 140 ? 0.9232 0.8200 0.5444 -0.1848 0.1973 -0.0176 139 PRO B CG 4122 C CD . PRO B 140 ? 0.9074 0.7995 0.5450 -0.1901 0.1870 -0.0093 139 PRO B CD 4123 N N . TYR B 141 ? 0.8493 0.8491 0.5908 -0.1792 0.2080 -0.0352 140 TYR B N 4124 C CA . TYR B 141 ? 0.8280 0.8663 0.6128 -0.1724 0.2087 -0.0431 140 TYR B CA 4125 C C . TYR B 141 ? 0.8420 0.9052 0.6425 -0.1914 0.2195 -0.0428 140 TYR B C 4126 O O . TYR B 141 ? 0.8268 0.9311 0.6556 -0.1907 0.2311 -0.0529 140 TYR B O 4127 C CB . TYR B 141 ? 0.7734 0.8028 0.5743 -0.1598 0.1893 -0.0400 140 TYR B CB 4128 C CG . TYR B 141 ? 0.7386 0.8035 0.5798 -0.1548 0.1873 -0.0459 140 TYR B CG 4129 C CD1 . TYR B 141 ? 0.7299 0.8229 0.5961 -0.1381 0.1897 -0.0566 140 TYR B CD1 4130 C CD2 . TYR B 141 ? 0.7284 0.7975 0.5815 -0.1659 0.1818 -0.0413 140 TYR B CD2 4131 C CE1 . TYR B 141 ? 0.7034 0.8291 0.6056 -0.1322 0.1860 -0.0617 140 TYR B CE1 4132 C CE2 . TYR B 141 ? 0.7024 0.8046 0.5910 -0.1614 0.1784 -0.0471 140 TYR B CE2 4133 C CZ . TYR B 141 ? 0.6917 0.8229 0.6049 -0.1443 0.1801 -0.0569 140 TYR B CZ 4134 O OH . TYR B 141 ? 0.6755 0.8399 0.6233 -0.1386 0.1750 -0.0623 140 TYR B OH 4135 N N . PHE B 142 ? 0.8653 0.9046 0.6485 -0.2082 0.2157 -0.0321 141 PHE B N 4136 C CA . PHE B 142 ? 0.8944 0.9540 0.6919 -0.2288 0.2252 -0.0315 141 PHE B CA 4137 C C . PHE B 142 ? 0.9482 1.0260 0.7367 -0.2444 0.2479 -0.0348 141 PHE B C 4138 O O . PHE B 142 ? 0.9718 1.0872 0.7872 -0.2560 0.2597 -0.0409 141 PHE B O 4139 C CB . PHE B 142 ? 0.8977 0.9223 0.6768 -0.2425 0.2149 -0.0194 141 PHE B CB 4140 C CG . PHE B 142 ? 0.8611 0.8751 0.6536 -0.2288 0.1950 -0.0178 141 PHE B CG 4141 C CD1 . PHE B 142 ? 0.8375 0.8830 0.6673 -0.2249 0.1903 -0.0245 141 PHE B CD1 4142 C CD2 . PHE B 142 ? 0.8549 0.8304 0.6234 -0.2192 0.1809 -0.0103 141 PHE B CD2 4143 C CE1 . PHE B 142 ? 0.8059 0.8420 0.6454 -0.2124 0.1730 -0.0231 141 PHE B CE1 4144 C CE2 . PHE B 142 ? 0.8316 0.8002 0.6130 -0.2069 0.1644 -0.0094 141 PHE B CE2 4145 C CZ . PHE B 142 ? 0.8046 0.8025 0.6200 -0.2038 0.1609 -0.0156 141 PHE B CZ 4146 N N . LEU B 143 ? 0.9979 1.0505 0.7487 -0.2454 0.2542 -0.0312 142 LEU B N 4147 C CA . LEU B 143 ? 1.0324 1.1027 0.7716 -0.2578 0.2771 -0.0354 142 LEU B CA 4148 C C . LEU B 143 ? 0.9991 1.1201 0.7749 -0.2442 0.2885 -0.0520 142 LEU B C 4149 O O . LEU B 143 ? 0.9960 1.1550 0.7907 -0.2565 0.3066 -0.0586 142 LEU B O 4150 C CB . LEU B 143 ? 1.1138 1.1465 0.8033 -0.2577 0.2795 -0.0295 142 LEU B CB 4151 C CG . LEU B 143 ? 1.1825 1.1663 0.8304 -0.2731 0.2722 -0.0129 142 LEU B CG 4152 C CD1 . LEU B 143 ? 1.2279 1.1749 0.8310 -0.2654 0.2674 -0.0083 142 LEU B CD1 4153 C CD2 . LEU B 143 ? 1.2291 1.2167 0.8659 -0.3017 0.2897 -0.0069 142 LEU B CD2 4154 N N . ALA B 144 ? 0.9702 1.0905 0.7556 -0.2190 0.2775 -0.0586 143 ALA B N 4155 C CA . ALA B 144 ? 0.9430 1.1047 0.7610 -0.2019 0.2850 -0.0742 143 ALA B CA 4156 C C . ALA B 144 ? 0.8996 1.1057 0.7667 -0.2024 0.2842 -0.0802 143 ALA B C 4157 O O . ALA B 144 ? 0.8936 1.1453 0.7894 -0.2001 0.2985 -0.0924 143 ALA B O 4158 C CB . ALA B 144 ? 0.9286 1.0721 0.7434 -0.1758 0.2709 -0.0782 143 ALA B CB 4159 N N . LEU B 145 ? 0.8752 1.0693 0.7522 -0.2049 0.2673 -0.0725 144 LEU B N 4160 C CA . LEU B 145 ? 0.8587 1.0917 0.7788 -0.2068 0.2641 -0.0776 144 LEU B CA 4161 C C . LEU B 145 ? 0.8829 1.1464 0.8143 -0.2326 0.2822 -0.0795 144 LEU B C 4162 O O . LEU B 145 ? 0.8555 1.1702 0.8261 -0.2320 0.2907 -0.0908 144 LEU B O 4163 C CB . LEU B 145 ? 0.8375 1.0452 0.7578 -0.2066 0.2429 -0.0684 144 LEU B CB 4164 C CG . LEU B 145 ? 0.8285 1.0706 0.7887 -0.2094 0.2360 -0.0727 144 LEU B CG 4165 C CD1 . LEU B 145 ? 0.8076 1.0892 0.8048 -0.1859 0.2328 -0.0849 144 LEU B CD1 4166 C CD2 . LEU B 145 ? 0.8187 1.0286 0.7700 -0.2107 0.2166 -0.0631 144 LEU B CD2 4167 N N . ARG B 146 ? 0.9221 1.1546 0.8191 -0.2558 0.2885 -0.0685 145 ARG B N 4168 C CA . ARG B 146 ? 0.9625 1.2181 0.8642 -0.2836 0.3076 -0.0687 145 ARG B CA 4169 C C . ARG B 146 ? 0.9566 1.2545 0.8704 -0.2824 0.3310 -0.0810 145 ARG B C 4170 O O . ARG B 146 ? 0.9377 1.2851 0.8866 -0.2930 0.3439 -0.0899 145 ARG B O 4171 C CB . ARG B 146 ? 1.0218 1.2273 0.8751 -0.3063 0.3103 -0.0532 145 ARG B CB 4172 C CG . ARG B 146 ? 1.0773 1.2981 0.9272 -0.3384 0.3314 -0.0510 145 ARG B CG 4173 C CD . ARG B 146 ? 1.1348 1.3003 0.9378 -0.3604 0.3297 -0.0339 145 ARG B CD 4174 N NE . ARG B 146 ? 1.1937 1.3213 0.9484 -0.3550 0.3332 -0.0270 145 ARG B NE 4175 C CZ . ARG B 146 ? 1.2663 1.4026 0.9999 -0.3653 0.3553 -0.0284 145 ARG B CZ 4176 N NH1 . ARG B 146 ? 1.2872 1.4711 1.0458 -0.3819 0.3775 -0.0366 145 ARG B NH1 4177 N NH2 . ARG B 146 ? 1.3219 1.4205 1.0092 -0.3589 0.3551 -0.0220 145 ARG B NH2 4178 N N . GLU B 147 ? 0.9697 1.2488 0.8546 -0.2696 0.3364 -0.0824 146 GLU B N 4179 C CA . GLU B 147 ? 0.9824 1.2984 0.8753 -0.2660 0.3587 -0.0953 146 GLU B CA 4180 C C . GLU B 147 ? 0.9352 1.3062 0.8819 -0.2447 0.3583 -0.1122 146 GLU B C 4181 O O . GLU B 147 ? 0.9400 1.3610 0.9132 -0.2497 0.3779 -0.1238 146 GLU B O 4182 C CB . GLU B 147 ? 1.0212 1.3031 0.8722 -0.2525 0.3608 -0.0951 146 GLU B CB 4183 C CG . GLU B 147 ? 1.0831 1.3187 0.8780 -0.2730 0.3669 -0.0811 146 GLU B CG 4184 C CD . GLU B 147 ? 1.1166 1.3176 0.8714 -0.2573 0.3642 -0.0816 146 GLU B CD 4185 O OE1 . GLU B 147 ? 1.1029 1.2597 0.8352 -0.2478 0.3435 -0.0727 146 GLU B OE1 4186 O OE2 . GLU B 147 ? 1.1790 1.3992 0.9261 -0.2543 0.3831 -0.0920 146 GLU B OE2 4187 N N . MET B 148 ? 0.8918 1.2533 0.8535 -0.2204 0.3362 -0.1133 147 MET B N 4188 C CA . MET B 148 ? 0.8600 1.2674 0.8693 -0.1968 0.3324 -0.1280 147 MET B CA 4189 C C . MET B 148 ? 0.8435 1.3006 0.8981 -0.2103 0.3345 -0.1324 147 MET B C 4190 O O . MET B 148 ? 0.8354 1.3474 0.9290 -0.2033 0.3453 -0.1466 147 MET B O 4191 C CB . MET B 148 ? 0.8357 1.2158 0.8461 -0.1708 0.3074 -0.1255 147 MET B CB 4192 C CG . MET B 148 ? 0.8181 1.2394 0.8735 -0.1449 0.3013 -0.1390 147 MET B CG 4193 S SD . MET B 148 ? 0.8221 1.2042 0.8696 -0.1145 0.2752 -0.1353 147 MET B SD 4194 C CE . MET B 148 ? 0.7900 1.1508 0.8375 -0.1274 0.2544 -0.1207 147 MET B CE 4195 N N . ILE B 149 ? 0.8396 1.2778 0.8887 -0.2298 0.3243 -0.1209 148 ILE B N 4196 C CA . ILE B 149 ? 0.8247 1.3054 0.9125 -0.2468 0.3256 -0.1245 148 ILE B CA 4197 C C . ILE B 149 ? 0.8574 1.3800 0.9570 -0.2697 0.3534 -0.1315 148 ILE B C 4198 O O . ILE B 149 ? 0.8553 1.4379 1.0022 -0.2699 0.3601 -0.1441 148 ILE B O 4199 C CB . ILE B 149 ? 0.8156 1.2602 0.8885 -0.2647 0.3099 -0.1109 148 ILE B CB 4200 C CG1 . ILE B 149 ? 0.7783 1.2008 0.8551 -0.2405 0.2832 -0.1081 148 ILE B CG1 4201 C CG2 . ILE B 149 ? 0.8142 1.2988 0.9205 -0.2895 0.3149 -0.1146 148 ILE B CG2 4202 C CD1 . ILE B 149 ? 0.7758 1.1532 0.8296 -0.2528 0.2672 -0.0948 148 ILE B CD1 4203 N N . GLU B 150 ? 0.8991 1.3908 0.9556 -0.2888 0.3693 -0.1231 149 GLU B N 4204 C CA . GLU B 150 ? 0.9278 1.4554 0.9890 -0.3125 0.3982 -0.1284 149 GLU B CA 4205 C C . GLU B 150 ? 0.9306 1.5133 1.0233 -0.2924 0.4140 -0.1473 149 GLU B C 4206 O O . GLU B 150 ? 0.9392 1.5826 1.0713 -0.3034 0.4311 -0.1587 149 GLU B O 4207 C CB . GLU B 150 ? 0.9653 1.4420 0.9665 -0.3333 0.4108 -0.1146 149 GLU B CB 4208 C CG . GLU B 150 ? 0.9812 1.4105 0.9553 -0.3577 0.3995 -0.0972 149 GLU B CG 4209 C CD . GLU B 150 ? 1.0254 1.3973 0.9363 -0.3740 0.4074 -0.0820 149 GLU B CD 4210 O OE1 . GLU B 150 ? 1.0535 1.4221 0.9389 -0.3681 0.4222 -0.0848 149 GLU B OE1 4211 O OE2 . GLU B 150 ? 1.0323 1.3608 0.9176 -0.3923 0.3979 -0.0673 149 GLU B OE2 4212 N N . GLU B 151 ? 0.9365 1.4981 1.0131 -0.2628 0.4077 -0.1511 150 GLU B N 4213 C CA . GLU B 151 ? 0.9389 1.5449 1.0418 -0.2391 0.4202 -0.1696 150 GLU B CA 4214 C C . GLU B 151 ? 0.8939 1.5597 1.0612 -0.2232 0.4116 -0.1830 150 GLU B C 4215 O O . GLU B 151 ? 0.8915 1.6184 1.0969 -0.2200 0.4289 -0.1988 150 GLU B O 4216 C CB . GLU B 151 ? 0.9658 1.5289 1.0375 -0.2100 0.4100 -0.1702 150 GLU B CB 4217 C CG . GLU B 151 ? 0.9962 1.5962 1.0946 -0.1795 0.4173 -0.1896 150 GLU B CG 4218 C CD . GLU B 151 ? 1.0229 1.5754 1.0922 -0.1514 0.4029 -0.1895 150 GLU B CD 4219 O OE1 . GLU B 151 ? 1.0396 1.5332 1.0627 -0.1586 0.3928 -0.1751 150 GLU B OE1 4220 O OE2 . GLU B 151 ? 1.0335 1.6075 1.1273 -0.1218 0.4007 -0.2040 150 GLU B OE2 4221 N N . MET B 152 ? 0.8525 1.5007 1.0309 -0.2120 0.3843 -0.1770 151 MET B N 4222 C CA . MET B 152 ? 0.8192 1.5179 1.0538 -0.1947 0.3720 -0.1881 151 MET B CA 4223 C C . MET B 152 ? 0.8139 1.5710 1.0892 -0.2211 0.3837 -0.1937 151 MET B C 4224 O O . MET B 152 ? 0.7904 1.6114 1.1167 -0.2108 0.3882 -0.2092 151 MET B O 4225 C CB . MET B 152 ? 0.7953 1.4588 1.0270 -0.1801 0.3407 -0.1789 151 MET B CB 4226 C CG . MET B 152 ? 0.7951 1.4130 0.9987 -0.1505 0.3286 -0.1766 151 MET B CG 4227 S SD . MET B 152 ? 0.7669 1.3383 0.9598 -0.1383 0.2950 -0.1634 151 MET B SD 4228 C CE . MET B 152 ? 0.7464 1.3713 0.9964 -0.1088 0.2807 -0.1770 151 MET B CE 4229 N N . TYR B 153 ? 0.8219 1.5558 1.0745 -0.2555 0.3881 -0.1813 152 TYR B N 4230 C CA . TYR B 153 ? 0.8227 1.6039 1.1068 -0.2876 0.4010 -0.1847 152 TYR B CA 4231 C C . TYR B 153 ? 0.8512 1.6904 1.1586 -0.2928 0.4311 -0.1992 152 TYR B C 4232 O O . TYR B 153 ? 0.8492 1.7591 1.2117 -0.2972 0.4384 -0.2130 152 TYR B O 4233 C CB . TYR B 153 ? 0.8352 1.5674 1.0769 -0.3242 0.4045 -0.1672 152 TYR B CB 4234 C CG . TYR B 153 ? 0.8412 1.6123 1.1036 -0.3629 0.4235 -0.1690 152 TYR B CG 4235 C CD1 . TYR B 153 ? 0.8771 1.6690 1.1299 -0.3828 0.4550 -0.1720 152 TYR B CD1 4236 C CD2 . TYR B 153 ? 0.8285 1.6136 1.1177 -0.3811 0.4102 -0.1677 152 TYR B CD2 4237 C CE1 . TYR B 153 ? 0.8909 1.7178 1.1622 -0.4205 0.4735 -0.1730 152 TYR B CE1 4238 C CE2 . TYR B 153 ? 0.8485 1.6676 1.1568 -0.4187 0.4273 -0.1694 152 TYR B CE2 4239 C CZ . TYR B 153 ? 0.8803 1.7204 1.1801 -0.4389 0.4593 -0.1718 152 TYR B CZ 4240 O OH . TYR B 153 ? 0.8891 1.7628 1.2077 -0.4782 0.4773 -0.1731 152 TYR B OH 4241 N N . GLN B 154 ? 0.8897 1.7010 1.1547 -0.2937 0.4498 -0.1966 153 GLN B N 4242 C CA . GLN B 154 ? 0.9214 1.7826 1.2002 -0.2994 0.4815 -0.2100 153 GLN B CA 4243 C C . GLN B 154 ? 0.8995 1.8168 1.2257 -0.2630 0.4823 -0.2312 153 GLN B C 4244 O O . GLN B 154 ? 0.8956 1.8831 1.2659 -0.2681 0.5018 -0.2465 153 GLN B O 4245 C CB . GLN B 154 ? 0.9612 1.7738 1.1773 -0.3069 0.4994 -0.2021 153 GLN B CB 4246 C CG . GLN B 154 ? 0.9941 1.7629 1.1651 -0.3470 0.5072 -0.1832 153 GLN B CG 4247 C CD . GLN B 154 ? 1.0218 1.8410 1.2137 -0.3836 0.5357 -0.1870 153 GLN B CD 4248 O OE1 . GLN B 154 ? 1.0180 1.8390 1.2210 -0.4117 0.5315 -0.1792 153 GLN B OE1 4249 N NE2 . GLN B 154 ? 1.0482 1.9078 1.2445 -0.3843 0.5654 -0.1993 153 GLN B NE2 4250 N N . LEU B 155 ? 0.8868 1.7715 1.2022 -0.2274 0.4620 -0.2318 154 LEU B N 4251 C CA . LEU B 155 ? 0.8854 1.8123 1.2388 -0.1898 0.4609 -0.2508 154 LEU B CA 4252 C C . LEU B 155 ? 0.8715 1.8596 1.2910 -0.1795 0.4468 -0.2611 154 LEU B C 4253 O O . LEU B 155 ? 0.8590 1.9134 1.3258 -0.1654 0.4585 -0.2797 154 LEU B O 4254 C CB . LEU B 155 ? 0.8879 1.7581 1.2092 -0.1557 0.4422 -0.2478 154 LEU B CB 4255 C CG . LEU B 155 ? 0.9154 1.7493 1.1883 -0.1488 0.4589 -0.2495 154 LEU B CG 4256 C CD1 . LEU B 155 ? 0.9429 1.7594 1.1743 -0.1857 0.4830 -0.2403 154 LEU B CD1 4257 C CD2 . LEU B 155 ? 0.9115 1.6753 1.1457 -0.1263 0.4349 -0.2400 154 LEU B CD2 4258 N N . TYR B 156 ? 0.8762 1.8429 1.2988 -0.1855 0.4213 -0.2496 155 TYR B N 4259 C CA . TYR B 156 ? 0.8650 1.8812 1.3448 -0.1703 0.4019 -0.2585 155 TYR B CA 4260 C C . TYR B 156 ? 0.8679 1.9303 1.3820 -0.2051 0.4066 -0.2591 155 TYR B C 4261 O O . TYR B 156 ? 0.8671 1.9746 1.4296 -0.1964 0.3905 -0.2668 155 TYR B O 4262 C CB . TYR B 156 ? 0.8428 1.8079 1.3060 -0.1458 0.3684 -0.2484 155 TYR B CB 4263 C CG . TYR B 156 ? 0.8558 1.7729 1.2817 -0.1171 0.3672 -0.2476 155 TYR B CG 4264 C CD1 . TYR B 156 ? 0.8659 1.8163 1.3141 -0.0877 0.3771 -0.2647 155 TYR B CD1 4265 C CD2 . TYR B 156 ? 0.8643 1.7037 1.2330 -0.1204 0.3576 -0.2308 155 TYR B CD2 4266 C CE1 . TYR B 156 ? 0.8803 1.7853 1.2934 -0.0630 0.3766 -0.2651 155 TYR B CE1 4267 C CE2 . TYR B 156 ? 0.8723 1.6694 1.2079 -0.0964 0.3568 -0.2310 155 TYR B CE2 4268 C CZ . TYR B 156 ? 0.8825 1.7114 1.2397 -0.0684 0.3662 -0.2482 155 TYR B CZ 4269 O OH . TYR B 156 ? 0.9029 1.6886 1.2270 -0.0456 0.3653 -0.2496 155 TYR B OH 4270 N N . GLY B 157 ? 0.8795 1.9316 1.3688 -0.2437 0.4283 -0.2516 156 GLY B N 4271 C CA . GLY B 157 ? 0.8728 1.9784 1.3986 -0.2790 0.4402 -0.2557 156 GLY B CA 4272 C C . GLY B 157 ? 0.8581 1.9464 1.3869 -0.3012 0.4187 -0.2450 156 GLY B C 4273 O O . GLY B 157 ? 0.8535 1.9949 1.4245 -0.3239 0.4221 -0.2519 156 GLY B O 4274 N N . GLY B 158 ? 0.8417 1.8576 1.3273 -0.2949 0.3963 -0.2293 157 GLY B N 4275 C CA . GLY B 158 ? 0.8374 1.8258 1.3143 -0.3203 0.3796 -0.2178 157 GLY B CA 4276 C C . GLY B 158 ? 0.8339 1.7359 1.2536 -0.3147 0.3611 -0.1996 157 GLY B C 4277 O O . GLY B 158 ? 0.8327 1.6966 1.2221 -0.2885 0.3576 -0.1958 157 GLY B O 4278 N N . PRO B 159 ? 0.8239 1.6960 1.2310 -0.3379 0.3475 -0.1893 158 PRO B N 4279 C CA . PRO B 159 ? 0.8226 1.6166 1.1795 -0.3336 0.3291 -0.1729 158 PRO B CA 4280 C C . PRO B 159 ? 0.7934 1.5735 1.1541 -0.2945 0.3031 -0.1738 158 PRO B C 4281 O O . PRO B 159 ? 0.7808 1.6117 1.1871 -0.2748 0.2929 -0.1861 158 PRO B O 4282 C CB . PRO B 159 ? 0.8314 1.6144 1.1888 -0.3662 0.3208 -0.1670 158 PRO B CB 4283 C CG . PRO B 159 ? 0.8189 1.6805 1.2378 -0.3760 0.3236 -0.1827 158 PRO B CG 4284 C CD . PRO B 159 ? 0.8281 1.7415 1.2705 -0.3694 0.3487 -0.1943 158 PRO B CD 4285 N N . VAL B 160 ? 0.7823 1.4938 1.0947 -0.2844 0.2924 -0.1603 159 VAL B N 4286 C CA . VAL B 160 ? 0.7609 1.4503 1.0673 -0.2480 0.2720 -0.1592 159 VAL B CA 4287 C C . VAL B 160 ? 0.7343 1.3987 1.0374 -0.2461 0.2453 -0.1525 159 VAL B C 4288 O O . VAL B 160 ? 0.7447 1.3817 1.0298 -0.2713 0.2422 -0.1443 159 VAL B O 4289 C CB . VAL B 160 ? 0.7726 1.4072 1.0315 -0.2337 0.2765 -0.1506 159 VAL B CB 4290 C CG1 . VAL B 160 ? 0.7937 1.4403 1.0421 -0.2449 0.3049 -0.1543 159 VAL B CG1 4291 C CG2 . VAL B 160 ? 0.7853 1.3508 0.9972 -0.2438 0.2648 -0.1340 159 VAL B CG2 4292 N N . VAL B 161 ? 0.7038 1.3776 1.0239 -0.2153 0.2264 -0.1565 160 VAL B N 4293 C CA . VAL B 161 ? 0.6899 1.3362 1.0015 -0.2084 0.2011 -0.1499 160 VAL B CA 4294 C C . VAL B 161 ? 0.6851 1.2705 0.9543 -0.1890 0.1928 -0.1387 160 VAL B C 4295 O O . VAL B 161 ? 0.6850 1.2708 0.9541 -0.1636 0.1941 -0.1416 160 VAL B O 4296 C CB . VAL B 161 ? 0.6721 1.3663 1.0273 -0.1882 0.1835 -0.1602 160 VAL B CB 4297 C CG1 . VAL B 161 ? 0.6610 1.3205 0.9997 -0.1771 0.1578 -0.1524 160 VAL B CG1 4298 C CG2 . VAL B 161 ? 0.6774 1.4322 1.0759 -0.2103 0.1887 -0.1714 160 VAL B CG2 4299 N N . LEU B 162 ? 0.6907 1.2248 0.9247 -0.2020 0.1853 -0.1266 161 LEU B N 4300 C CA . LEU B 162 ? 0.6806 1.1582 0.8764 -0.1857 0.1756 -0.1158 161 LEU B CA 4301 C C . LEU B 162 ? 0.6586 1.1325 0.8620 -0.1674 0.1520 -0.1147 161 LEU B C 4302 O O . LEU B 162 ? 0.6713 1.1547 0.8855 -0.1790 0.1415 -0.1156 161 LEU B O 4303 C CB . LEU B 162 ? 0.6990 1.1249 0.8542 -0.2075 0.1790 -0.1039 161 LEU B CB 4304 C CG . LEU B 162 ? 0.7281 1.1472 0.8658 -0.2278 0.2015 -0.1018 161 LEU B CG 4305 C CD1 . LEU B 162 ? 0.7457 1.1148 0.8462 -0.2500 0.2010 -0.0898 161 LEU B CD1 4306 C CD2 . LEU B 162 ? 0.7386 1.1467 0.8605 -0.2097 0.2108 -0.1021 161 LEU B CD2 4307 N N . VAL B 163 ? 0.6403 1.0987 0.8361 -0.1398 0.1437 -0.1128 162 VAL B N 4308 C CA . VAL B 163 ? 0.6295 1.0772 0.8253 -0.1221 0.1221 -0.1096 162 VAL B CA 4309 C C . VAL B 163 ? 0.6262 1.0166 0.7822 -0.1135 0.1175 -0.0980 162 VAL B C 4310 O O . VAL B 163 ? 0.6510 1.0267 0.7953 -0.1003 0.1241 -0.0971 162 VAL B O 4311 C CB . VAL B 163 ? 0.6225 1.1066 0.8487 -0.0948 0.1146 -0.1179 162 VAL B CB 4312 C CG1 . VAL B 163 ? 0.6162 1.0873 0.8387 -0.0778 0.0919 -0.1132 162 VAL B CG1 4313 C CG2 . VAL B 163 ? 0.6212 1.1685 0.8914 -0.1019 0.1208 -0.1310 162 VAL B CG2 4314 N N . ALA B 164 ? 0.6115 0.9706 0.7472 -0.1212 0.1065 -0.0901 163 ALA B N 4315 C CA . ALA B 164 ? 0.6101 0.9171 0.7095 -0.1159 0.1029 -0.0793 163 ALA B CA 4316 C C . ALA B 164 ? 0.6114 0.9033 0.7046 -0.1029 0.0844 -0.0746 163 ALA B C 4317 O O . ALA B 164 ? 0.5999 0.9105 0.7070 -0.1067 0.0743 -0.0777 163 ALA B O 4318 C CB . ALA B 164 ? 0.6161 0.8927 0.6903 -0.1392 0.1104 -0.0732 163 ALA B CB 4319 N N . HIS B 165 ? 0.6237 0.8823 0.6954 -0.0884 0.0804 -0.0675 164 HIS B N 4320 C CA . HIS B 165 ? 0.6263 0.8677 0.6883 -0.0762 0.0650 -0.0620 164 HIS B CA 4321 C C . HIS B 165 ? 0.6176 0.8145 0.6481 -0.0819 0.0644 -0.0527 164 HIS B C 4322 O O . HIS B 165 ? 0.6277 0.8016 0.6416 -0.0835 0.0730 -0.0492 164 HIS B O 4323 C CB . HIS B 165 ? 0.6338 0.8777 0.7013 -0.0515 0.0592 -0.0618 164 HIS B CB 4324 C CG . HIS B 165 ? 0.6398 0.8653 0.6951 -0.0400 0.0443 -0.0550 164 HIS B CG 4325 N ND1 . HIS B 165 ? 0.6483 0.8384 0.6812 -0.0299 0.0421 -0.0468 164 HIS B ND1 4326 C CD2 . HIS B 165 ? 0.6430 0.8804 0.7039 -0.0384 0.0312 -0.0551 164 HIS B CD2 4327 C CE1 . HIS B 165 ? 0.6512 0.8325 0.6763 -0.0227 0.0295 -0.0417 164 HIS B CE1 4328 N NE2 . HIS B 165 ? 0.6490 0.8579 0.6894 -0.0270 0.0224 -0.0465 164 HIS B NE2 4329 N N . SER B 166 ? 0.6073 0.7931 0.6294 -0.0849 0.0539 -0.0495 165 SER B N 4330 C CA . SER B 166 ? 0.6135 0.7604 0.6084 -0.0863 0.0511 -0.0414 165 SER B CA 4331 C C . SER B 166 ? 0.6209 0.7467 0.6006 -0.1020 0.0617 -0.0391 165 SER B C 4332 O O . SER B 166 ? 0.6260 0.7619 0.6114 -0.1183 0.0669 -0.0428 165 SER B O 4333 C CB . SER B 166 ? 0.6003 0.7298 0.5854 -0.0679 0.0477 -0.0357 165 SER B CB 4334 O OG . SER B 166 ? 0.5798 0.6780 0.5430 -0.0680 0.0437 -0.0285 165 SER B OG 4335 N N . MET B 167 ? 0.6177 0.7142 0.5778 -0.0978 0.0645 -0.0330 166 MET B N 4336 C CA . MET B 167 ? 0.6296 0.7037 0.5723 -0.1105 0.0726 -0.0300 166 MET B CA 4337 C C . MET B 167 ? 0.6402 0.7315 0.5908 -0.1208 0.0850 -0.0345 166 MET B C 4338 O O . MET B 167 ? 0.6667 0.7443 0.6044 -0.1358 0.0917 -0.0325 166 MET B O 4339 C CB . MET B 167 ? 0.6332 0.6791 0.5572 -0.1019 0.0726 -0.0240 166 MET B CB 4340 C CG . MET B 167 ? 0.6403 0.6602 0.5435 -0.1129 0.0777 -0.0198 166 MET B CG 4341 S SD . MET B 167 ? 0.6447 0.6357 0.5292 -0.1027 0.0751 -0.0139 166 MET B SD 4342 C CE . MET B 167 ? 0.6512 0.6529 0.5396 -0.0961 0.0839 -0.0181 166 MET B CE 4343 N N . GLY B 168 ? 0.6333 0.7539 0.6040 -0.1123 0.0886 -0.0405 167 GLY B N 4344 C CA . GLY B 168 ? 0.6362 0.7789 0.6171 -0.1219 0.1020 -0.0461 167 GLY B CA 4345 C C . GLY B 168 ? 0.6498 0.8057 0.6383 -0.1426 0.1052 -0.0486 167 GLY B C 4346 O O . GLY B 168 ? 0.6659 0.8280 0.6531 -0.1574 0.1178 -0.0502 167 GLY B O 4347 N N . ASN B 169 ? 0.6292 0.7890 0.6247 -0.1447 0.0941 -0.0492 168 ASN B N 4348 C CA . ASN B 169 ? 0.6569 0.8253 0.6583 -0.1656 0.0956 -0.0520 168 ASN B CA 4349 C C . ASN B 169 ? 0.6725 0.8031 0.6460 -0.1820 0.1003 -0.0453 168 ASN B C 4350 O O . ASN B 169 ? 0.6617 0.7956 0.6354 -0.2021 0.1084 -0.0465 168 ASN B O 4351 C CB . ASN B 169 ? 0.6661 0.8445 0.6784 -0.1631 0.0813 -0.0550 168 ASN B CB 4352 C CG . ASN B 169 ? 0.6585 0.8794 0.7010 -0.1506 0.0761 -0.0625 168 ASN B CG 4353 O OD1 . ASN B 169 ? 0.6591 0.9161 0.7261 -0.1594 0.0816 -0.0701 168 ASN B OD1 4354 N ND2 . ASN B 169 ? 0.6565 0.8738 0.6976 -0.1299 0.0656 -0.0602 168 ASN B ND2 4355 N N . MET B 170 ? 0.6699 0.7643 0.6194 -0.1733 0.0948 -0.0380 169 MET B N 4356 C CA . MET B 170 ? 0.7073 0.7637 0.6296 -0.1846 0.0968 -0.0312 169 MET B CA 4357 C C . MET B 170 ? 0.7088 0.7576 0.6178 -0.1910 0.1101 -0.0281 169 MET B C 4358 O O . MET B 170 ? 0.7172 0.7479 0.6101 -0.2081 0.1163 -0.0244 169 MET B O 4359 C CB . MET B 170 ? 0.7384 0.7635 0.6426 -0.1717 0.0866 -0.0254 169 MET B CB 4360 C CG . MET B 170 ? 0.7623 0.7863 0.6710 -0.1688 0.0747 -0.0275 169 MET B CG 4361 S SD . MET B 170 ? 0.8392 0.8444 0.7380 -0.1902 0.0737 -0.0285 169 MET B SD 4362 C CE . MET B 170 ? 0.8592 0.8155 0.7262 -0.1865 0.0708 -0.0198 169 MET B CE 4363 N N . TYR B 171 ? 0.6884 0.7494 0.6022 -0.1775 0.1143 -0.0297 170 TYR B N 4364 C CA . TYR B 171 ? 0.6976 0.7593 0.6015 -0.1831 0.1283 -0.0294 170 TYR B CA 4365 C C . TYR B 171 ? 0.7146 0.8040 0.6327 -0.2018 0.1408 -0.0344 170 TYR B C 4366 O O . TYR B 171 ? 0.7316 0.8076 0.6316 -0.2176 0.1515 -0.0307 170 TYR B O 4367 C CB . TYR B 171 ? 0.6733 0.7473 0.5839 -0.1643 0.1302 -0.0330 170 TYR B CB 4368 C CG . TYR B 171 ? 0.6646 0.7039 0.5484 -0.1559 0.1270 -0.0267 170 TYR B CG 4369 C CD1 . TYR B 171 ? 0.6509 0.6672 0.5266 -0.1465 0.1138 -0.0217 170 TYR B CD1 4370 C CD2 . TYR B 171 ? 0.6656 0.6965 0.5320 -0.1580 0.1373 -0.0263 170 TYR B CD2 4371 C CE1 . TYR B 171 ? 0.6519 0.6399 0.5059 -0.1397 0.1104 -0.0166 170 TYR B CE1 4372 C CE2 . TYR B 171 ? 0.6641 0.6645 0.5063 -0.1511 0.1330 -0.0213 170 TYR B CE2 4373 C CZ . TYR B 171 ? 0.6557 0.6358 0.4933 -0.1422 0.1193 -0.0166 170 TYR B CZ 4374 O OH . TYR B 171 ? 0.6621 0.6157 0.4785 -0.1362 0.1148 -0.0124 170 TYR B OH 4375 N N . THR B 172 ? 0.7084 0.8366 0.6586 -0.2003 0.1392 -0.0425 171 THR B N 4376 C CA . THR B 172 ? 0.7032 0.8651 0.6732 -0.2181 0.1509 -0.0488 171 THR B CA 4377 C C . THR B 172 ? 0.7214 0.8644 0.6795 -0.2428 0.1515 -0.0448 171 THR B C 4378 O O . THR B 172 ? 0.7419 0.8887 0.6952 -0.2632 0.1656 -0.0442 171 THR B O 4379 C CB . THR B 172 ? 0.6800 0.8899 0.6895 -0.2088 0.1460 -0.0591 171 THR B CB 4380 O OG1 . THR B 172 ? 0.6767 0.8996 0.6948 -0.1854 0.1458 -0.0625 171 THR B OG1 4381 C CG2 . THR B 172 ? 0.6895 0.9401 0.7242 -0.2275 0.1583 -0.0669 171 THR B CG2 4382 N N . LEU B 173 ? 0.7155 0.8360 0.6668 -0.2416 0.1372 -0.0420 172 LEU B N 4383 C CA . LEU B 173 ? 0.7337 0.8289 0.6704 -0.2634 0.1363 -0.0383 172 LEU B CA 4384 C C . LEU B 173 ? 0.7627 0.8156 0.6628 -0.2734 0.1440 -0.0281 172 LEU B C 4385 O O . LEU B 173 ? 0.8034 0.8469 0.6935 -0.2966 0.1531 -0.0255 172 LEU B O 4386 C CB . LEU B 173 ? 0.7221 0.7979 0.6552 -0.2567 0.1193 -0.0380 172 LEU B CB 4387 C CG . LEU B 173 ? 0.7494 0.7946 0.6665 -0.2767 0.1162 -0.0355 172 LEU B CG 4388 C CD1 . LEU B 173 ? 0.7734 0.8450 0.7090 -0.3016 0.1247 -0.0415 172 LEU B CD1 4389 C CD2 . LEU B 173 ? 0.7407 0.7713 0.6561 -0.2671 0.0999 -0.0375 172 LEU B CD2 4390 N N . TYR B 174 ? 0.7472 0.7745 0.6266 -0.2567 0.1401 -0.0221 173 TYR B N 4391 C CA . TYR B 174 ? 0.7744 0.7636 0.6185 -0.2631 0.1457 -0.0126 173 TYR B CA 4392 C C . TYR B 174 ? 0.8065 0.8123 0.6485 -0.2788 0.1643 -0.0131 173 TYR B C 4393 O O . TYR B 174 ? 0.8189 0.8014 0.6383 -0.2987 0.1719 -0.0066 173 TYR B O 4394 C CB . TYR B 174 ? 0.7676 0.7392 0.5972 -0.2413 0.1393 -0.0088 173 TYR B CB 4395 C CG . TYR B 174 ? 0.8079 0.7423 0.6008 -0.2449 0.1429 0.0004 173 TYR B CG 4396 C CD1 . TYR B 174 ? 0.8351 0.7263 0.6021 -0.2465 0.1333 0.0087 173 TYR B CD1 4397 C CD2 . TYR B 174 ? 0.8264 0.7687 0.6098 -0.2452 0.1551 0.0004 173 TYR B CD2 4398 C CE1 . TYR B 174 ? 0.8614 0.7186 0.5941 -0.2482 0.1344 0.0176 173 TYR B CE1 4399 C CE2 . TYR B 174 ? 0.8510 0.7589 0.5983 -0.2479 0.1570 0.0089 173 TYR B CE2 4400 C CZ . TYR B 174 ? 0.8787 0.7442 0.6009 -0.2494 0.1460 0.0179 173 TYR B CZ 4401 O OH . TYR B 174 ? 0.9082 0.7395 0.5939 -0.2510 0.1460 0.0268 173 TYR B OH 4402 N N . PHE B 175 ? 0.7916 0.8373 0.6564 -0.2695 0.1720 -0.0210 174 PHE B N 4403 C CA . PHE B 175 ? 0.8162 0.8844 0.6826 -0.2821 0.1912 -0.0236 174 PHE B CA 4404 C C . PHE B 175 ? 0.8335 0.9170 0.7106 -0.3098 0.2009 -0.0252 174 PHE B C 4405 O O . PHE B 175 ? 0.8638 0.9317 0.7182 -0.3300 0.2140 -0.0193 174 PHE B O 4406 C CB . PHE B 175 ? 0.7953 0.9080 0.6912 -0.2645 0.1957 -0.0343 174 PHE B CB 4407 C CG . PHE B 175 ? 0.8181 0.9634 0.7229 -0.2756 0.2164 -0.0400 174 PHE B CG 4408 C CD1 . PHE B 175 ? 0.8471 0.9731 0.7206 -0.2802 0.2290 -0.0353 174 PHE B CD1 4409 C CD2 . PHE B 175 ? 0.8181 1.0157 0.7630 -0.2809 0.2232 -0.0508 174 PHE B CD2 4410 C CE1 . PHE B 175 ? 0.8631 1.0206 0.7436 -0.2904 0.2498 -0.0413 174 PHE B CE1 4411 C CE2 . PHE B 175 ? 0.8333 1.0650 0.7888 -0.2908 0.2437 -0.0572 174 PHE B CE2 4412 C CZ . PHE B 175 ? 0.8560 1.0673 0.7786 -0.2958 0.2579 -0.0524 174 PHE B CZ 4413 N N . LEU B 176 ? 0.8148 0.9270 0.7246 -0.3117 0.1937 -0.0329 175 LEU B N 4414 C CA . LEU B 176 ? 0.8353 0.9678 0.7610 -0.3385 0.2019 -0.0364 175 LEU B CA 4415 C C . LEU B 176 ? 0.8720 0.9559 0.7662 -0.3604 0.2000 -0.0265 175 LEU B C 4416 O O . LEU B 176 ? 0.8989 0.9840 0.7885 -0.3871 0.2133 -0.0246 175 LEU B O 4417 C CB . LEU B 176 ? 0.8080 0.9825 0.7758 -0.3340 0.1919 -0.0477 175 LEU B CB 4418 C CG . LEU B 176 ? 0.7789 1.0071 0.7822 -0.3153 0.1953 -0.0584 175 LEU B CG 4419 C CD1 . LEU B 176 ? 0.7620 1.0223 0.8000 -0.3058 0.1801 -0.0674 175 LEU B CD1 4420 C CD2 . LEU B 176 ? 0.7966 1.0640 0.8160 -0.3308 0.2170 -0.0641 175 LEU B CD2 4421 N N . GLN B 177 ? 0.8911 0.9324 0.7642 -0.3492 0.1837 -0.0204 176 GLN B N 4422 C CA . GLN B 177 ? 0.9403 0.9294 0.7806 -0.3658 0.1801 -0.0107 176 GLN B CA 4423 C C . GLN B 177 ? 0.9960 0.9548 0.7995 -0.3793 0.1939 0.0001 176 GLN B C 4424 O O . GLN B 177 ? 1.0281 0.9546 0.8091 -0.4018 0.1976 0.0073 176 GLN B O 4425 C CB . GLN B 177 ? 0.9253 0.8758 0.7491 -0.3465 0.1609 -0.0067 176 GLN B CB 4426 C CG . GLN B 177 ? 0.9041 0.8694 0.7530 -0.3411 0.1469 -0.0154 176 GLN B CG 4427 C CD . GLN B 177 ? 0.8870 0.8143 0.7182 -0.3236 0.1301 -0.0119 176 GLN B CD 4428 O OE1 . GLN B 177 ? 0.8869 0.7841 0.6934 -0.3109 0.1274 -0.0039 176 GLN B OE1 4429 N NE2 . GLN B 177 ? 0.8836 0.8139 0.7279 -0.3232 0.1187 -0.0185 176 GLN B NE2 4430 N N . ARG B 178 ? 1.0163 0.9840 0.8123 -0.3655 0.2009 0.0013 177 ARG B N 4431 C CA . ARG B 178 ? 1.0759 1.0156 0.8343 -0.3751 0.2127 0.0113 177 ARG B CA 4432 C C . ARG B 178 ? 1.0715 1.0451 0.8369 -0.3940 0.2360 0.0083 177 ARG B C 4433 O O . ARG B 178 ? 1.0794 1.0320 0.8116 -0.4021 0.2474 0.0163 177 ARG B O 4434 C CB . ARG B 178 ? 1.1131 1.0341 0.8515 -0.3496 0.2054 0.0151 177 ARG B CB 4435 C CG . ARG B 178 ? 1.1674 1.0444 0.8877 -0.3360 0.1851 0.0216 177 ARG B CG 4436 C CD . ARG B 178 ? 1.2237 1.0898 0.9321 -0.3106 0.1765 0.0233 177 ARG B CD 4437 N NE . ARG B 178 ? 1.3204 1.1368 0.9999 -0.3038 0.1615 0.0327 177 ARG B NE 4438 C CZ . ARG B 178 ? 1.3982 1.1746 1.0375 -0.3071 0.1613 0.0436 177 ARG B CZ 4439 N NH1 . ARG B 178 ? 1.4175 1.1955 1.0369 -0.3181 0.1763 0.0472 177 ARG B NH1 4440 N NH2 . ARG B 178 ? 1.4324 1.1674 1.0506 -0.2984 0.1459 0.0509 177 ARG B NH2 4441 N N . GLN B 179 ? 1.0347 1.0626 0.8433 -0.4003 0.2431 -0.0037 178 GLN B N 4442 C CA . GLN B 179 ? 1.0294 1.0939 0.8489 -0.4202 0.2662 -0.0078 178 GLN B CA 4443 C C . GLN B 179 ? 1.0476 1.1092 0.8707 -0.4536 0.2725 -0.0058 178 GLN B C 4444 O O . GLN B 179 ? 1.0171 1.0793 0.8591 -0.4565 0.2594 -0.0095 178 GLN B O 4445 C CB . GLN B 179 ? 0.9879 1.1195 0.8564 -0.4066 0.2712 -0.0235 178 GLN B CB 4446 C CG . GLN B 179 ? 0.9603 1.0989 0.8308 -0.3738 0.2651 -0.0275 178 GLN B CG 4447 C CD . GLN B 179 ? 0.9852 1.0851 0.8101 -0.3690 0.2708 -0.0181 178 GLN B CD 4448 O OE1 . GLN B 179 ? 1.0249 1.1299 0.8335 -0.3837 0.2903 -0.0164 178 GLN B OE1 4449 N NE2 . GLN B 179 ? 0.9813 1.0439 0.7853 -0.3486 0.2537 -0.0124 178 GLN B NE2 4450 N N . PRO B 180 ? 1.0797 1.1371 0.8829 -0.4799 0.2932 0.0000 179 PRO B N 4451 C CA . PRO B 180 ? 1.1101 1.1684 0.9191 -0.5148 0.3015 0.0013 179 PRO B CA 4452 C C . PRO B 180 ? 1.0830 1.2059 0.9506 -0.5204 0.3021 -0.0147 179 PRO B C 4453 O O . PRO B 180 ? 1.0632 1.2420 0.9671 -0.5036 0.3065 -0.0269 179 PRO B O 4454 C CB . PRO B 180 ? 1.1515 1.2089 0.9347 -0.5383 0.3274 0.0082 179 PRO B CB 4455 C CG . PRO B 180 ? 1.1506 1.1849 0.8996 -0.5157 0.3279 0.0143 179 PRO B CG 4456 C CD . PRO B 180 ? 1.1011 1.1575 0.8777 -0.4795 0.3109 0.0043 179 PRO B CD 4457 N N . GLN B 181 ? 1.0919 1.2059 0.9677 -0.5442 0.2973 -0.0150 180 GLN B N 4458 C CA . GLN B 181 ? 1.0644 1.2370 0.9943 -0.5521 0.2955 -0.0303 180 GLN B CA 4459 C C . GLN B 181 ? 1.0614 1.3020 1.0258 -0.5642 0.3190 -0.0400 180 GLN B C 4460 O O . GLN B 181 ? 1.0313 1.3334 1.0446 -0.5517 0.3164 -0.0547 180 GLN B O 4461 C CB . GLN B 181 ? 1.0898 1.2362 1.0166 -0.5816 0.2891 -0.0283 180 GLN B CB 4462 C CG . GLN B 181 ? 1.0682 1.2703 1.0492 -0.5889 0.2820 -0.0446 180 GLN B CG 4463 C CD . GLN B 181 ? 1.0275 1.2458 1.0316 -0.5540 0.2588 -0.0535 180 GLN B CD 4464 O OE1 . GLN B 181 ? 1.0288 1.1977 1.0066 -0.5379 0.2409 -0.0475 180 GLN B OE1 4465 N NE2 . GLN B 181 ? 0.9911 1.2789 1.0442 -0.5418 0.2594 -0.0676 180 GLN B NE2 4466 N N . ALA B 182 ? 1.0982 1.3286 1.0367 -0.5876 0.3419 -0.0319 181 ALA B N 4467 C CA . ALA B 182 ? 1.0997 1.3948 1.0688 -0.6005 0.3672 -0.0412 181 ALA B CA 4468 C C . ALA B 182 ? 1.0593 1.3960 1.0485 -0.5658 0.3697 -0.0509 181 ALA B C 4469 O O . ALA B 182 ? 1.0345 1.4423 1.0721 -0.5639 0.3804 -0.0659 181 ALA B O 4470 C CB . ALA B 182 ? 1.1501 1.4175 1.0783 -0.6316 0.3916 -0.0286 181 ALA B CB 4471 N N . TRP B 183 ? 1.0472 1.3411 1.0013 -0.5379 0.3593 -0.0433 182 TRP B N 4472 C CA . TRP B 183 ? 1.0169 1.3412 0.9859 -0.5040 0.3591 -0.0521 182 TRP B CA 4473 C C . TRP B 183 ? 0.9642 1.3318 0.9845 -0.4811 0.3407 -0.0659 182 TRP B C 4474 O O . TRP B 183 ? 0.9262 1.3534 0.9866 -0.4666 0.3473 -0.0797 182 TRP B O 4475 C CB . TRP B 183 ? 1.0218 1.2874 0.9411 -0.4822 0.3502 -0.0406 182 TRP B CB 4476 C CG . TRP B 183 ? 1.0079 1.3003 0.9378 -0.4506 0.3523 -0.0494 182 TRP B CG 4477 C CD1 . TRP B 183 ? 1.0266 1.3313 0.9415 -0.4486 0.3727 -0.0513 182 TRP B CD1 4478 C CD2 . TRP B 183 ? 0.9716 1.2802 0.9282 -0.4168 0.3335 -0.0579 182 TRP B CD2 4479 N NE1 . TRP B 183 ? 1.0025 1.3285 0.9336 -0.4152 0.3671 -0.0611 182 TRP B NE1 4480 C CE2 . TRP B 183 ? 0.9603 1.2885 0.9170 -0.3956 0.3432 -0.0647 182 TRP B CE2 4481 C CE3 . TRP B 183 ? 0.9461 1.2526 0.9241 -0.4028 0.3097 -0.0603 182 TRP B CE3 4482 C CZ2 . TRP B 183 ? 0.9364 1.2799 0.9142 -0.3616 0.3295 -0.0731 182 TRP B CZ2 4483 C CZ3 . TRP B 183 ? 0.9064 1.2295 0.9043 -0.3693 0.2966 -0.0679 182 TRP B CZ3 4484 C CH2 . TRP B 183 ? 0.9080 1.2482 0.9059 -0.3493 0.3063 -0.0739 182 TRP B CH2 4485 N N . LYS B 184 ? 0.9621 1.3002 0.9804 -0.4781 0.3181 -0.0625 183 LYS B N 4486 C CA . LYS B 184 ? 0.9236 1.2961 0.9837 -0.4563 0.2989 -0.0740 183 LYS B CA 4487 C C . LYS B 184 ? 0.9155 1.3580 1.0306 -0.4716 0.3054 -0.0885 183 LYS B C 4488 O O . LYS B 184 ? 0.8764 1.3703 1.0329 -0.4503 0.2996 -0.1011 183 LYS B O 4489 C CB . LYS B 184 ? 0.9186 1.2413 0.9598 -0.4506 0.2743 -0.0671 183 LYS B CB 4490 C CG . LYS B 184 ? 0.9182 1.1834 0.9153 -0.4286 0.2651 -0.0556 183 LYS B CG 4491 C CD . LYS B 184 ? 0.9089 1.1281 0.8891 -0.4218 0.2421 -0.0498 183 LYS B CD 4492 C CE . LYS B 184 ? 0.9512 1.1279 0.9052 -0.4521 0.2433 -0.0412 183 LYS B CE 4493 N NZ . LYS B 184 ? 0.9548 1.0776 0.8833 -0.4418 0.2226 -0.0343 183 LYS B NZ 4494 N N . ASP B 185 ? 0.9538 1.3969 1.0678 -0.5088 0.3176 -0.0862 184 ASP B N 4495 C CA . ASP B 185 ? 0.9629 1.4738 1.1290 -0.5288 0.3260 -0.0999 184 ASP B CA 4496 C C . ASP B 185 ? 0.9513 1.5284 1.1509 -0.5203 0.3461 -0.1114 184 ASP B C 4497 O O . ASP B 185 ? 0.9168 1.5612 1.1707 -0.5157 0.3444 -0.1267 184 ASP B O 4498 C CB . ASP B 185 ? 1.0074 1.5007 1.1605 -0.5740 0.3384 -0.0937 184 ASP B CB 4499 C CG . ASP B 185 ? 1.0326 1.4754 1.1679 -0.5848 0.3170 -0.0878 184 ASP B CG 4500 O OD1 . ASP B 185 ? 1.0350 1.4679 1.1760 -0.5589 0.2928 -0.0908 184 ASP B OD1 4501 O OD2 . ASP B 185 ? 1.0736 1.4848 1.1874 -0.6197 0.3248 -0.0802 184 ASP B OD2 4502 N N . LYS B 186 ? 0.9767 1.5354 1.1441 -0.5170 0.3643 -0.1049 185 LYS B N 4503 C CA . LYS B 186 ? 0.9695 1.5866 1.1638 -0.5066 0.3845 -0.1164 185 LYS B CA 4504 C C . LYS B 186 ? 0.9298 1.5674 1.1438 -0.4619 0.3711 -0.1254 185 LYS B C 4505 O O . LYS B 186 ? 0.9124 1.6160 1.1751 -0.4484 0.3750 -0.1410 185 LYS B O 4506 C CB . LYS B 186 ? 1.0124 1.6004 1.1610 -0.5194 0.4093 -0.1066 185 LYS B CB 4507 C CG . LYS B 186 ? 1.0202 1.6638 1.1906 -0.5072 0.4319 -0.1190 185 LYS B CG 4508 C CD . LYS B 186 ? 1.0837 1.7006 1.2072 -0.5267 0.4584 -0.1094 185 LYS B CD 4509 C CE . LYS B 186 ? 1.0967 1.7674 1.2393 -0.5126 0.4813 -0.1230 185 LYS B CE 4510 N NZ . LYS B 186 ? 1.1475 1.7857 1.2365 -0.5266 0.5051 -0.1133 185 LYS B NZ 4511 N N . TYR B 187 ? 0.9166 1.4957 1.0914 -0.4389 0.3552 -0.1154 186 TYR B N 4512 C CA . TYR B 187 ? 0.8949 1.4815 1.0749 -0.3991 0.3479 -0.1213 186 TYR B CA 4513 C C . TYR B 187 ? 0.8610 1.4517 1.0646 -0.3717 0.3195 -0.1256 186 TYR B C 4514 O O . TYR B 187 ? 0.8387 1.4482 1.0580 -0.3398 0.3137 -0.1331 186 TYR B O 4515 C CB . TYR B 187 ? 0.9154 1.4403 1.0382 -0.3895 0.3508 -0.1090 186 TYR B CB 4516 C CG . TYR B 187 ? 0.9476 1.4783 1.0493 -0.4052 0.3797 -0.1083 186 TYR B CG 4517 C CD1 . TYR B 187 ? 0.9511 1.5338 1.0785 -0.3913 0.3967 -0.1223 186 TYR B CD1 4518 C CD2 . TYR B 187 ? 0.9894 1.4724 1.0436 -0.4332 0.3902 -0.0936 186 TYR B CD2 4519 C CE1 . TYR B 187 ? 0.9837 1.5730 1.0900 -0.4059 0.4246 -0.1224 186 TYR B CE1 4520 C CE2 . TYR B 187 ? 1.0258 1.5128 1.0568 -0.4483 0.4171 -0.0922 186 TYR B CE2 4521 C CZ . TYR B 187 ? 1.0200 1.5613 1.0771 -0.4351 0.4349 -0.1069 186 TYR B CZ 4522 O OH . TYR B 187 ? 1.0379 1.5840 1.0701 -0.4503 0.4627 -0.1062 186 TYR B OH 4523 N N . ILE B 188 ? 0.8549 1.4242 1.0574 -0.3833 0.3019 -0.1205 187 ILE B N 4524 C CA . ILE B 188 ? 0.8298 1.3952 1.0461 -0.3580 0.2747 -0.1227 187 ILE B CA 4525 C C . ILE B 188 ? 0.8157 1.4355 1.0818 -0.3665 0.2663 -0.1343 187 ILE B C 4526 O O . ILE B 188 ? 0.8165 1.4361 1.0856 -0.3973 0.2683 -0.1332 187 ILE B O 4527 C CB . ILE B 188 ? 0.8319 1.3263 1.0047 -0.3593 0.2578 -0.1085 187 ILE B CB 4528 C CG1 . ILE B 188 ? 0.8441 1.2854 0.9680 -0.3505 0.2641 -0.0970 187 ILE B CG1 4529 C CG2 . ILE B 188 ? 0.7981 1.2911 0.9845 -0.3347 0.2316 -0.1110 187 ILE B CG2 4530 C CD1 . ILE B 188 ? 0.8229 1.2709 0.9494 -0.3158 0.2610 -0.1010 187 ILE B CD1 4531 N N . ARG B 189 ? 0.7942 1.4581 1.0981 -0.3392 0.2555 -0.1454 188 ARG B N 4532 C CA . ARG B 189 ? 0.7878 1.5059 1.1403 -0.3428 0.2440 -0.1572 188 ARG B CA 4533 C C . ARG B 189 ? 0.7663 1.4513 1.1073 -0.3370 0.2168 -0.1523 188 ARG B C 4534 O O . ARG B 189 ? 0.7491 1.4462 1.1051 -0.3579 0.2088 -0.1557 188 ARG B O 4535 C CB . ARG B 189 ? 0.7853 1.5648 1.1824 -0.3139 0.2430 -0.1712 188 ARG B CB 4536 C CG . ARG B 189 ? 0.7951 1.6393 1.2471 -0.3160 0.2312 -0.1849 188 ARG B CG 4537 C CD . ARG B 189 ? 0.8032 1.7048 1.2967 -0.2842 0.2310 -0.1981 188 ARG B CD 4538 N NE . ARG B 189 ? 0.8192 1.7972 1.3725 -0.2884 0.2260 -0.2137 188 ARG B NE 4539 C CZ . ARG B 189 ? 0.8200 1.8161 1.3960 -0.2802 0.2003 -0.2180 188 ARG B CZ 4540 N NH1 . ARG B 189 ? 0.8252 1.7675 1.3680 -0.2678 0.1779 -0.2077 188 ARG B NH1 4541 N NH2 . ARG B 189 ? 0.8062 1.8764 1.4386 -0.2849 0.1971 -0.2332 188 ARG B NH2 4542 N N . ALA B 190 ? 0.7430 1.3884 1.0584 -0.3085 0.2027 -0.1453 189 ALA B N 4543 C CA . ALA B 190 ? 0.7344 1.3493 1.0373 -0.2997 0.1780 -0.1409 189 ALA B CA 4544 C C . ALA B 190 ? 0.7220 1.2830 0.9861 -0.2747 0.1706 -0.1301 189 ALA B C 4545 O O . ALA B 190 ? 0.7212 1.2788 0.9772 -0.2590 0.1811 -0.1289 189 ALA B O 4546 C CB . ALA B 190 ? 0.7238 1.3912 1.0705 -0.2840 0.1606 -0.1527 189 ALA B CB 4547 N N . PHE B 191 ? 0.7102 1.2307 0.9515 -0.2717 0.1527 -0.1233 190 PHE B N 4548 C CA . PHE B 191 ? 0.6933 1.1636 0.8999 -0.2497 0.1432 -0.1132 190 PHE B CA 4549 C C . PHE B 191 ? 0.6717 1.1498 0.8900 -0.2311 0.1200 -0.1160 190 PHE B C 4550 O O . PHE B 191 ? 0.6694 1.1448 0.8894 -0.2438 0.1086 -0.1175 190 PHE B O 4551 C CB . PHE B 191 ? 0.7089 1.1197 0.8724 -0.2678 0.1462 -0.1016 190 PHE B CB 4552 C CG . PHE B 191 ? 0.6936 1.0528 0.8227 -0.2490 0.1347 -0.0916 190 PHE B CG 4553 C CD1 . PHE B 191 ? 0.6741 1.0347 0.8051 -0.2194 0.1266 -0.0913 190 PHE B CD1 4554 C CD2 . PHE B 191 ? 0.7089 1.0166 0.8029 -0.2619 0.1325 -0.0824 190 PHE B CD2 4555 C CE1 . PHE B 191 ? 0.6639 0.9789 0.7644 -0.2053 0.1173 -0.0821 190 PHE B CE1 4556 C CE2 . PHE B 191 ? 0.7018 0.9658 0.7668 -0.2457 0.1228 -0.0740 190 PHE B CE2 4557 C CZ . PHE B 191 ? 0.6764 0.9454 0.7453 -0.2183 0.1156 -0.0739 190 PHE B CZ 4558 N N . VAL B 192 ? 0.6582 1.1475 0.8851 -0.2015 0.1135 -0.1172 191 VAL B N 4559 C CA . VAL B 192 ? 0.6522 1.1444 0.8848 -0.1805 0.0919 -0.1179 191 VAL B CA 4560 C C . VAL B 192 ? 0.6439 1.0787 0.8362 -0.1669 0.0855 -0.1058 191 VAL B C 4561 O O . VAL B 192 ? 0.6548 1.0711 0.8331 -0.1527 0.0924 -0.1013 191 VAL B O 4562 C CB . VAL B 192 ? 0.6402 1.1774 0.9058 -0.1552 0.0879 -0.1259 191 VAL B CB 4563 C CG1 . VAL B 192 ? 0.6318 1.1645 0.8963 -0.1324 0.0650 -0.1241 191 VAL B CG1 4564 C CG2 . VAL B 192 ? 0.6426 1.2425 0.9525 -0.1680 0.0944 -0.1390 191 VAL B CG2 4565 N N . SER B 193 ? 0.6369 1.0449 0.8114 -0.1725 0.0727 -0.1017 192 SER B N 4566 C CA . SER B 193 ? 0.6344 0.9888 0.7711 -0.1655 0.0680 -0.0909 192 SER B CA 4567 C C . SER B 193 ? 0.6116 0.9636 0.7465 -0.1433 0.0500 -0.0893 192 SER B C 4568 O O . SER B 193 ? 0.6024 0.9687 0.7460 -0.1462 0.0370 -0.0936 192 SER B O 4569 C CB . SER B 193 ? 0.6557 0.9793 0.7714 -0.1888 0.0683 -0.0878 192 SER B CB 4570 O OG . SER B 193 ? 0.6707 0.9454 0.7523 -0.1819 0.0642 -0.0783 192 SER B OG 4571 N N . LEU B 194 ? 0.6114 0.9454 0.7340 -0.1221 0.0492 -0.0832 193 LEU B N 4572 C CA . LEU B 194 ? 0.6048 0.9341 0.7231 -0.1004 0.0334 -0.0802 193 LEU B CA 4573 C C . LEU B 194 ? 0.5964 0.8767 0.6793 -0.0964 0.0300 -0.0697 193 LEU B C 4574 O O . LEU B 194 ? 0.5997 0.8535 0.6661 -0.0911 0.0380 -0.0636 193 LEU B O 4575 C CB . LEU B 194 ? 0.6122 0.9602 0.7460 -0.0775 0.0337 -0.0817 193 LEU B CB 4576 C CG . LEU B 194 ? 0.6290 1.0287 0.8006 -0.0779 0.0394 -0.0929 193 LEU B CG 4577 C CD1 . LEU B 194 ? 0.6401 1.0490 0.8217 -0.0536 0.0417 -0.0943 193 LEU B CD1 4578 C CD2 . LEU B 194 ? 0.6406 1.0787 0.8372 -0.0801 0.0254 -0.1006 193 LEU B CD2 4579 N N . GLY B 195 ? 0.6089 0.8782 0.6804 -0.0993 0.0183 -0.0686 194 GLY B N 4580 C CA . GLY B 195 ? 0.6070 0.8348 0.6476 -0.0941 0.0149 -0.0597 194 GLY B CA 4581 C C . GLY B 195 ? 0.6051 0.7993 0.6253 -0.1072 0.0259 -0.0551 194 GLY B C 4582 O O . GLY B 195 ? 0.6239 0.7892 0.6252 -0.0997 0.0288 -0.0477 194 GLY B O 4583 N N . ALA B 196 ? 0.6013 0.7989 0.6253 -0.1274 0.0314 -0.0595 195 ALA B N 4584 C CA . ALA B 196 ? 0.6128 0.7787 0.6173 -0.1406 0.0413 -0.0550 195 ALA B CA 4585 C C . ALA B 196 ? 0.6272 0.7570 0.6062 -0.1411 0.0351 -0.0506 195 ALA B C 4586 O O . ALA B 196 ? 0.6623 0.7936 0.6403 -0.1464 0.0265 -0.0549 195 ALA B O 4587 C CB . ALA B 196 ? 0.6224 0.8018 0.6378 -0.1629 0.0487 -0.0607 195 ALA B CB 4588 N N . PRO B 197 ? 0.6230 0.7215 0.5819 -0.1360 0.0395 -0.0430 196 PRO B N 4589 C CA . PRO B 197 ? 0.6376 0.7036 0.5742 -0.1356 0.0352 -0.0392 196 PRO B CA 4590 C C . PRO B 197 ? 0.6515 0.6945 0.5759 -0.1527 0.0398 -0.0393 196 PRO B C 4591 O O . PRO B 197 ? 0.6692 0.6834 0.5759 -0.1519 0.0432 -0.0335 196 PRO B O 4592 C CB . PRO B 197 ? 0.6370 0.6861 0.5627 -0.1219 0.0379 -0.0317 196 PRO B CB 4593 C CG . PRO B 197 ? 0.6278 0.6854 0.5607 -0.1245 0.0477 -0.0312 196 PRO B CG 4594 C CD . PRO B 197 ? 0.6277 0.7214 0.5844 -0.1295 0.0484 -0.0385 196 PRO B CD 4595 N N . TRP B 198 ? 0.6599 0.7150 0.5934 -0.1682 0.0393 -0.0458 197 TRP B N 4596 C CA . TRP B 198 ? 0.6864 0.7156 0.6063 -0.1854 0.0424 -0.0458 197 TRP B CA 4597 C C . TRP B 198 ? 0.7215 0.7178 0.6200 -0.1786 0.0355 -0.0438 197 TRP B C 4598 O O . TRP B 198 ? 0.7632 0.7653 0.6621 -0.1684 0.0271 -0.0468 197 TRP B O 4599 C CB . TRP B 198 ? 0.6975 0.7447 0.6311 -0.2035 0.0407 -0.0543 197 TRP B CB 4600 C CG . TRP B 198 ? 0.6900 0.7805 0.6516 -0.2089 0.0455 -0.0591 197 TRP B CG 4601 C CD1 . TRP B 198 ? 0.6812 0.8082 0.6660 -0.2102 0.0384 -0.0677 197 TRP B CD1 4602 C CD2 . TRP B 198 ? 0.6875 0.7910 0.6573 -0.2131 0.0583 -0.0565 197 TRP B CD2 4603 N NE1 . TRP B 198 ? 0.6722 0.8357 0.6818 -0.2142 0.0460 -0.0708 197 TRP B NE1 4604 C CE2 . TRP B 198 ? 0.6775 0.8273 0.6779 -0.2162 0.0591 -0.0643 197 TRP B CE2 4605 C CE3 . TRP B 198 ? 0.6897 0.7713 0.6436 -0.2139 0.0688 -0.0489 197 TRP B CE3 4606 C CZ2 . TRP B 198 ? 0.6730 0.8482 0.6892 -0.2199 0.0715 -0.0653 197 TRP B CZ2 4607 C CZ3 . TRP B 198 ? 0.6923 0.7969 0.6586 -0.2184 0.0809 -0.0496 197 TRP B CZ3 4608 C CH2 . TRP B 198 ? 0.6798 0.8312 0.6776 -0.2211 0.0829 -0.0580 197 TRP B CH2 4609 N N . GLY B 199 ? 0.7435 0.7058 0.6229 -0.1829 0.0390 -0.0389 198 GLY B N 4610 C CA . GLY B 199 ? 0.7458 0.6783 0.6069 -0.1749 0.0330 -0.0379 198 GLY B CA 4611 C C . GLY B 199 ? 0.7103 0.6436 0.5687 -0.1553 0.0304 -0.0339 198 GLY B C 4612 O O . GLY B 199 ? 0.7262 0.6431 0.5737 -0.1476 0.0255 -0.0348 198 GLY B O 4613 N N . GLY B 200 ? 0.6783 0.6299 0.5465 -0.1474 0.0341 -0.0300 199 GLY B N 4614 C CA . GLY B 200 ? 0.6733 0.6222 0.5378 -0.1311 0.0327 -0.0252 199 GLY B CA 4615 C C . GLY B 200 ? 0.6665 0.6323 0.5368 -0.1212 0.0264 -0.0279 199 GLY B C 4616 O O . GLY B 200 ? 0.6997 0.6786 0.5756 -0.1259 0.0217 -0.0341 199 GLY B O 4617 N N . VAL B 201 ? 0.6593 0.6240 0.5269 -0.1082 0.0260 -0.0230 200 VAL B N 4618 C CA . VAL B 201 ? 0.6754 0.6531 0.5445 -0.0984 0.0206 -0.0235 200 VAL B CA 4619 C C . VAL B 201 ? 0.6574 0.6193 0.5138 -0.0900 0.0201 -0.0204 200 VAL B C 4620 O O . VAL B 201 ? 0.6112 0.5596 0.4636 -0.0874 0.0239 -0.0159 200 VAL B O 4621 C CB . VAL B 201 ? 0.6935 0.6904 0.5740 -0.0904 0.0210 -0.0202 200 VAL B CB 4622 C CG1 . VAL B 201 ? 0.7193 0.7366 0.6156 -0.0977 0.0225 -0.0245 200 VAL B CG1 4623 C CG2 . VAL B 201 ? 0.7055 0.6912 0.5831 -0.0843 0.0263 -0.0135 200 VAL B CG2 4624 N N . ALA B 202 ? 0.6685 0.6341 0.5189 -0.0857 0.0155 -0.0232 201 ALA B N 4625 C CA . ALA B 202 ? 0.6720 0.6256 0.5111 -0.0788 0.0165 -0.0215 201 ALA B CA 4626 C C . ALA B 202 ? 0.6675 0.6219 0.5078 -0.0707 0.0200 -0.0133 201 ALA B C 4627 O O . ALA B 202 ? 0.6686 0.6123 0.5043 -0.0674 0.0232 -0.0109 201 ALA B O 4628 C CB . ALA B 202 ? 0.6850 0.6444 0.5155 -0.0762 0.0116 -0.0265 201 ALA B CB 4629 N N . LYS B 203 ? 0.6690 0.6360 0.5162 -0.0674 0.0191 -0.0095 202 LYS B N 4630 C CA . LYS B 203 ? 0.6747 0.6393 0.5209 -0.0602 0.0218 -0.0019 202 LYS B CA 4631 C C . LYS B 203 ? 0.6460 0.5991 0.4949 -0.0613 0.0267 0.0014 202 LYS B C 4632 O O . LYS B 203 ? 0.6266 0.5749 0.4736 -0.0572 0.0290 0.0067 202 LYS B O 4633 C CB . LYS B 203 ? 0.7266 0.7036 0.5781 -0.0547 0.0187 0.0013 202 LYS B CB 4634 C CG . LYS B 203 ? 0.7677 0.7476 0.6304 -0.0548 0.0212 0.0023 202 LYS B CG 4635 C CD . LYS B 203 ? 0.8301 0.8247 0.7001 -0.0478 0.0168 0.0032 202 LYS B CD 4636 C CE . LYS B 203 ? 0.8651 0.8534 0.7267 -0.0384 0.0148 0.0108 202 LYS B CE 4637 N NZ . LYS B 203 ? 0.8774 0.8795 0.7401 -0.0309 0.0068 0.0111 202 LYS B NZ 4638 N N . THR B 204 ? 0.6383 0.5862 0.4902 -0.0678 0.0281 -0.0015 203 THR B N 4639 C CA . THR B 204 ? 0.6182 0.5537 0.4694 -0.0691 0.0315 0.0012 203 THR B CA 4640 C C . THR B 204 ? 0.6053 0.5307 0.4511 -0.0661 0.0319 0.0025 203 THR B C 4641 O O . THR B 204 ? 0.5787 0.4986 0.4255 -0.0644 0.0336 0.0060 203 THR B O 4642 C CB . THR B 204 ? 0.6273 0.5579 0.4795 -0.0768 0.0334 -0.0007 203 THR B CB 4643 O OG1 . THR B 204 ? 0.6659 0.5806 0.5122 -0.0778 0.0346 0.0014 203 THR B OG1 4644 C CG2 . THR B 204 ? 0.6400 0.5718 0.4915 -0.0839 0.0318 -0.0058 203 THR B CG2 4645 N N . LEU B 205 ? 0.6252 0.5500 0.4663 -0.0649 0.0305 -0.0011 204 LEU B N 4646 C CA . LEU B 205 ? 0.6125 0.5324 0.4511 -0.0606 0.0318 -0.0009 204 LEU B CA 4647 C C . LEU B 205 ? 0.6095 0.5364 0.4501 -0.0566 0.0345 0.0045 204 LEU B C 4648 O O . LEU B 205 ? 0.6135 0.5377 0.4574 -0.0553 0.0365 0.0067 204 LEU B O 4649 C CB . LEU B 205 ? 0.6249 0.5431 0.4572 -0.0594 0.0305 -0.0073 204 LEU B CB 4650 C CG . LEU B 205 ? 0.6423 0.5462 0.4718 -0.0638 0.0279 -0.0118 204 LEU B CG 4651 C CD1 . LEU B 205 ? 0.6604 0.5639 0.4850 -0.0686 0.0249 -0.0182 204 LEU B CD1 4652 C CD2 . LEU B 205 ? 0.6577 0.5502 0.4855 -0.0589 0.0277 -0.0138 204 LEU B CD2 4653 N N . ARG B 206 ? 0.6202 0.5553 0.4586 -0.0552 0.0342 0.0069 205 ARG B N 4654 C CA . ARG B 206 ? 0.6449 0.5825 0.4824 -0.0525 0.0369 0.0134 205 ARG B CA 4655 C C . ARG B 206 ? 0.6231 0.5554 0.4665 -0.0534 0.0377 0.0178 205 ARG B C 4656 O O . ARG B 206 ? 0.6188 0.5483 0.4638 -0.0537 0.0404 0.0216 205 ARG B O 4657 C CB . ARG B 206 ? 0.6829 0.6274 0.5136 -0.0497 0.0348 0.0157 205 ARG B CB 4658 C CG . ARG B 206 ? 0.7428 0.6856 0.5688 -0.0474 0.0370 0.0239 205 ARG B CG 4659 C CD . ARG B 206 ? 0.8254 0.7729 0.6437 -0.0433 0.0323 0.0265 205 ARG B CD 4660 N NE . ARG B 206 ? 0.9197 0.8627 0.7272 -0.0410 0.0341 0.0350 205 ARG B NE 4661 C CZ . ARG B 206 ? 0.9860 0.9201 0.7936 -0.0394 0.0343 0.0423 205 ARG B CZ 4662 N NH1 . ARG B 206 ? 0.9919 0.9222 0.8105 -0.0389 0.0329 0.0411 205 ARG B NH1 4663 N NH2 . ARG B 206 ? 1.0247 0.9517 0.8195 -0.0387 0.0362 0.0508 205 ARG B NH2 4664 N N . VAL B 207 ? 0.6048 0.5362 0.4517 -0.0546 0.0358 0.0166 206 VAL B N 4665 C CA . VAL B 207 ? 0.5859 0.5113 0.4366 -0.0552 0.0368 0.0190 206 VAL B CA 4666 C C . VAL B 207 ? 0.5782 0.4961 0.4304 -0.0577 0.0378 0.0188 206 VAL B C 4667 O O . VAL B 207 ? 0.6088 0.5225 0.4626 -0.0580 0.0389 0.0221 206 VAL B O 4668 C CB . VAL B 207 ? 0.5813 0.5091 0.4354 -0.0568 0.0360 0.0157 206 VAL B CB 4669 C CG1 . VAL B 207 ? 0.5917 0.5119 0.4472 -0.0577 0.0378 0.0165 206 VAL B CG1 4670 C CG2 . VAL B 207 ? 0.5788 0.5175 0.4355 -0.0530 0.0340 0.0154 206 VAL B CG2 4671 N N . LEU B 208 ? 0.5574 0.4728 0.4087 -0.0595 0.0366 0.0149 207 LEU B N 4672 C CA . LEU B 208 ? 0.5595 0.4682 0.4121 -0.0604 0.0356 0.0145 207 LEU B CA 4673 C C . LEU B 208 ? 0.5603 0.4742 0.4173 -0.0584 0.0369 0.0155 207 LEU B C 4674 O O . LEU B 208 ? 0.5766 0.4891 0.4382 -0.0593 0.0363 0.0168 207 LEU B O 4675 C CB . LEU B 208 ? 0.5621 0.4637 0.4107 -0.0617 0.0332 0.0107 207 LEU B CB 4676 C CG . LEU B 208 ? 0.5621 0.4580 0.4063 -0.0663 0.0332 0.0101 207 LEU B CG 4677 C CD1 . LEU B 208 ? 0.5732 0.4611 0.4117 -0.0693 0.0314 0.0070 207 LEU B CD1 4678 C CD2 . LEU B 208 ? 0.5626 0.4509 0.4046 -0.0679 0.0327 0.0121 207 LEU B CD2 4679 N N . ALA B 209 ? 0.5544 0.4754 0.4099 -0.0561 0.0389 0.0144 208 ALA B N 4680 C CA . ALA B 209 ? 0.5645 0.4933 0.4244 -0.0546 0.0421 0.0146 208 ALA B CA 4681 C C . ALA B 209 ? 0.5675 0.4989 0.4298 -0.0575 0.0453 0.0206 208 ALA B C 4682 O O . ALA B 209 ? 0.5712 0.5054 0.4413 -0.0597 0.0464 0.0215 208 ALA B O 4683 C CB . ALA B 209 ? 0.5705 0.5058 0.4253 -0.0517 0.0443 0.0112 208 ALA B CB 4684 N N . SER B 210 ? 0.5694 0.4992 0.4247 -0.0575 0.0463 0.0246 209 SER B N 4685 C CA . SER B 210 ? 0.5853 0.5143 0.4389 -0.0600 0.0498 0.0312 209 SER B CA 4686 C C . SER B 210 ? 0.6030 0.5215 0.4527 -0.0597 0.0476 0.0356 209 SER B C 4687 O O . SER B 210 ? 0.6302 0.5430 0.4763 -0.0617 0.0497 0.0416 209 SER B O 4688 C CB . SER B 210 ? 0.5987 0.5350 0.4441 -0.0588 0.0540 0.0331 209 SER B CB 4689 O OG . SER B 210 ? 0.5658 0.5032 0.4031 -0.0547 0.0509 0.0306 209 SER B OG 4690 N N . GLY B 211 ? 0.6364 0.5516 0.4869 -0.0576 0.0439 0.0324 210 GLY B N 4691 C CA . GLY B 211 ? 0.6815 0.5885 0.5301 -0.0555 0.0421 0.0346 210 GLY B CA 4692 C C . GLY B 211 ? 0.7083 0.6184 0.5511 -0.0503 0.0403 0.0369 210 GLY B C 4693 O O . GLY B 211 ? 0.6944 0.6099 0.5315 -0.0494 0.0409 0.0389 210 GLY B O 4694 N N . ASP B 212 ? 0.7619 0.6700 0.6064 -0.0462 0.0378 0.0359 211 ASP B N 4695 C CA . ASP B 212 ? 0.8436 0.7570 0.6852 -0.0396 0.0343 0.0373 211 ASP B CA 4696 C C . ASP B 212 ? 0.8944 0.7984 0.7365 -0.0339 0.0328 0.0395 211 ASP B C 4697 O O . ASP B 212 ? 0.8672 0.7728 0.7162 -0.0324 0.0330 0.0345 211 ASP B O 4698 C CB . ASP B 212 ? 0.8782 0.8060 0.7255 -0.0392 0.0320 0.0305 211 ASP B CB 4699 C CG . ASP B 212 ? 0.9195 0.8575 0.7654 -0.0328 0.0268 0.0310 211 ASP B CG 4700 O OD1 . ASP B 212 ? 0.9187 0.8510 0.7605 -0.0260 0.0242 0.0362 211 ASP B OD1 4701 O OD2 . ASP B 212 ? 0.9768 0.9275 0.8252 -0.0344 0.0244 0.0259 211 ASP B OD2 4702 N N A ASN B 213 ? 0.9349 0.8281 0.7683 -0.0303 0.0315 0.0468 212 ASN B N 4703 N N B ASN B 213 ? 0.9412 0.8339 0.7745 -0.0306 0.0317 0.0470 212 ASN B N 4704 C CA A ASN B 213 ? 0.9562 0.8362 0.7882 -0.0233 0.0292 0.0492 212 ASN B CA 4705 C CA B ASN B 213 ? 0.9701 0.8501 0.8014 -0.0229 0.0289 0.0497 212 ASN B CA 4706 C C A ASN B 213 ? 0.9976 0.8834 0.8283 -0.0120 0.0229 0.0507 212 ASN B C 4707 C C B ASN B 213 ? 1.0211 0.9075 0.8493 -0.0125 0.0226 0.0521 212 ASN B C 4708 O O A ASN B 213 ? 1.0120 0.8856 0.8407 -0.0038 0.0201 0.0530 212 ASN B O 4709 O O B ASN B 213 ? 1.0090 0.9081 0.8469 -0.0058 0.0194 0.0463 212 ASN B O 4710 C CB A ASN B 213 ? 0.9557 0.8142 0.7781 -0.0272 0.0313 0.0569 212 ASN B CB 4711 C CB B ASN B 213 ? 0.9681 0.8260 0.7900 -0.0267 0.0311 0.0573 212 ASN B CB 4712 C CG A ASN B 213 ? 0.9591 0.8136 0.7681 -0.0271 0.0307 0.0660 212 ASN B CG 4713 C CG B ASN B 213 ? 0.9705 0.8238 0.7788 -0.0274 0.0308 0.0665 212 ASN B CG 4714 O OD1 A ASN B 213 ? 0.9719 0.8390 0.7776 -0.0227 0.0274 0.0663 212 ASN B OD1 4715 O OD1 B ASN B 213 ? 0.9898 0.8480 0.7921 -0.0196 0.0259 0.0692 212 ASN B OD1 4716 N ND2 A ASN B 213 ? 0.9577 0.7942 0.7578 -0.0332 0.0339 0.0734 212 ASN B ND2 4717 N ND2 B ASN B 213 ? 0.9595 0.8043 0.7627 -0.0370 0.0360 0.0714 212 ASN B ND2 4718 N N A ASN B 214 ? 1.0220 0.9259 0.8540 -0.0110 0.0199 0.0486 213 ASN B N 4719 N N B ASN B 214 ? 1.0862 0.9649 0.9004 -0.0116 0.0208 0.0606 213 ASN B N 4720 C CA A ASN B 214 ? 1.0641 0.9762 0.8947 -0.0002 0.0121 0.0500 213 ASN B CA 4721 C CA B ASN B 214 ? 1.1263 1.0084 0.9334 -0.0011 0.0130 0.0645 213 ASN B CA 4722 C C A ASN B 214 ? 1.0805 0.9975 0.9237 0.0097 0.0091 0.0451 213 ASN B C 4723 C C B ASN B 214 ? 1.1422 1.0225 0.9572 0.0114 0.0075 0.0621 213 ASN B C 4724 O O A ASN B 214 ? 1.1042 1.0209 0.9457 0.0216 0.0019 0.0479 213 ASN B O 4725 O O B ASN B 214 ? 1.1467 1.0210 0.9539 0.0223 0.0001 0.0676 213 ASN B O 4726 C CB A ASN B 214 ? 1.0635 0.9979 0.8974 -0.0026 0.0090 0.0450 213 ASN B CB 4727 C CB B ASN B 214 ? 1.1208 1.0266 0.9308 -0.0020 0.0101 0.0595 213 ASN B CB 4728 C CG A ASN B 214 ? 1.0710 1.0030 0.8923 -0.0104 0.0119 0.0480 213 ASN B CG 4729 C CG B ASN B 214 ? 1.1220 1.0273 0.9187 -0.0100 0.0139 0.0632 213 ASN B CG 4730 O OD1 A ASN B 214 ? 1.1056 1.0244 0.9211 -0.0167 0.0182 0.0519 213 ASN B OD1 4731 O OD1 B ASN B 214 ? 1.1030 0.9921 0.8856 -0.0128 0.0171 0.0720 213 ASN B OD1 4732 N ND2 A ASN B 214 ? 1.0595 1.0057 0.8773 -0.0103 0.0075 0.0452 213 ASN B ND2 4733 N ND2 B ASN B 214 ? 1.1126 1.0352 0.9136 -0.0142 0.0142 0.0560 213 ASN B ND2 4734 N N A ARG B 215 ? 1.0966 1.0191 0.9518 0.0056 0.0145 0.0374 214 ARG B N 4735 N N B ARG B 215 ? 1.1709 1.0565 1.0006 0.0106 0.0110 0.0537 214 ARG B N 4736 C CA A ARG B 215 ? 1.1292 1.0590 0.9970 0.0146 0.0138 0.0311 214 ARG B CA 4737 C CA B ARG B 215 ? 1.2220 1.1047 1.0597 0.0224 0.0081 0.0501 214 ARG B CA 4738 C C A ARG B 215 ? 1.1654 1.0699 1.0272 0.0202 0.0152 0.0338 214 ARG B C 4739 C C B ARG B 215 ? 1.2467 1.0975 1.0740 0.0236 0.0098 0.0553 214 ARG B C 4740 O O A ARG B 215 ? 1.2035 1.1088 1.0720 0.0320 0.0131 0.0302 214 ARG B O 4741 O O B ARG B 215 ? 1.2219 1.0655 1.0553 0.0306 0.0102 0.0502 214 ARG B O 4742 C CB A ARG B 215 ? 1.1381 1.0855 1.0192 0.0071 0.0198 0.0215 214 ARG B CB 4743 C CB B ARG B 215 ? 1.2093 1.1113 1.0648 0.0204 0.0124 0.0385 214 ARG B CB 4744 C CG A ARG B 215 ? 1.1379 1.1115 1.0284 0.0028 0.0177 0.0169 214 ARG B CG 4745 C CG B ARG B 215 ? 1.1968 1.1294 1.0665 0.0250 0.0085 0.0321 214 ARG B CG 4746 C CD A ARG B 215 ? 1.1374 1.1317 1.0396 0.0144 0.0104 0.0140 214 ARG B CD 4747 C CD B ARG B 215 ? 1.2118 1.1570 1.0777 0.0164 0.0069 0.0334 214 ARG B CD 4748 N NE A ARG B 215 ? 1.1281 1.1439 1.0352 0.0093 0.0059 0.0112 214 ARG B NE 4749 N NE B ARG B 215 ? 1.2465 1.2175 1.1226 0.0221 -0.0001 0.0292 214 ARG B NE 4750 C CZ A ARG B 215 ? 1.1084 1.1414 1.0212 0.0179 -0.0035 0.0105 214 ARG B CZ 4751 C CZ B ARG B 215 ? 1.2605 1.2448 1.1342 0.0162 -0.0032 0.0282 214 ARG B CZ 4752 N NH1 A ARG B 215 ? 1.1133 1.1444 1.0277 0.0335 -0.0098 0.0133 214 ARG B NH1 4753 N NH1 B ARG B 215 ? 1.2554 1.2298 1.1170 0.0057 0.0008 0.0311 214 ARG B NH1 4754 N NH2 A ARG B 215 ? 1.0899 1.1412 1.0062 0.0112 -0.0076 0.0067 214 ARG B NH2 4755 N NH2 B ARG B 215 ? 1.2609 1.2694 1.1449 0.0210 -0.0107 0.0235 214 ARG B NH2 4756 N N A ILE B 216 ? 1.1591 1.0417 1.0089 0.0117 0.0187 0.0392 215 ILE B N 4757 N N B ILE B 216 ? 1.2642 1.0963 1.0759 0.0160 0.0113 0.0649 215 ILE B N 4758 C CA A ILE B 216 ? 1.1565 1.0118 0.9989 0.0142 0.0198 0.0416 215 ILE B CA 4759 C CA B ILE B 216 ? 1.2620 1.0618 1.0626 0.0143 0.0128 0.0708 215 ILE B CA 4760 C C A ILE B 216 ? 1.1807 1.0138 1.0076 0.0066 0.0202 0.0521 215 ILE B C 4761 C C B ILE B 216 ? 1.1896 0.9789 0.9797 -0.0010 0.0185 0.0780 215 ILE B C 4762 O O A ILE B 216 ? 1.1837 1.0085 1.0083 -0.0052 0.0251 0.0522 215 ILE B O 4763 O O B ILE B 216 ? 1.1745 0.9648 0.9710 -0.0120 0.0243 0.0736 215 ILE B O 4764 C CB A ILE B 216 ? 1.1139 0.9677 0.9624 0.0090 0.0259 0.0329 215 ILE B CB 4765 C CB B ILE B 216 ? 1.3061 1.0996 1.1164 0.0143 0.0162 0.0616 215 ILE B CB 4766 C CG1 A ILE B 216 ? 1.0523 0.9343 0.9146 0.0085 0.0285 0.0240 215 ILE B CG1 4767 C CG1 B ILE B 216 ? 1.3152 1.1379 1.1430 0.0181 0.0172 0.0501 215 ILE B CG1 4768 C CG2 A ILE B 216 ? 1.1379 0.9706 0.9834 0.0182 0.0253 0.0305 215 ILE B CG2 4769 C CG2 B ILE B 216 ? 1.3307 1.0956 1.1336 0.0256 0.0122 0.0637 215 ILE B CG2 4770 C CD1 A ILE B 216 ? 1.0123 0.9068 0.8755 -0.0041 0.0312 0.0238 215 ILE B CD1 4771 C CD1 B ILE B 216 ? 1.2966 1.1411 1.1304 0.0060 0.0214 0.0472 215 ILE B CD1 4772 N N A PRO B 217 ? 1.2116 1.0357 1.0275 0.0133 0.0148 0.0610 216 PRO B N 4773 N N B PRO B 217 ? 1.1373 0.9178 0.9112 -0.0017 0.0169 0.0889 216 PRO B N 4774 C CA A PRO B 217 ? 1.2166 1.0231 1.0160 0.0056 0.0160 0.0721 216 PRO B CA 4775 C CA B PRO B 217 ? 1.0994 0.8721 0.8632 -0.0163 0.0236 0.0962 216 PRO B CA 4776 C C A PRO B 217 ? 1.2334 1.0093 1.0243 -0.0005 0.0191 0.0763 216 PRO B C 4777 C C B PRO B 217 ? 1.0466 0.7954 0.8093 -0.0261 0.0281 0.0977 216 PRO B C 4778 O O A PRO B 217 ? 1.2197 0.9841 0.9999 -0.0109 0.0224 0.0844 216 PRO B O 4779 O O B PRO B 217 ? 1.0001 0.7517 0.7644 -0.0404 0.0349 0.0989 216 PRO B O 4780 C CB A PRO B 217 ? 1.2263 1.0291 1.0141 0.0173 0.0081 0.0800 216 PRO B CB 4781 C CB B PRO B 217 ? 1.1433 0.9038 0.8854 -0.0119 0.0199 0.1086 216 PRO B CB 4782 C CG A PRO B 217 ? 1.2150 1.0428 1.0176 0.0291 0.0025 0.0717 216 PRO B CG 4783 C CG B PRO B 217 ? 1.1570 0.9331 0.9025 0.0036 0.0108 0.1051 216 PRO B CG 4784 C CD A PRO B 217 ? 1.2185 1.0511 1.0370 0.0290 0.0070 0.0608 216 PRO B CD 4785 C CD B PRO B 217 ? 1.1591 0.9401 0.9234 0.0116 0.0085 0.0944 216 PRO B CD 4786 N N A VAL B 218 ? 1.2603 1.0236 1.0559 0.0050 0.0184 0.0703 217 VAL B N 4787 N N B VAL B 218 ? 1.0232 0.7493 0.7839 -0.0183 0.0240 0.0969 217 VAL B N 4788 C CA A VAL B 218 ? 1.2869 1.0206 1.0752 -0.0020 0.0208 0.0720 217 VAL B CA 4789 C CA B VAL B 218 ? 1.0114 0.7136 0.7714 -0.0274 0.0271 0.0961 217 VAL B CA 4790 C C A VAL B 218 ? 1.2572 0.9995 1.0528 -0.0182 0.0271 0.0672 217 VAL B C 4791 C C B VAL B 218 ? 0.9480 0.6701 0.7244 -0.0384 0.0322 0.0862 217 VAL B C 4792 O O A VAL B 218 ? 1.2893 1.0115 1.0800 -0.0281 0.0292 0.0690 217 VAL B O 4793 O O B VAL B 218 ? 0.9277 0.6413 0.7050 -0.0522 0.0363 0.0868 217 VAL B O 4794 C CB A VAL B 218 ? 1.3205 1.0380 1.1109 0.0098 0.0181 0.0648 217 VAL B CB 4795 C CB B VAL B 218 ? 1.0329 0.7123 0.7917 -0.0147 0.0216 0.0918 217 VAL B CB 4796 C CG1 A VAL B 218 ? 1.3460 1.0260 1.1245 0.0033 0.0187 0.0680 217 VAL B CG1 4797 C CG1 B VAL B 218 ? 1.0470 0.6992 0.8028 -0.0255 0.0243 0.0903 217 VAL B CG1 4798 C CG2 A VAL B 218 ? 1.3286 1.0471 1.1182 0.0293 0.0109 0.0664 217 VAL B CG2 4799 C CG2 B VAL B 218 ? 1.0685 0.7281 0.8117 -0.0004 0.0145 0.1013 217 VAL B CG2 4800 N N A ILE B 219 ? 1.1961 0.9672 1.0033 -0.0207 0.0292 0.0609 218 ILE B N 4801 N N B ILE B 219 ? 0.9122 0.6606 0.7015 -0.0324 0.0313 0.0771 218 ILE B N 4802 C CA A ILE B 219 ? 1.1549 0.9353 0.9686 -0.0341 0.0336 0.0571 218 ILE B CA 4803 C CA B ILE B 219 ? 0.8764 0.6440 0.6790 -0.0411 0.0350 0.0687 218 ILE B CA 4804 C C A ILE B 219 ? 1.1037 0.8986 0.9168 -0.0417 0.0362 0.0628 218 ILE B C 4805 C C B ILE B 219 ? 0.8474 0.6338 0.6520 -0.0503 0.0391 0.0720 218 ILE B C 4806 O O A ILE B 219 ? 1.0933 0.9051 0.9070 -0.0366 0.0351 0.0634 218 ILE B O 4807 O O B ILE B 219 ? 0.8330 0.6329 0.6347 -0.0455 0.0384 0.0746 218 ILE B O 4808 C CB A ILE B 219 ? 1.1483 0.9471 0.9729 -0.0326 0.0344 0.0464 218 ILE B CB 4809 C CB B ILE B 219 ? 0.8623 0.6495 0.6758 -0.0325 0.0332 0.0588 218 ILE B CB 4810 C CG1 A ILE B 219 ? 1.1704 0.9612 0.9958 -0.0218 0.0329 0.0398 218 ILE B CG1 4811 C CG1 B ILE B 219 ? 0.8806 0.6534 0.6939 -0.0225 0.0306 0.0534 218 ILE B CG1 4812 C CG2 A ILE B 219 ? 1.1498 0.9502 0.9781 -0.0447 0.0368 0.0426 218 ILE B CG2 4813 C CG2 B ILE B 219 ? 0.8448 0.6482 0.6682 -0.0414 0.0363 0.0518 218 ILE B CG2 4814 C CD1 A ILE B 219 ? 1.1563 0.9651 0.9901 -0.0209 0.0352 0.0300 218 ILE B CD1 4815 C CD1 B ILE B 219 ? 0.8813 0.6607 0.6957 -0.0068 0.0263 0.0532 218 ILE B CD1 4816 N N A GLY B 220 ? 1.0558 0.8449 0.8679 -0.0541 0.0398 0.0660 219 GLY B N 4817 N N B GLY B 220 ? 0.8350 0.6232 0.6451 -0.0629 0.0431 0.0708 219 GLY B N 4818 C CA A GLY B 220 ? 1.0060 0.8110 0.8194 -0.0617 0.0439 0.0697 219 GLY B CA 4819 C CA B GLY B 220 ? 0.8161 0.6252 0.6315 -0.0702 0.0475 0.0715 219 GLY B CA 4820 C C A GLY B 220 ? 0.9466 0.7765 0.7711 -0.0610 0.0442 0.0618 219 GLY B C 4821 C C B GLY B 220 ? 0.7970 0.6287 0.6224 -0.0655 0.0461 0.0630 219 GLY B C 4822 O O A GLY B 220 ? 0.9074 0.7402 0.7392 -0.0606 0.0427 0.0545 219 GLY B O 4823 O O B GLY B 220 ? 0.7648 0.5980 0.5975 -0.0649 0.0441 0.0557 219 GLY B O 4824 N N A PRO B 221 ? 0.8952 0.7411 0.7188 -0.0609 0.0461 0.0634 220 PRO B N 4825 N N B PRO B 221 ? 0.7892 0.6367 0.6129 -0.0628 0.0472 0.0640 220 PRO B N 4826 C CA A PRO B 221 ? 0.8429 0.7084 0.6747 -0.0591 0.0456 0.0561 220 PRO B CA 4827 C CA B PRO B 221 ? 0.7636 0.6295 0.5953 -0.0594 0.0458 0.0563 220 PRO B CA 4828 C C A PRO B 221 ? 0.8078 0.6798 0.6505 -0.0656 0.0467 0.0502 220 PRO B C 4829 C C B PRO B 221 ? 0.7603 0.6334 0.6030 -0.0656 0.0469 0.0502 220 PRO B C 4830 O O A PRO B 221 ? 0.7857 0.6633 0.6332 -0.0631 0.0444 0.0438 220 PRO B O 4831 O O B PRO B 221 ? 0.7375 0.6175 0.5851 -0.0630 0.0446 0.0439 220 PRO B O 4832 C CB A PRO B 221 ? 0.8529 0.7297 0.6789 -0.0592 0.0482 0.0593 220 PRO B CB 4833 C CB B PRO B 221 ? 0.7624 0.6407 0.5885 -0.0584 0.0478 0.0588 220 PRO B CB 4834 C CG A PRO B 221 ? 0.8804 0.7466 0.6977 -0.0650 0.0523 0.0682 220 PRO B CG 4835 C CG B PRO B 221 ? 0.7820 0.6519 0.5990 -0.0639 0.0522 0.0675 220 PRO B CG 4836 C CD A PRO B 221 ? 0.8988 0.7430 0.7113 -0.0631 0.0492 0.0720 220 PRO B CD 4837 C CD B PRO B 221 ? 0.7965 0.6441 0.6090 -0.0639 0.0501 0.0722 220 PRO B CD 4838 N N . LEU B 222 ? 0.7743 0.6460 0.6207 -0.0739 0.0499 0.0523 221 LEU B N 4839 C CA . LEU B 222 ? 0.7554 0.6355 0.6133 -0.0790 0.0493 0.0466 221 LEU B CA 4840 C C . LEU B 222 ? 0.7760 0.6444 0.6352 -0.0798 0.0450 0.0424 221 LEU B C 4841 O O . LEU B 222 ? 0.7838 0.6578 0.6488 -0.0805 0.0420 0.0368 221 LEU B O 4842 C CB . LEU B 222 ? 0.7506 0.6377 0.6153 -0.0881 0.0538 0.0491 221 LEU B CB 4843 C CG . LEU B 222 ? 0.7455 0.6479 0.6099 -0.0884 0.0597 0.0514 221 LEU B CG 4844 C CD1 . LEU B 222 ? 0.7387 0.6518 0.6139 -0.0984 0.0650 0.0523 221 LEU B CD1 4845 C CD2 . LEU B 222 ? 0.7328 0.6490 0.6003 -0.0811 0.0580 0.0451 221 LEU B CD2 4846 N N . LYS B 223 ? 0.8166 0.6671 0.6684 -0.0788 0.0443 0.0451 222 LYS B N 4847 C CA . LYS B 223 ? 0.8502 0.6877 0.7006 -0.0785 0.0408 0.0401 222 LYS B CA 4848 C C . LYS B 223 ? 0.8236 0.6653 0.6721 -0.0703 0.0392 0.0351 222 LYS B C 4849 O O . LYS B 223 ? 0.8598 0.7031 0.7094 -0.0713 0.0371 0.0293 222 LYS B O 4850 C CB . LYS B 223 ? 0.8839 0.6984 0.7265 -0.0790 0.0406 0.0435 222 LYS B CB 4851 C CG . LYS B 223 ? 0.9170 0.7227 0.7622 -0.0912 0.0412 0.0454 222 LYS B CG 4852 C CD . LYS B 223 ? 0.9327 0.7378 0.7828 -0.0961 0.0371 0.0372 222 LYS B CD 4853 C CE . LYS B 223 ? 0.9351 0.7512 0.7967 -0.1083 0.0371 0.0370 222 LYS B CE 4854 N NZ . LYS B 223 ? 0.9833 0.7818 0.8428 -0.1188 0.0385 0.0408 222 LYS B NZ 4855 N N . ILE B 224 ? 0.7925 0.6371 0.6377 -0.0626 0.0400 0.0372 223 ILE B N 4856 C CA . ILE B 224 ? 0.7998 0.6516 0.6455 -0.0562 0.0393 0.0321 223 ILE B CA 4857 C C . ILE B 224 ? 0.7787 0.6454 0.6284 -0.0586 0.0393 0.0289 223 ILE B C 4858 O O . ILE B 224 ? 0.7707 0.6406 0.6201 -0.0573 0.0393 0.0242 223 ILE B O 4859 C CB . ILE B 224 ? 0.8161 0.6708 0.6601 -0.0474 0.0389 0.0345 223 ILE B CB 4860 C CG1 . ILE B 224 ? 0.8561 0.7174 0.7030 -0.0414 0.0390 0.0280 223 ILE B CG1 4861 C CG2 . ILE B 224 ? 0.7980 0.6659 0.6423 -0.0472 0.0390 0.0382 223 ILE B CG2 4862 C CD1 . ILE B 224 ? 0.9078 0.7802 0.7575 -0.0329 0.0376 0.0287 223 ILE B CD1 4863 N N . ARG B 225 ? 0.7415 0.6158 0.5942 -0.0622 0.0398 0.0313 224 ARG B N 4864 C CA . ARG B 225 ? 0.6889 0.5735 0.5446 -0.0635 0.0391 0.0280 224 ARG B CA 4865 C C . ARG B 225 ? 0.6832 0.5629 0.5384 -0.0664 0.0365 0.0238 224 ARG B C 4866 O O . ARG B 225 ? 0.6716 0.5537 0.5248 -0.0661 0.0355 0.0209 224 ARG B O 4867 C CB . ARG B 225 ? 0.6641 0.5569 0.5241 -0.0660 0.0404 0.0302 224 ARG B CB 4868 C CG . ARG B 225 ? 0.6370 0.5385 0.4995 -0.0651 0.0393 0.0265 224 ARG B CG 4869 C CD . ARG B 225 ? 0.6184 0.5298 0.4863 -0.0661 0.0417 0.0273 224 ARG B CD 4870 N NE . ARG B 225 ? 0.6091 0.5220 0.4850 -0.0707 0.0413 0.0276 224 ARG B NE 4871 C CZ . ARG B 225 ? 0.5928 0.5173 0.4769 -0.0728 0.0443 0.0278 224 ARG B CZ 4872 N NH1 . ARG B 225 ? 0.6070 0.5412 0.4902 -0.0700 0.0484 0.0276 224 ARG B NH1 4873 N NH2 . ARG B 225 ? 0.5913 0.5194 0.4850 -0.0781 0.0434 0.0274 224 ARG B NH2 4874 N N . GLU B 226 ? 0.6942 0.5652 0.5494 -0.0697 0.0352 0.0236 225 GLU B N 4875 C CA . GLU B 226 ? 0.7180 0.5834 0.5701 -0.0724 0.0316 0.0195 225 GLU B CA 4876 C C . GLU B 226 ? 0.7019 0.5626 0.5455 -0.0698 0.0327 0.0161 225 GLU B C 4877 O O . GLU B 226 ? 0.7065 0.5668 0.5452 -0.0710 0.0308 0.0140 225 GLU B O 4878 C CB . GLU B 226 ? 0.7606 0.6169 0.6134 -0.0772 0.0294 0.0188 225 GLU B CB 4879 C CG . GLU B 226 ? 0.8069 0.6714 0.6704 -0.0825 0.0281 0.0207 225 GLU B CG 4880 C CD . GLU B 226 ? 0.8700 0.7252 0.7352 -0.0896 0.0261 0.0200 225 GLU B CD 4881 O OE1 . GLU B 226 ? 0.9557 0.8037 0.8166 -0.0919 0.0212 0.0152 225 GLU B OE1 4882 O OE2 . GLU B 226 ? 0.8670 0.7210 0.7363 -0.0937 0.0295 0.0242 225 GLU B OE2 4883 N N . GLN B 227 ? 0.6908 0.5488 0.5327 -0.0659 0.0360 0.0158 226 GLN B N 4884 C CA . GLN B 227 ? 0.6840 0.5425 0.5206 -0.0634 0.0388 0.0119 226 GLN B CA 4885 C C . GLN B 227 ? 0.6750 0.5451 0.5136 -0.0634 0.0404 0.0122 226 GLN B C 4886 O O . GLN B 227 ? 0.6657 0.5361 0.4987 -0.0659 0.0417 0.0098 226 GLN B O 4887 C CB . GLN B 227 ? 0.6933 0.5491 0.5312 -0.0572 0.0415 0.0109 226 GLN B CB 4888 C CG . GLN B 227 ? 0.7166 0.5765 0.5520 -0.0539 0.0457 0.0055 226 GLN B CG 4889 C CD . GLN B 227 ? 0.7123 0.5892 0.5547 -0.0518 0.0482 0.0057 226 GLN B CD 4890 O OE1 . GLN B 227 ? 0.7386 0.6224 0.5876 -0.0486 0.0465 0.0091 226 GLN B OE1 4891 N NE2 . GLN B 227 ? 0.7414 0.6252 0.5815 -0.0545 0.0523 0.0017 226 GLN B NE2 4892 N N . GLN B 228 ? 0.6518 0.5301 0.4968 -0.0614 0.0402 0.0153 227 GLN B N 4893 C CA . GLN B 228 ? 0.6485 0.5373 0.4956 -0.0617 0.0412 0.0146 227 GLN B CA 4894 C C . GLN B 228 ? 0.6101 0.4962 0.4531 -0.0663 0.0394 0.0142 227 GLN B C 4895 O O . GLN B 228 ? 0.5997 0.4874 0.4396 -0.0691 0.0407 0.0124 227 GLN B O 4896 C CB . GLN B 228 ? 0.6637 0.5606 0.5159 -0.0583 0.0405 0.0175 227 GLN B CB 4897 C CG . GLN B 228 ? 0.6871 0.5859 0.5418 -0.0522 0.0411 0.0185 227 GLN B CG 4898 C CD . GLN B 228 ? 0.7148 0.6174 0.5701 -0.0487 0.0394 0.0230 227 GLN B CD 4899 O OE1 . GLN B 228 ? 0.7189 0.6192 0.5722 -0.0512 0.0391 0.0263 227 GLN B OE1 4900 N NE2 . GLN B 228 ? 0.7330 0.6427 0.5908 -0.0427 0.0382 0.0230 227 GLN B NE2 4901 N N . ARG B 229 ? 0.5891 0.4704 0.4321 -0.0672 0.0360 0.0156 228 ARG B N 4902 C CA . ARG B 229 ? 0.5942 0.4712 0.4332 -0.0692 0.0326 0.0151 228 ARG B CA 4903 C C . ARG B 229 ? 0.6036 0.4706 0.4316 -0.0723 0.0320 0.0138 228 ARG B C 4904 O O . ARG B 229 ? 0.6121 0.4732 0.4325 -0.0746 0.0307 0.0140 228 ARG B O 4905 C CB . ARG B 229 ? 0.5892 0.4672 0.4338 -0.0682 0.0288 0.0161 228 ARG B CB 4906 C CG . ARG B 229 ? 0.5904 0.4784 0.4432 -0.0658 0.0303 0.0171 228 ARG B CG 4907 C CD . ARG B 229 ? 0.6034 0.4963 0.4642 -0.0656 0.0280 0.0174 228 ARG B CD 4908 N NE . ARG B 229 ? 0.6128 0.5162 0.4798 -0.0633 0.0308 0.0176 228 ARG B NE 4909 C CZ . ARG B 229 ? 0.6222 0.5350 0.4987 -0.0629 0.0309 0.0171 228 ARG B CZ 4910 N NH1 . ARG B 229 ? 0.6140 0.5279 0.4967 -0.0647 0.0269 0.0163 228 ARG B NH1 4911 N NH2 . ARG B 229 ? 0.6389 0.5619 0.5189 -0.0607 0.0350 0.0168 228 ARG B NH2 4912 N N . SER B 230 ? 0.5961 0.4589 0.4209 -0.0726 0.0327 0.0126 229 SER B N 4913 C CA . SER B 230 ? 0.6158 0.4684 0.4272 -0.0756 0.0320 0.0110 229 SER B CA 4914 C C . SER B 230 ? 0.6301 0.4835 0.4341 -0.0783 0.0383 0.0096 229 SER B C 4915 O O . SER B 230 ? 0.6438 0.4883 0.4335 -0.0823 0.0387 0.0095 229 SER B O 4916 C CB . SER B 230 ? 0.6264 0.4734 0.4355 -0.0752 0.0310 0.0086 229 SER B CB 4917 O OG . SER B 230 ? 0.6435 0.4935 0.4558 -0.0726 0.0368 0.0064 229 SER B OG 4918 N N . ALA B 231 ? 0.6142 0.4793 0.4281 -0.0767 0.0431 0.0088 230 ALA B N 4919 C CA . ALA B 231 ? 0.6142 0.4859 0.4266 -0.0800 0.0496 0.0067 230 ALA B CA 4920 C C . ALA B 231 ? 0.6366 0.5065 0.4455 -0.0856 0.0489 0.0087 230 ALA B C 4921 O O . ALA B 231 ? 0.6561 0.5314 0.4734 -0.0843 0.0465 0.0095 230 ALA B O 4922 C CB . ALA B 231 ? 0.5906 0.4776 0.4168 -0.0753 0.0531 0.0046 230 ALA B CB 4923 N N . VAL B 232 ? 0.6477 0.5085 0.4425 -0.0922 0.0515 0.0093 231 VAL B N 4924 C CA . VAL B 232 ? 0.6443 0.4983 0.4327 -0.0989 0.0512 0.0115 231 VAL B CA 4925 C C . VAL B 232 ? 0.6458 0.5155 0.4477 -0.1017 0.0549 0.0091 231 VAL B C 4926 O O . VAL B 232 ? 0.6665 0.5322 0.4691 -0.1043 0.0518 0.0099 231 VAL B O 4927 C CB . VAL B 232 ? 0.6653 0.5058 0.4335 -0.1072 0.0550 0.0134 231 VAL B CB 4928 C CG1 . VAL B 232 ? 0.6781 0.5058 0.4373 -0.1147 0.0537 0.0167 231 VAL B CG1 4929 C CG2 . VAL B 232 ? 0.6833 0.5087 0.4365 -0.1041 0.0495 0.0153 231 VAL B CG2 4930 N N . SER B 233 ? 0.6404 0.5280 0.4533 -0.1004 0.0607 0.0054 232 SER B N 4931 C CA . SER B 233 ? 0.6289 0.5351 0.4562 -0.1029 0.0632 0.0023 232 SER B CA 4932 C C . SER B 233 ? 0.6009 0.5108 0.4373 -0.0974 0.0564 0.0027 232 SER B C 4933 O O . SER B 233 ? 0.6038 0.5220 0.4465 -0.1015 0.0557 0.0007 232 SER B O 4934 C CB . SER B 233 ? 0.6254 0.5519 0.4651 -0.0988 0.0690 -0.0020 232 SER B CB 4935 O OG . SER B 233 ? 0.6208 0.5448 0.4622 -0.0882 0.0664 -0.0018 232 SER B OG 4936 N N . THR B 234 ? 0.6034 0.5074 0.4396 -0.0892 0.0517 0.0050 233 THR B N 4937 C CA . THR B 234 ? 0.6076 0.5147 0.4497 -0.0845 0.0466 0.0056 233 THR B CA 4938 C C . THR B 234 ? 0.6291 0.5253 0.4646 -0.0888 0.0433 0.0057 233 THR B C 4939 O O . THR B 234 ? 0.6329 0.5354 0.4726 -0.0902 0.0418 0.0033 233 THR B O 4940 C CB . THR B 234 ? 0.6013 0.5041 0.4441 -0.0769 0.0435 0.0083 233 THR B CB 4941 O OG1 . THR B 234 ? 0.5926 0.4999 0.4391 -0.0727 0.0459 0.0081 233 THR B OG1 4942 C CG2 . THR B 234 ? 0.5929 0.5016 0.4408 -0.0726 0.0403 0.0090 233 THR B CG2 4943 N N . SER B 235 ? 0.6364 0.5151 0.4607 -0.0905 0.0415 0.0080 234 SER B N 4944 C CA . SER B 235 ? 0.6457 0.5098 0.4622 -0.0929 0.0377 0.0081 234 SER B CA 4945 C C . SER B 235 ? 0.6464 0.5072 0.4585 -0.1033 0.0405 0.0064 234 SER B C 4946 O O . SER B 235 ? 0.6628 0.5159 0.4724 -0.1056 0.0376 0.0044 234 SER B O 4947 C CB . SER B 235 ? 0.6863 0.5321 0.4912 -0.0909 0.0339 0.0114 234 SER B CB 4948 O OG . SER B 235 ? 0.7097 0.5602 0.5212 -0.0826 0.0305 0.0120 234 SER B OG 4949 N N . TRP B 236 ? 0.6448 0.5110 0.4559 -0.1102 0.0465 0.0066 235 TRP B N 4950 C CA . TRP B 236 ? 0.6724 0.5399 0.4821 -0.1226 0.0509 0.0048 235 TRP B CA 4951 C C . TRP B 236 ? 0.6800 0.5648 0.5038 -0.1239 0.0496 -0.0003 235 TRP B C 4952 O O . TRP B 236 ? 0.6948 0.5758 0.5169 -0.1341 0.0499 -0.0026 235 TRP B O 4953 C CB . TRP B 236 ? 0.6878 0.5667 0.4986 -0.1279 0.0593 0.0046 235 TRP B CB 4954 C CG . TRP B 236 ? 0.7116 0.5954 0.5223 -0.1425 0.0660 0.0029 235 TRP B CG 4955 C CD1 . TRP B 236 ? 0.7302 0.5949 0.5286 -0.1541 0.0658 0.0047 235 TRP B CD1 4956 C CD2 . TRP B 236 ? 0.7115 0.6210 0.5354 -0.1476 0.0745 -0.0010 235 TRP B CD2 4957 N NE1 . TRP B 236 ? 0.7267 0.6041 0.5300 -0.1682 0.0741 0.0024 235 TRP B NE1 4958 C CE2 . TRP B 236 ? 0.7144 0.6217 0.5347 -0.1642 0.0798 -0.0015 235 TRP B CE2 4959 C CE3 . TRP B 236 ? 0.6960 0.6300 0.5351 -0.1396 0.0780 -0.0046 235 TRP B CE3 4960 C CZ2 . TRP B 236 ? 0.7219 0.6551 0.5555 -0.1735 0.0893 -0.0058 235 TRP B CZ2 4961 C CZ3 . TRP B 236 ? 0.7100 0.6688 0.5622 -0.1465 0.0867 -0.0094 235 TRP B CZ3 4962 C CH2 . TRP B 236 ? 0.7206 0.6809 0.5710 -0.1638 0.0926 -0.0101 235 TRP B CH2 4963 N N . LEU B 237 ? 0.6755 0.5782 0.5119 -0.1143 0.0476 -0.0020 236 LEU B N 4964 C CA . LEU B 237 ? 0.6798 0.6002 0.5280 -0.1144 0.0451 -0.0067 236 LEU B CA 4965 C C . LEU B 237 ? 0.6581 0.5720 0.5032 -0.1089 0.0387 -0.0082 236 LEU B C 4966 O O . LEU B 237 ? 0.6204 0.5492 0.4730 -0.1072 0.0356 -0.0120 236 LEU B O 4967 C CB . LEU B 237 ? 0.7064 0.6509 0.5688 -0.1072 0.0464 -0.0078 236 LEU B CB 4968 C CG . LEU B 237 ? 0.7445 0.7044 0.6153 -0.1121 0.0534 -0.0096 236 LEU B CG 4969 C CD1 . LEU B 237 ? 0.7502 0.7348 0.6371 -0.1029 0.0521 -0.0121 236 LEU B CD1 4970 C CD2 . LEU B 237 ? 0.7565 0.7203 0.6288 -0.1272 0.0571 -0.0129 236 LEU B CD2 4971 N N . LEU B 238 ? 0.6544 0.5472 0.4883 -0.1058 0.0363 -0.0059 237 LEU B N 4972 C CA . LEU B 238 ? 0.6514 0.5371 0.4815 -0.1013 0.0315 -0.0089 237 LEU B CA 4973 C C . LEU B 238 ? 0.6632 0.5452 0.4911 -0.1110 0.0298 -0.0145 237 LEU B C 4974 O O . LEU B 238 ? 0.6701 0.5445 0.4947 -0.1222 0.0323 -0.0143 237 LEU B O 4975 C CB . LEU B 238 ? 0.6723 0.5367 0.4926 -0.0962 0.0293 -0.0065 237 LEU B CB 4976 C CG . LEU B 238 ? 0.6710 0.5403 0.4949 -0.0862 0.0294 -0.0027 237 LEU B CG 4977 C CD1 . LEU B 238 ? 0.6807 0.5312 0.4967 -0.0829 0.0266 -0.0001 237 LEU B CD1 4978 C CD2 . LEU B 238 ? 0.6604 0.5417 0.4896 -0.0786 0.0284 -0.0048 237 LEU B CD2 4979 N N . PRO B 239 ? 0.6612 0.5471 0.4891 -0.1077 0.0257 -0.0198 238 PRO B N 4980 C CA . PRO B 239 ? 0.6715 0.5519 0.4962 -0.1169 0.0229 -0.0266 238 PRO B CA 4981 C C . PRO B 239 ? 0.6949 0.5467 0.5076 -0.1256 0.0229 -0.0265 238 PRO B C 4982 O O . PRO B 239 ? 0.7072 0.5383 0.5103 -0.1193 0.0220 -0.0234 238 PRO B O 4983 C CB . PRO B 239 ? 0.6662 0.5469 0.4866 -0.1081 0.0186 -0.0317 238 PRO B CB 4984 C CG . PRO B 239 ? 0.6451 0.5447 0.4722 -0.0978 0.0199 -0.0275 238 PRO B CG 4985 C CD . PRO B 239 ? 0.6411 0.5379 0.4712 -0.0962 0.0241 -0.0199 238 PRO B CD 4986 N N . TYR B 240 ? 0.7190 0.5700 0.5325 -0.1402 0.0235 -0.0300 239 TYR B N 4987 C CA . TYR B 240 ? 0.7587 0.5798 0.5588 -0.1517 0.0236 -0.0296 239 TYR B CA 4988 C C . TYR B 240 ? 0.8064 0.6135 0.6000 -0.1567 0.0181 -0.0385 239 TYR B C 4989 O O . TYR B 240 ? 0.8171 0.6443 0.6193 -0.1577 0.0152 -0.0455 239 TYR B O 4990 C CB . TYR B 240 ? 0.7553 0.5843 0.5602 -0.1680 0.0298 -0.0270 239 TYR B CB 4991 C CG . TYR B 240 ? 0.7448 0.5779 0.5496 -0.1653 0.0359 -0.0188 239 TYR B CG 4992 C CD1 . TYR B 240 ? 0.7202 0.5833 0.5400 -0.1577 0.0387 -0.0179 239 TYR B CD1 4993 C CD2 . TYR B 240 ? 0.7479 0.5528 0.5356 -0.1702 0.0382 -0.0121 239 TYR B CD2 4994 C CE1 . TYR B 240 ? 0.7069 0.5723 0.5253 -0.1552 0.0442 -0.0117 239 TYR B CE1 4995 C CE2 . TYR B 240 ? 0.7397 0.5481 0.5249 -0.1678 0.0434 -0.0054 239 TYR B CE2 4996 C CZ . TYR B 240 ? 0.7121 0.5509 0.5130 -0.1605 0.0466 -0.0058 239 TYR B CZ 4997 O OH . TYR B 240 ? 0.7046 0.5451 0.5016 -0.1581 0.0515 -0.0006 239 TYR B OH 4998 N N . ASN B 241 ? 0.8705 0.6416 0.6475 -0.1598 0.0159 -0.0383 240 ASN B N 4999 C CA . ASN B 241 ? 0.9286 0.6797 0.6966 -0.1646 0.0105 -0.0476 240 ASN B CA 5000 C C . ASN B 241 ? 0.9383 0.6919 0.7094 -0.1858 0.0107 -0.0528 240 ASN B C 5001 O O . ASN B 241 ? 1.0041 0.7437 0.7688 -0.1910 0.0056 -0.0619 240 ASN B O 5002 C CB . ASN B 241 ? 1.0069 0.7147 0.7552 -0.1602 0.0075 -0.0454 240 ASN B CB 5003 C CG . ASN B 241 ? 1.0889 0.7745 0.8269 -0.1726 0.0111 -0.0361 240 ASN B CG 5004 O OD1 . ASN B 241 ? 1.1259 0.8256 0.8703 -0.1890 0.0165 -0.0337 240 ASN B OD1 5005 N ND2 . ASN B 241 ? 1.1783 0.8299 0.8997 -0.1647 0.0080 -0.0309 240 ASN B ND2 5006 N N . TYR B 242 ? 0.9327 0.7058 0.7147 -0.1983 0.0167 -0.0482 241 TYR B N 5007 C CA . TYR B 242 ? 0.9410 0.7251 0.7314 -0.2191 0.0174 -0.0543 241 TYR B CA 5008 C C . TYR B 242 ? 0.9402 0.7658 0.7506 -0.2169 0.0137 -0.0624 241 TYR B C 5009 O O . TYR B 242 ? 0.9666 0.8051 0.7860 -0.2324 0.0117 -0.0698 241 TYR B O 5010 C CB . TYR B 242 ? 0.9426 0.7299 0.7360 -0.2359 0.0265 -0.0469 241 TYR B CB 5011 C CG . TYR B 242 ? 0.9043 0.7228 0.7114 -0.2288 0.0335 -0.0403 241 TYR B CG 5012 C CD1 . TYR B 242 ? 0.8870 0.7504 0.7185 -0.2289 0.0349 -0.0447 241 TYR B CD1 5013 C CD2 . TYR B 242 ? 0.8930 0.6952 0.6880 -0.2222 0.0382 -0.0302 241 TYR B CD2 5014 C CE1 . TYR B 242 ? 0.8536 0.7426 0.6968 -0.2216 0.0412 -0.0395 241 TYR B CE1 5015 C CE2 . TYR B 242 ? 0.8634 0.6917 0.6693 -0.2162 0.0446 -0.0254 241 TYR B CE2 5016 C CZ . TYR B 242 ? 0.8392 0.7099 0.6691 -0.2158 0.0465 -0.0302 241 TYR B CZ 5017 O OH . TYR B 242 ? 0.8304 0.7246 0.6705 -0.2087 0.0527 -0.0264 241 TYR B OH 5018 N N . THR B 243 ? 0.9016 0.7469 0.7180 -0.1979 0.0122 -0.0608 242 THR B N 5019 C CA . THR B 243 ? 0.8802 0.7605 0.7109 -0.1923 0.0075 -0.0668 242 THR B CA 5020 C C . THR B 243 ? 0.8905 0.7621 0.7098 -0.1778 0.0009 -0.0720 242 THR B C 5021 O O . THR B 243 ? 0.9024 0.7876 0.7237 -0.1788 -0.0058 -0.0809 242 THR B O 5022 C CB . THR B 243 ? 0.8552 0.7670 0.7016 -0.1827 0.0118 -0.0599 242 THR B CB 5023 O OG1 . THR B 243 ? 0.8559 0.7801 0.7140 -0.1962 0.0188 -0.0570 242 THR B OG1 5024 C CG2 . THR B 243 ? 0.8440 0.7891 0.7028 -0.1745 0.0055 -0.0647 242 THR B CG2 5025 N N . TRP B 244 ? 0.8665 0.7177 0.6740 -0.1641 0.0028 -0.0670 243 TRP B N 5026 C CA . TRP B 244 ? 0.8560 0.7033 0.6543 -0.1489 -0.0007 -0.0711 243 TRP B CA 5027 C C . TRP B 244 ? 0.8693 0.6789 0.6498 -0.1474 -0.0028 -0.0762 243 TRP B C 5028 O O . TRP B 244 ? 0.8580 0.6412 0.6318 -0.1534 -0.0009 -0.0723 243 TRP B O 5029 C CB . TRP B 244 ? 0.8335 0.6909 0.6351 -0.1328 0.0033 -0.0624 243 TRP B CB 5030 C CG . TRP B 244 ? 0.7960 0.6851 0.6132 -0.1312 0.0056 -0.0564 243 TRP B CG 5031 C CD1 . TRP B 244 ? 0.7840 0.6809 0.6112 -0.1363 0.0106 -0.0494 243 TRP B CD1 5032 C CD2 . TRP B 244 ? 0.7705 0.6850 0.5930 -0.1227 0.0028 -0.0569 243 TRP B CD2 5033 N NE1 . TRP B 244 ? 0.7458 0.6717 0.5858 -0.1305 0.0110 -0.0465 243 TRP B NE1 5034 C CE2 . TRP B 244 ? 0.7479 0.6839 0.5849 -0.1222 0.0057 -0.0503 243 TRP B CE2 5035 C CE3 . TRP B 244 ? 0.7788 0.6988 0.5932 -0.1152 -0.0017 -0.0623 243 TRP B CE3 5036 C CZ2 . TRP B 244 ? 0.7583 0.7184 0.6020 -0.1138 0.0032 -0.0484 243 TRP B CZ2 5037 C CZ3 . TRP B 244 ? 0.7883 0.7327 0.6077 -0.1080 -0.0039 -0.0596 243 TRP B CZ3 5038 C CH2 . TRP B 244 ? 0.7851 0.7484 0.6193 -0.1070 -0.0020 -0.0524 243 TRP B CH2 5039 N N . SER B 245 ? 0.8927 0.6994 0.6643 -0.1384 -0.0067 -0.0848 244 SER B N 5040 C CA . SER B 245 ? 0.9287 0.7014 0.6839 -0.1332 -0.0088 -0.0915 244 SER B CA 5041 C C . SER B 245 ? 0.9640 0.7242 0.7168 -0.1183 -0.0048 -0.0840 244 SER B C 5042 O O . SER B 245 ? 0.9036 0.6852 0.6639 -0.1069 -0.0013 -0.0784 244 SER B O 5043 C CB . SER B 245 ? 0.9267 0.7045 0.6731 -0.1260 -0.0129 -0.1035 244 SER B CB 5044 O OG . SER B 245 ? 0.9341 0.6807 0.6654 -0.1173 -0.0139 -0.1109 244 SER B OG 5045 N N . PRO B 246 ? 1.0368 0.7613 0.7786 -0.1179 -0.0061 -0.0841 245 PRO B N 5046 C CA . PRO B 246 ? 1.0409 0.7551 0.7813 -0.1024 -0.0042 -0.0782 245 PRO B CA 5047 C C . PRO B 246 ? 1.0097 0.7331 0.7495 -0.0844 -0.0035 -0.0850 245 PRO B C 5048 O O . PRO B 246 ? 0.9976 0.7247 0.7421 -0.0712 -0.0011 -0.0803 245 PRO B O 5049 C CB . PRO B 246 ? 1.0973 0.7679 0.8232 -0.1060 -0.0079 -0.0785 245 PRO B CB 5050 C CG . PRO B 246 ? 1.1156 0.7789 0.8390 -0.1282 -0.0087 -0.0786 245 PRO B CG 5051 C CD . PRO B 246 ? 1.0949 0.7870 0.8259 -0.1331 -0.0095 -0.0874 245 PRO B CD 5052 N N . GLU B 247 ? 1.0093 0.7384 0.7434 -0.0843 -0.0052 -0.0963 246 GLU B N 5053 C CA . GLU B 247 ? 1.0192 0.7603 0.7512 -0.0685 -0.0027 -0.1031 246 GLU B CA 5054 C C . GLU B 247 ? 0.9363 0.7159 0.6767 -0.0661 0.0014 -0.0993 246 GLU B C 5055 O O . GLU B 247 ? 0.9314 0.7229 0.6697 -0.0542 0.0051 -0.1031 246 GLU B O 5056 C CB . GLU B 247 ? 1.1064 0.8291 0.8228 -0.0680 -0.0066 -0.1190 246 GLU B CB 5057 C CG . GLU B 247 ? 1.2203 0.8995 0.9245 -0.0707 -0.0117 -0.1249 246 GLU B CG 5058 C CD . GLU B 247 ? 1.3322 0.9951 1.0235 -0.0839 -0.0175 -0.1374 246 GLU B CD 5059 O OE1 . GLU B 247 ? 1.3885 1.0377 1.0790 -0.1021 -0.0210 -0.1348 246 GLU B OE1 5060 O OE2 . GLU B 247 ? 1.3607 1.0250 1.0421 -0.0768 -0.0183 -0.1505 246 GLU B OE2 5061 N N . LYS B 248 ? 0.8742 0.6719 0.6233 -0.0768 0.0009 -0.0918 247 LYS B N 5062 C CA . LYS B 248 ? 0.8278 0.6573 0.5830 -0.0738 0.0036 -0.0872 247 LYS B CA 5063 C C . LYS B 248 ? 0.7876 0.6280 0.5512 -0.0627 0.0100 -0.0780 247 LYS B C 5064 O O . LYS B 248 ? 0.7756 0.6106 0.5474 -0.0635 0.0112 -0.0700 247 LYS B O 5065 C CB . LYS B 248 ? 0.8196 0.6641 0.5843 -0.0866 0.0011 -0.0815 247 LYS B CB 5066 C CG . LYS B 248 ? 0.8164 0.6896 0.5902 -0.0831 0.0035 -0.0728 247 LYS B CG 5067 C CD . LYS B 248 ? 0.8370 0.7274 0.6042 -0.0824 -0.0003 -0.0781 247 LYS B CD 5068 C CE . LYS B 248 ? 0.8426 0.7571 0.6166 -0.0779 0.0012 -0.0684 247 LYS B CE 5069 N NZ . LYS B 248 ? 0.8799 0.8066 0.6411 -0.0730 -0.0014 -0.0722 247 LYS B NZ 5070 N N . VAL B 249 ? 0.7529 0.6091 0.5136 -0.0536 0.0141 -0.0794 248 VAL B N 5071 C CA . VAL B 249 ? 0.7152 0.5849 0.4849 -0.0453 0.0205 -0.0711 248 VAL B CA 5072 C C . VAL B 249 ? 0.7028 0.5924 0.4795 -0.0499 0.0214 -0.0606 248 VAL B C 5073 O O . VAL B 249 ? 0.7102 0.6126 0.4807 -0.0514 0.0202 -0.0614 248 VAL B O 5074 C CB . VAL B 249 ? 0.7333 0.6118 0.4963 -0.0347 0.0262 -0.0771 248 VAL B CB 5075 C CG1 . VAL B 249 ? 0.7232 0.6178 0.4974 -0.0288 0.0334 -0.0683 248 VAL B CG1 5076 C CG2 . VAL B 249 ? 0.7484 0.6069 0.5044 -0.0278 0.0253 -0.0893 248 VAL B CG2 5077 N N . PHE B 250 ? 0.6812 0.5718 0.4697 -0.0515 0.0227 -0.0512 249 PHE B N 5078 C CA . PHE B 250 ? 0.6570 0.5634 0.4528 -0.0545 0.0237 -0.0415 249 PHE B CA 5079 C C . PHE B 250 ? 0.6328 0.5513 0.4316 -0.0478 0.0297 -0.0352 249 PHE B C 5080 O O . PHE B 250 ? 0.6086 0.5394 0.4074 -0.0484 0.0306 -0.0290 249 PHE B O 5081 C CB . PHE B 250 ? 0.6574 0.5575 0.4626 -0.0605 0.0224 -0.0357 249 PHE B CB 5082 C CG . PHE B 250 ? 0.6712 0.5645 0.4751 -0.0703 0.0178 -0.0397 249 PHE B CG 5083 C CD1 . PHE B 250 ? 0.6667 0.5753 0.4736 -0.0756 0.0151 -0.0396 249 PHE B CD1 5084 C CD2 . PHE B 250 ? 0.6945 0.5664 0.4946 -0.0745 0.0160 -0.0434 249 PHE B CD2 5085 C CE1 . PHE B 250 ? 0.6744 0.5806 0.4832 -0.0862 0.0114 -0.0440 249 PHE B CE1 5086 C CE2 . PHE B 250 ? 0.7029 0.5682 0.5018 -0.0860 0.0128 -0.0467 249 PHE B CE2 5087 C CZ . PHE B 250 ? 0.6867 0.5711 0.4913 -0.0925 0.0109 -0.0474 249 PHE B CZ 5088 N N . VAL B 251 ? 0.6324 0.5471 0.4348 -0.0418 0.0335 -0.0366 250 VAL B N 5089 C CA . VAL B 251 ? 0.6166 0.5440 0.4243 -0.0374 0.0400 -0.0313 250 VAL B CA 5090 C C . VAL B 251 ? 0.6367 0.5667 0.4419 -0.0297 0.0447 -0.0392 250 VAL B C 5091 O O . VAL B 251 ? 0.6258 0.5450 0.4335 -0.0250 0.0429 -0.0458 250 VAL B O 5092 C CB . VAL B 251 ? 0.6062 0.5322 0.4272 -0.0381 0.0403 -0.0243 250 VAL B CB 5093 C CG1 . VAL B 251 ? 0.6096 0.5493 0.4375 -0.0349 0.0471 -0.0204 250 VAL B CG1 5094 C CG2 . VAL B 251 ? 0.6073 0.5322 0.4308 -0.0446 0.0373 -0.0171 250 VAL B CG2 5095 N N . GLN B 252 ? 0.6619 0.6059 0.4611 -0.0279 0.0510 -0.0385 251 GLN B N 5096 C CA . GLN B 252 ? 0.6912 0.6429 0.4888 -0.0207 0.0580 -0.0459 251 GLN B CA 5097 C C . GLN B 252 ? 0.6819 0.6509 0.4891 -0.0209 0.0666 -0.0385 251 GLN B C 5098 O O . GLN B 252 ? 0.6893 0.6636 0.4937 -0.0266 0.0683 -0.0288 251 GLN B O 5099 C CB . GLN B 252 ? 0.7185 0.6717 0.4965 -0.0200 0.0591 -0.0525 251 GLN B CB 5100 C CG . GLN B 252 ? 0.7759 0.7339 0.5488 -0.0116 0.0659 -0.0640 251 GLN B CG 5101 C CD . GLN B 252 ? 0.7976 0.7548 0.5474 -0.0114 0.0659 -0.0717 251 GLN B CD 5102 O OE1 . GLN B 252 ? 0.7765 0.7277 0.5155 -0.0174 0.0583 -0.0699 251 GLN B OE1 5103 N NE2 . GLN B 252 ? 0.8173 0.7818 0.5597 -0.0043 0.0741 -0.0811 251 GLN B NE2 5104 N N . THR B 253 ? 0.6822 0.6597 0.5008 -0.0144 0.0719 -0.0438 252 THR B N 5105 C CA . THR B 253 ? 0.6791 0.6763 0.5092 -0.0154 0.0812 -0.0390 252 THR B CA 5106 C C . THR B 253 ? 0.7025 0.7135 0.5313 -0.0076 0.0904 -0.0496 252 THR B C 5107 O O . THR B 253 ? 0.7284 0.7299 0.5476 -0.0007 0.0878 -0.0606 252 THR B O 5108 C CB . THR B 253 ? 0.6702 0.6693 0.5223 -0.0148 0.0779 -0.0360 252 THR B CB 5109 O OG1 . THR B 253 ? 0.6670 0.6651 0.5287 -0.0043 0.0757 -0.0464 252 THR B OG1 5110 C CG2 . THR B 253 ? 0.6615 0.6433 0.5129 -0.0203 0.0681 -0.0290 252 THR B CG2 5111 N N . PRO B 254 ? 0.7189 0.7521 0.5574 -0.0090 0.1015 -0.0473 253 PRO B N 5112 C CA . PRO B 254 ? 0.7389 0.7883 0.5771 -0.0009 0.1119 -0.0588 253 PRO B CA 5113 C C . PRO B 254 ? 0.7495 0.7978 0.6028 0.0122 0.1081 -0.0716 253 PRO B C 5114 O O . PRO B 254 ? 0.7807 0.8351 0.6290 0.0214 0.1140 -0.0838 253 PRO B O 5115 C CB . PRO B 254 ? 0.7263 0.8013 0.5758 -0.0076 0.1248 -0.0523 253 PRO B CB 5116 C CG . PRO B 254 ? 0.7100 0.7760 0.5553 -0.0200 0.1210 -0.0368 253 PRO B CG 5117 C CD . PRO B 254 ? 0.7015 0.7463 0.5511 -0.0183 0.1061 -0.0356 253 PRO B CD 5118 N N . THR B 255 ? 0.7701 0.8094 0.6395 0.0140 0.0980 -0.0689 254 THR B N 5119 C CA . THR B 255 ? 0.7922 0.8297 0.6763 0.0276 0.0932 -0.0793 254 THR B CA 5120 C C . THR B 255 ? 0.8078 0.8131 0.6839 0.0314 0.0791 -0.0813 254 THR B C 5121 O O . THR B 255 ? 0.8645 0.8623 0.7477 0.0438 0.0741 -0.0900 254 THR B O 5122 C CB . THR B 255 ? 0.7762 0.8335 0.6890 0.0287 0.0930 -0.0759 254 THR B CB 5123 O OG1 . THR B 255 ? 0.7542 0.7977 0.6691 0.0199 0.0833 -0.0645 254 THR B OG1 5124 C CG2 . THR B 255 ? 0.7846 0.8751 0.7087 0.0225 0.1076 -0.0736 254 THR B CG2 5125 N N . ILE B 256 ? 0.7848 0.7714 0.6468 0.0212 0.0728 -0.0732 255 ILE B N 5126 C CA . ILE B 256 ? 0.7615 0.7188 0.6171 0.0221 0.0605 -0.0736 255 ILE B CA 5127 C C . ILE B 256 ? 0.7300 0.6727 0.5682 0.0101 0.0568 -0.0674 255 ILE B C 5128 O O . ILE B 256 ? 0.6938 0.6481 0.5295 0.0013 0.0609 -0.0592 255 ILE B O 5129 C CB . ILE B 256 ? 0.7732 0.7279 0.6455 0.0233 0.0532 -0.0672 255 ILE B CB 5130 C CG1 . ILE B 256 ? 0.7790 0.7022 0.6415 0.0215 0.0415 -0.0648 255 ILE B CG1 5131 C CG2 . ILE B 256 ? 0.7673 0.7379 0.6488 0.0125 0.0562 -0.0554 255 ILE B CG2 5132 C CD1 . ILE B 256 ? 0.7600 0.6789 0.6348 0.0243 0.0338 -0.0596 255 ILE B CD1 5133 N N . ASN B 257 ? 0.7469 0.6645 0.5733 0.0097 0.0489 -0.0716 256 ASN B N 5134 C CA . ASN B 257 ? 0.7487 0.6557 0.5649 -0.0022 0.0442 -0.0650 256 ASN B CA 5135 C C . ASN B 257 ? 0.7052 0.5891 0.5209 -0.0065 0.0352 -0.0614 256 ASN B C 5136 O O . ASN B 257 ? 0.7262 0.5944 0.5441 0.0002 0.0306 -0.0647 256 ASN B O 5137 C CB . ASN B 257 ? 0.7986 0.7040 0.5972 -0.0062 0.0450 -0.0707 256 ASN B CB 5138 C CG . ASN B 257 ? 0.8628 0.7620 0.6518 0.0027 0.0468 -0.0849 256 ASN B CG 5139 O OD1 . ASN B 257 ? 0.9432 0.8587 0.7268 0.0065 0.0546 -0.0893 256 ASN B OD1 5140 N ND2 . ASN B 257 ? 0.9197 0.7933 0.7032 0.0053 0.0398 -0.0922 256 ASN B ND2 5141 N N . TYR B 258 ? 0.6668 0.5496 0.4794 -0.0175 0.0331 -0.0539 257 TYR B N 5142 C CA . TYR B 258 ? 0.6555 0.5206 0.4674 -0.0243 0.0268 -0.0487 257 TYR B CA 5143 C C . TYR B 258 ? 0.6470 0.5018 0.4480 -0.0342 0.0235 -0.0508 257 TYR B C 5144 O O . TYR B 258 ? 0.6283 0.4970 0.4278 -0.0399 0.0251 -0.0489 257 TYR B O 5145 C CB . TYR B 258 ? 0.6320 0.5089 0.4540 -0.0287 0.0282 -0.0378 257 TYR B CB 5146 C CG . TYR B 258 ? 0.6254 0.5158 0.4601 -0.0212 0.0311 -0.0359 257 TYR B CG 5147 C CD1 . TYR B 258 ? 0.6245 0.5058 0.4654 -0.0160 0.0264 -0.0350 257 TYR B CD1 5148 C CD2 . TYR B 258 ? 0.6117 0.5246 0.4521 -0.0197 0.0384 -0.0350 257 TYR B CD2 5149 C CE1 . TYR B 258 ? 0.6148 0.5122 0.4703 -0.0096 0.0282 -0.0342 257 TYR B CE1 5150 C CE2 . TYR B 258 ? 0.6045 0.5323 0.4589 -0.0148 0.0418 -0.0338 257 TYR B CE2 5151 C CZ . TYR B 258 ? 0.6112 0.5329 0.4747 -0.0097 0.0363 -0.0339 257 TYR B CZ 5152 O OH . TYR B 258 ? 0.6113 0.5512 0.4914 -0.0053 0.0387 -0.0336 257 TYR B OH 5153 N N . THR B 259 ? 0.6597 0.4892 0.4533 -0.0363 0.0182 -0.0545 258 THR B N 5154 C CA . THR B 259 ? 0.6682 0.4847 0.4537 -0.0487 0.0145 -0.0556 258 THR B CA 5155 C C . THR B 259 ? 0.6602 0.4672 0.4482 -0.0565 0.0128 -0.0465 258 THR B C 5156 O O . THR B 259 ? 0.6560 0.4642 0.4498 -0.0515 0.0133 -0.0402 258 THR B O 5157 C CB . THR B 259 ? 0.6879 0.4774 0.4608 -0.0480 0.0101 -0.0658 258 THR B CB 5158 O OG1 . THR B 259 ? 0.6920 0.4566 0.4622 -0.0442 0.0066 -0.0632 258 THR B OG1 5159 C CG2 . THR B 259 ? 0.6848 0.4795 0.4534 -0.0369 0.0122 -0.0765 258 THR B CG2 5160 N N . LEU B 260 ? 0.6779 0.4755 0.4609 -0.0693 0.0109 -0.0464 259 LEU B N 5161 C CA . LEU B 260 ? 0.6743 0.4624 0.4572 -0.0779 0.0108 -0.0382 259 LEU B CA 5162 C C . LEU B 260 ? 0.6840 0.4414 0.4571 -0.0742 0.0070 -0.0364 259 LEU B C 5163 O O . LEU B 260 ? 0.6988 0.4463 0.4686 -0.0794 0.0068 -0.0285 259 LEU B O 5164 C CB . LEU B 260 ? 0.6907 0.4804 0.4727 -0.0938 0.0111 -0.0389 259 LEU B CB 5165 C CG . LEU B 260 ? 0.7254 0.4931 0.4966 -0.1025 0.0075 -0.0466 259 LEU B CG 5166 C CD1 . LEU B 260 ? 0.7552 0.4897 0.5145 -0.1094 0.0059 -0.0424 259 LEU B CD1 5167 C CD2 . LEU B 260 ? 0.7267 0.5133 0.5043 -0.1155 0.0079 -0.0500 259 LEU B CD2 5168 N N . ARG B 261 ? 0.6781 0.4196 0.4451 -0.0646 0.0036 -0.0436 260 ARG B N 5169 C CA . ARG B 261 ? 0.6945 0.4072 0.4529 -0.0571 -0.0014 -0.0418 260 ARG B CA 5170 C C . ARG B 261 ? 0.6892 0.4151 0.4579 -0.0420 -0.0018 -0.0391 260 ARG B C 5171 O O . ARG B 261 ? 0.7144 0.4207 0.4786 -0.0326 -0.0074 -0.0378 260 ARG B O 5172 C CB . ARG B 261 ? 0.7171 0.4026 0.4638 -0.0525 -0.0057 -0.0519 260 ARG B CB 5173 C CG . ARG B 261 ? 0.7386 0.4079 0.4746 -0.0692 -0.0063 -0.0554 260 ARG B CG 5174 C CD . ARG B 261 ? 0.7707 0.3982 0.4897 -0.0674 -0.0123 -0.0618 260 ARG B CD 5175 N NE . ARG B 261 ? 0.7851 0.4132 0.5041 -0.0528 -0.0134 -0.0742 260 ARG B NE 5176 C CZ . ARG B 261 ? 0.8184 0.4129 0.5252 -0.0435 -0.0187 -0.0818 260 ARG B CZ 5177 N NH1 . ARG B 261 ? 0.8543 0.4081 0.5460 -0.0474 -0.0244 -0.0771 260 ARG B NH1 5178 N NH2 . ARG B 261 ? 0.8225 0.4229 0.5306 -0.0295 -0.0181 -0.0943 260 ARG B NH2 5179 N N . ASP B 262 ? 0.6560 0.4145 0.4388 -0.0399 0.0033 -0.0378 261 ASP B N 5180 C CA . ASP B 262 ? 0.6468 0.4224 0.4421 -0.0273 0.0038 -0.0365 261 ASP B CA 5181 C C . ASP B 262 ? 0.6278 0.4208 0.4319 -0.0318 0.0059 -0.0273 261 ASP B C 5182 O O . ASP B 262 ? 0.6053 0.4198 0.4224 -0.0253 0.0083 -0.0265 261 ASP B O 5183 C CB . ASP B 262 ? 0.6313 0.4293 0.4349 -0.0196 0.0090 -0.0443 261 ASP B CB 5184 C CG . ASP B 262 ? 0.6524 0.4342 0.4469 -0.0133 0.0073 -0.0555 261 ASP B CG 5185 O OD1 . ASP B 262 ? 0.6595 0.4195 0.4499 -0.0040 0.0018 -0.0585 261 ASP B OD1 5186 O OD2 . ASP B 262 ? 0.6680 0.4582 0.4585 -0.0167 0.0109 -0.0617 261 ASP B OD2 5187 N N . TYR B 263 ? 0.6373 0.4211 0.4343 -0.0432 0.0056 -0.0208 262 TYR B N 5188 C CA . TYR B 263 ? 0.6294 0.4285 0.4330 -0.0474 0.0080 -0.0135 262 TYR B CA 5189 C C . TYR B 263 ? 0.6355 0.4340 0.4434 -0.0392 0.0035 -0.0099 262 TYR B C 5190 O O . TYR B 263 ? 0.6273 0.4448 0.4457 -0.0386 0.0057 -0.0070 262 TYR B O 5191 C CB . TYR B 263 ? 0.6348 0.4260 0.4300 -0.0609 0.0098 -0.0084 262 TYR B CB 5192 C CG . TYR B 263 ? 0.6449 0.4465 0.4417 -0.0700 0.0142 -0.0115 262 TYR B CG 5193 C CD1 . TYR B 263 ? 0.6319 0.4561 0.4383 -0.0668 0.0173 -0.0149 262 TYR B CD1 5194 C CD2 . TYR B 263 ? 0.6710 0.4605 0.4593 -0.0823 0.0150 -0.0109 262 TYR B CD2 5195 C CE1 . TYR B 263 ? 0.6357 0.4700 0.4432 -0.0740 0.0193 -0.0178 262 TYR B CE1 5196 C CE2 . TYR B 263 ? 0.6652 0.4677 0.4577 -0.0906 0.0178 -0.0146 262 TYR B CE2 5197 C CZ . TYR B 263 ? 0.6556 0.4807 0.4578 -0.0856 0.0191 -0.0182 262 TYR B CZ 5198 O OH . TYR B 263 ? 0.6662 0.5052 0.4723 -0.0927 0.0201 -0.0220 262 TYR B OH 5199 N N . ARG B 264 ? 0.6705 0.4467 0.4701 -0.0329 -0.0035 -0.0100 263 ARG B N 5200 C CA . ARG B 264 ? 0.6874 0.4651 0.4919 -0.0240 -0.0097 -0.0072 263 ARG B CA 5201 C C . ARG B 264 ? 0.6603 0.4660 0.4854 -0.0141 -0.0076 -0.0121 263 ARG B C 5202 O O . ARG B 264 ? 0.6713 0.4941 0.5071 -0.0139 -0.0078 -0.0092 263 ARG B O 5203 C CB . ARG B 264 ? 0.7438 0.4915 0.5351 -0.0167 -0.0191 -0.0066 263 ARG B CB 5204 C CG . ARG B 264 ? 0.7809 0.5305 0.5753 -0.0093 -0.0271 -0.0024 263 ARG B CG 5205 C CD . ARG B 264 ? 0.8575 0.5757 0.6368 -0.0005 -0.0382 -0.0005 263 ARG B CD 5206 N NE . ARG B 264 ? 0.9100 0.6354 0.6948 0.0077 -0.0472 0.0026 263 ARG B NE 5207 C CZ . ARG B 264 ? 0.9881 0.6947 0.7660 0.0204 -0.0595 0.0037 263 ARG B CZ 5208 N NH1 . ARG B 264 ? 1.0477 0.7235 0.8116 0.0267 -0.0640 0.0022 263 ARG B NH1 5209 N NH2 . ARG B 264 ? 1.0098 0.7277 0.7945 0.0270 -0.0684 0.0061 263 ARG B NH2 5210 N N . LYS B 265 ? 0.6446 0.4553 0.4743 -0.0075 -0.0048 -0.0199 264 LYS B N 5211 C CA . LYS B 265 ? 0.6230 0.4625 0.4714 0.0002 0.0000 -0.0251 264 LYS B CA 5212 C C . LYS B 265 ? 0.5960 0.4591 0.4522 -0.0089 0.0079 -0.0213 264 LYS B C 5213 O O . LYS B 265 ? 0.5827 0.4678 0.4541 -0.0070 0.0102 -0.0207 264 LYS B O 5214 C CB . LYS B 265 ? 0.6244 0.4638 0.4714 0.0067 0.0036 -0.0346 264 LYS B CB 5215 C CG . LYS B 265 ? 0.6502 0.4710 0.4942 0.0202 -0.0033 -0.0410 264 LYS B CG 5216 C CD . LYS B 265 ? 0.6627 0.4944 0.5117 0.0296 0.0023 -0.0523 264 LYS B CD 5217 C CE . LYS B 265 ? 0.6526 0.4791 0.4885 0.0205 0.0081 -0.0556 264 LYS B CE 5218 N NZ . LYS B 265 ? 0.6704 0.4937 0.5034 0.0313 0.0103 -0.0682 264 LYS B NZ 5219 N N . PHE B 266 ? 0.5906 0.4491 0.4370 -0.0188 0.0119 -0.0193 265 PHE B N 5220 C CA . PHE B 266 ? 0.5911 0.4674 0.4420 -0.0265 0.0184 -0.0154 265 PHE B CA 5221 C C . PHE B 266 ? 0.5915 0.4734 0.4486 -0.0302 0.0169 -0.0089 265 PHE B C 5222 O O . PHE B 266 ? 0.5683 0.4684 0.4364 -0.0309 0.0207 -0.0072 265 PHE B O 5223 C CB . PHE B 266 ? 0.6044 0.4725 0.4440 -0.0354 0.0201 -0.0145 265 PHE B CB 5224 C CG . PHE B 266 ? 0.6121 0.4958 0.4550 -0.0416 0.0252 -0.0103 265 PHE B CG 5225 C CD1 . PHE B 266 ? 0.6211 0.5209 0.4674 -0.0396 0.0304 -0.0118 265 PHE B CD1 5226 C CD2 . PHE B 266 ? 0.6254 0.5062 0.4662 -0.0488 0.0250 -0.0048 265 PHE B CD2 5227 C CE1 . PHE B 266 ? 0.6243 0.5348 0.4714 -0.0442 0.0339 -0.0071 265 PHE B CE1 5228 C CE2 . PHE B 266 ? 0.6199 0.5130 0.4637 -0.0523 0.0288 -0.0014 265 PHE B CE2 5229 C CZ . PHE B 266 ? 0.6177 0.5244 0.4643 -0.0499 0.0327 -0.0020 265 PHE B CZ 5230 N N . PHE B 267 ? 0.6157 0.4803 0.4641 -0.0330 0.0114 -0.0054 266 PHE B N 5231 C CA . PHE B 267 ? 0.6080 0.4754 0.4590 -0.0365 0.0093 -0.0002 266 PHE B CA 5232 C C . PHE B 267 ? 0.6360 0.5147 0.5003 -0.0295 0.0049 -0.0015 266 PHE B C 5233 O O . PHE B 267 ? 0.6480 0.5392 0.5209 -0.0329 0.0059 0.0007 266 PHE B O 5234 C CB . PHE B 267 ? 0.6038 0.4495 0.4392 -0.0414 0.0049 0.0035 266 PHE B CB 5235 C CG . PHE B 267 ? 0.5902 0.4326 0.4175 -0.0510 0.0104 0.0055 266 PHE B CG 5236 C CD1 . PHE B 267 ? 0.5691 0.4243 0.4014 -0.0557 0.0152 0.0077 266 PHE B CD1 5237 C CD2 . PHE B 267 ? 0.5935 0.4200 0.4088 -0.0554 0.0105 0.0049 266 PHE B CD2 5238 C CE1 . PHE B 267 ? 0.5618 0.4170 0.3894 -0.0627 0.0198 0.0087 266 PHE B CE1 5239 C CE2 . PHE B 267 ? 0.5833 0.4115 0.3948 -0.0645 0.0156 0.0058 266 PHE B CE2 5240 C CZ . PHE B 267 ? 0.5650 0.4090 0.3835 -0.0673 0.0201 0.0075 266 PHE B CZ 5241 N N . GLN B 268 ? 0.6691 0.5442 0.5362 -0.0196 0.0000 -0.0057 267 GLN B N 5242 C CA . GLN B 268 ? 0.7066 0.5989 0.5911 -0.0119 -0.0038 -0.0085 267 GLN B CA 5243 C C . GLN B 268 ? 0.6821 0.6021 0.5835 -0.0138 0.0052 -0.0107 267 GLN B C 5244 O O . GLN B 268 ? 0.6748 0.6121 0.5902 -0.0161 0.0051 -0.0097 267 GLN B O 5245 C CB . GLN B 268 ? 0.7847 0.6703 0.6712 0.0015 -0.0101 -0.0140 267 GLN B CB 5246 C CG . GLN B 268 ? 0.8940 0.7563 0.7685 0.0059 -0.0222 -0.0109 267 GLN B CG 5247 C CD . GLN B 268 ? 0.9902 0.8388 0.8627 0.0203 -0.0291 -0.0159 267 GLN B CD 5248 O OE1 . GLN B 268 ? 1.1011 0.9186 0.9537 0.0215 -0.0357 -0.0130 267 GLN B OE1 5249 N NE2 . GLN B 268 ? 0.9901 0.8609 0.8826 0.0313 -0.0273 -0.0237 267 GLN B NE2 5250 N N . ASP B 269 ? 0.6613 0.5846 0.5597 -0.0138 0.0131 -0.0136 268 ASP B N 5251 C CA . ASP B 269 ? 0.6325 0.5803 0.5435 -0.0146 0.0223 -0.0157 268 ASP B CA 5252 C C . ASP B 269 ? 0.6359 0.5907 0.5466 -0.0261 0.0281 -0.0092 268 ASP B C 5253 O O . ASP B 269 ? 0.6391 0.6134 0.5614 -0.0287 0.0346 -0.0090 268 ASP B O 5254 C CB . ASP B 269 ? 0.6071 0.5550 0.5119 -0.0100 0.0281 -0.0215 268 ASP B CB 5255 C CG . ASP B 269 ? 0.6104 0.5546 0.5188 0.0031 0.0238 -0.0297 268 ASP B CG 5256 O OD1 . ASP B 269 ? 0.6149 0.5621 0.5344 0.0100 0.0167 -0.0308 268 ASP B OD1 5257 O OD2 . ASP B 269 ? 0.5929 0.5301 0.4924 0.0074 0.0265 -0.0355 268 ASP B OD2 5258 N N . ILE B 270 ? 0.6417 0.5805 0.5394 -0.0326 0.0263 -0.0041 269 ILE B N 5259 C CA . ILE B 270 ? 0.6466 0.5890 0.5442 -0.0413 0.0301 0.0014 269 ILE B CA 5260 C C . ILE B 270 ? 0.6544 0.5964 0.5582 -0.0450 0.0250 0.0039 269 ILE B C 5261 O O . ILE B 270 ? 0.6771 0.6195 0.5808 -0.0520 0.0274 0.0080 269 ILE B O 5262 C CB . ILE B 270 ? 0.6533 0.5831 0.5363 -0.0457 0.0317 0.0046 269 ILE B CB 5263 C CG1 . ILE B 270 ? 0.6706 0.5827 0.5442 -0.0469 0.0255 0.0054 269 ILE B CG1 5264 C CG2 . ILE B 270 ? 0.6651 0.5967 0.5418 -0.0431 0.0357 0.0015 269 ILE B CG2 5265 C CD1 . ILE B 270 ? 0.6780 0.5822 0.5409 -0.0514 0.0276 0.0073 269 ILE B CD1 5266 N N . GLY B 271 ? 0.6528 0.5917 0.5600 -0.0398 0.0169 0.0014 270 GLY B N 5267 C CA . GLY B 271 ? 0.6606 0.6002 0.5730 -0.0427 0.0103 0.0026 270 GLY B CA 5268 C C . GLY B 271 ? 0.6881 0.6072 0.5836 -0.0471 0.0064 0.0061 270 GLY B C 5269 O O . GLY B 271 ? 0.7425 0.6609 0.6385 -0.0527 0.0044 0.0077 270 GLY B O 5270 N N . PHE B 272 ? 0.6799 0.5828 0.5605 -0.0454 0.0060 0.0068 271 PHE B N 5271 C CA . PHE B 272 ? 0.6654 0.5511 0.5300 -0.0501 0.0042 0.0097 271 PHE B CA 5272 C C . PHE B 272 ? 0.6864 0.5536 0.5365 -0.0470 -0.0009 0.0100 271 PHE B C 5273 O O . PHE B 272 ? 0.6588 0.5156 0.4981 -0.0499 0.0028 0.0108 271 PHE B O 5274 C CB . PHE B 272 ? 0.6597 0.5453 0.5199 -0.0556 0.0124 0.0115 271 PHE B CB 5275 C CG . PHE B 272 ? 0.6542 0.5271 0.5011 -0.0605 0.0126 0.0135 271 PHE B CG 5276 C CD1 . PHE B 272 ? 0.6656 0.5346 0.5094 -0.0632 0.0091 0.0140 271 PHE B CD1 5277 C CD2 . PHE B 272 ? 0.6486 0.5148 0.4863 -0.0629 0.0165 0.0139 271 PHE B CD2 5278 C CE1 . PHE B 272 ? 0.6740 0.5321 0.5043 -0.0672 0.0106 0.0147 271 PHE B CE1 5279 C CE2 . PHE B 272 ? 0.6707 0.5285 0.4976 -0.0676 0.0183 0.0149 271 PHE B CE2 5280 C CZ . PHE B 272 ? 0.6790 0.5325 0.5014 -0.0692 0.0158 0.0153 271 PHE B CZ 5281 N N . GLU B 273 ? 0.7481 0.6106 0.5978 -0.0414 -0.0101 0.0095 272 GLU B N 5282 C CA . GLU B 273 ? 0.7943 0.6355 0.6286 -0.0373 -0.0162 0.0106 272 GLU B CA 5283 C C . GLU B 273 ? 0.7812 0.6021 0.5934 -0.0453 -0.0151 0.0151 272 GLU B C 5284 O O . GLU B 273 ? 0.8078 0.6104 0.6059 -0.0461 -0.0153 0.0166 272 GLU B O 5285 C CB . GLU B 273 ? 0.8405 0.6809 0.6789 -0.0277 -0.0279 0.0095 272 GLU B CB 5286 C CG . GLU B 273 ? 0.8996 0.7603 0.7602 -0.0185 -0.0277 0.0039 272 GLU B CG 5287 C CD . GLU B 273 ? 0.9910 0.8474 0.8547 -0.0055 -0.0395 0.0017 272 GLU B CD 5288 O OE1 . GLU B 273 ? 1.0752 0.9052 0.9205 -0.0013 -0.0453 0.0040 272 GLU B OE1 5289 O OE2 . GLU B 273 ? 1.0079 0.8877 0.8933 0.0006 -0.0429 -0.0024 272 GLU B OE2 5290 N N . ASP B 274 ? 0.7556 0.5798 0.5647 -0.0515 -0.0131 0.0165 273 ASP B N 5291 C CA . ASP B 274 ? 0.7759 0.5851 0.5653 -0.0593 -0.0098 0.0196 273 ASP B CA 5292 C C . ASP B 274 ? 0.7416 0.5494 0.5285 -0.0648 -0.0005 0.0196 273 ASP B C 5293 O O . ASP B 274 ? 0.7389 0.5324 0.5095 -0.0709 0.0020 0.0221 273 ASP B O 5294 C CB . ASP B 274 ? 0.8060 0.6218 0.5951 -0.0641 -0.0075 0.0191 273 ASP B CB 5295 C CG . ASP B 274 ? 0.8364 0.6502 0.6224 -0.0614 -0.0177 0.0189 273 ASP B CG 5296 O OD1 . ASP B 274 ? 0.8339 0.6378 0.6129 -0.0560 -0.0274 0.0205 273 ASP B OD1 5297 O OD2 . ASP B 274 ? 0.8760 0.6974 0.6664 -0.0646 -0.0169 0.0168 273 ASP B OD2 5298 N N . GLY B 275 ? 0.6947 0.5184 0.4975 -0.0634 0.0045 0.0168 274 GLY B N 5299 C CA . GLY B 275 ? 0.6716 0.4969 0.4739 -0.0680 0.0116 0.0159 274 GLY B CA 5300 C C . GLY B 275 ? 0.6766 0.4850 0.4683 -0.0690 0.0096 0.0161 274 GLY B C 5301 O O . GLY B 275 ? 0.6768 0.4802 0.4616 -0.0767 0.0144 0.0164 274 GLY B O 5302 N N . TRP B 276 ? 0.6741 0.4740 0.4654 -0.0613 0.0023 0.0154 275 TRP B N 5303 C CA . TRP B 276 ? 0.6868 0.4651 0.4658 -0.0612 -0.0007 0.0156 275 TRP B CA 5304 C C . TRP B 276 ? 0.7276 0.4829 0.4845 -0.0686 -0.0022 0.0212 275 TRP B C 5305 O O . TRP B 276 ? 0.7399 0.4795 0.4847 -0.0765 0.0006 0.0225 275 TRP B O 5306 C CB . TRP B 276 ? 0.6879 0.4620 0.4720 -0.0487 -0.0089 0.0130 275 TRP B CB 5307 C CG . TRP B 276 ? 0.7086 0.4541 0.4770 -0.0464 -0.0145 0.0138 275 TRP B CG 5308 C CD1 . TRP B 276 ? 0.7364 0.4618 0.4935 -0.0390 -0.0246 0.0169 275 TRP B CD1 5309 C CD2 . TRP B 276 ? 0.7138 0.4451 0.4744 -0.0519 -0.0113 0.0116 275 TRP B CD2 5310 N NE1 . TRP B 276 ? 0.7801 0.4768 0.5218 -0.0390 -0.0275 0.0173 275 TRP B NE1 5311 C CE2 . TRP B 276 ? 0.7583 0.4581 0.5022 -0.0477 -0.0192 0.0136 275 TRP B CE2 5312 C CE3 . TRP B 276 ? 0.7058 0.4473 0.4717 -0.0598 -0.0035 0.0078 275 TRP B CE3 5313 C CZ2 . TRP B 276 ? 0.7676 0.4439 0.4996 -0.0524 -0.0187 0.0119 275 TRP B CZ2 5314 C CZ3 . TRP B 276 ? 0.7432 0.4648 0.4987 -0.0647 -0.0035 0.0054 275 TRP B CZ3 5315 C CH2 . TRP B 276 ? 0.7678 0.4559 0.5062 -0.0617 -0.0107 0.0073 275 TRP B CH2 5316 N N . LEU B 277 ? 0.7285 0.4822 0.4794 -0.0671 -0.0063 0.0245 276 LEU B N 5317 C CA . LEU B 277 ? 0.7545 0.4871 0.4812 -0.0745 -0.0068 0.0303 276 LEU B CA 5318 C C . LEU B 277 ? 0.7435 0.4826 0.4668 -0.0873 0.0049 0.0305 276 LEU B C 5319 O O . LEU B 277 ? 0.7464 0.4687 0.4526 -0.0967 0.0084 0.0339 276 LEU B O 5320 C CB . LEU B 277 ? 0.7710 0.5028 0.4912 -0.0702 -0.0141 0.0326 276 LEU B CB 5321 C CG . LEU B 277 ? 0.7835 0.5130 0.5093 -0.0571 -0.0270 0.0320 276 LEU B CG 5322 C CD1 . LEU B 277 ? 0.7853 0.5202 0.5082 -0.0547 -0.0339 0.0329 276 LEU B CD1 5323 C CD2 . LEU B 277 ? 0.8206 0.5204 0.5281 -0.0530 -0.0349 0.0360 276 LEU B CD2 5324 N N . MET B 278 ? 0.7282 0.4923 0.4690 -0.0875 0.0110 0.0266 277 MET B N 5325 C CA . MET B 278 ? 0.7246 0.4998 0.4675 -0.0970 0.0217 0.0253 277 MET B CA 5326 C C . MET B 278 ? 0.7329 0.5063 0.4780 -0.1037 0.0259 0.0238 277 MET B C 5327 O O . MET B 278 ? 0.7416 0.5128 0.4792 -0.1148 0.0329 0.0247 277 MET B O 5328 C CB . MET B 278 ? 0.7193 0.5194 0.4815 -0.0931 0.0255 0.0213 277 MET B CB 5329 C CG . MET B 278 ? 0.7354 0.5379 0.4951 -0.0901 0.0237 0.0215 277 MET B CG 5330 S SD . MET B 278 ? 0.7385 0.5640 0.5203 -0.0848 0.0264 0.0177 277 MET B SD 5331 C CE . MET B 278 ? 0.7663 0.5879 0.5407 -0.0837 0.0236 0.0172 277 MET B CE 5332 N N . ARG B 279 ? 0.7256 0.5012 0.4811 -0.0977 0.0219 0.0208 278 ARG B N 5333 C CA . ARG B 279 ? 0.7309 0.5031 0.4875 -0.1037 0.0240 0.0181 278 ARG B CA 5334 C C . ARG B 279 ? 0.7845 0.5268 0.5198 -0.1115 0.0223 0.0222 278 ARG B C 5335 O O . ARG B 279 ? 0.8251 0.5640 0.5560 -0.1240 0.0280 0.0220 278 ARG B O 5336 C CB . ARG B 279 ? 0.7237 0.5010 0.4919 -0.0946 0.0196 0.0134 278 ARG B CB 5337 C CG . ARG B 279 ? 0.7062 0.4780 0.4739 -0.1005 0.0206 0.0092 278 ARG B CG 5338 C CD . ARG B 279 ? 0.6850 0.4776 0.4625 -0.1099 0.0276 0.0065 278 ARG B CD 5339 N NE . ARG B 279 ? 0.6940 0.4837 0.4724 -0.1161 0.0272 0.0013 278 ARG B NE 5340 C CZ . ARG B 279 ? 0.6900 0.5000 0.4794 -0.1230 0.0309 -0.0027 278 ARG B CZ 5341 N NH1 . ARG B 279 ? 0.6884 0.5228 0.4893 -0.1232 0.0356 -0.0020 278 ARG B NH1 5342 N NH2 . ARG B 279 ? 0.6864 0.4923 0.4755 -0.1291 0.0291 -0.0082 278 ARG B NH2 5343 N N . GLN B 280 ? 0.8162 0.5364 0.5379 -0.1046 0.0142 0.0262 279 GLN B N 5344 C CA . GLN B 280 ? 0.8670 0.5538 0.5641 -0.1115 0.0117 0.0318 279 GLN B CA 5345 C C . GLN B 280 ? 0.8712 0.5547 0.5535 -0.1255 0.0199 0.0367 279 GLN B C 5346 O O . GLN B 280 ? 0.8784 0.5425 0.5456 -0.1378 0.0233 0.0399 279 GLN B O 5347 C CB . GLN B 280 ? 0.9170 0.5820 0.6018 -0.0993 0.0000 0.0357 279 GLN B CB 5348 C CG . GLN B 280 ? 0.9505 0.6128 0.6463 -0.0860 -0.0076 0.0305 279 GLN B CG 5349 C CD . GLN B 280 ? 1.0163 0.6535 0.6985 -0.0740 -0.0200 0.0344 279 GLN B CD 5350 O OE1 . GLN B 280 ? 1.0668 0.7082 0.7469 -0.0677 -0.0255 0.0376 279 GLN B OE1 5351 N NE2 . GLN B 280 ? 1.0676 0.6778 0.7403 -0.0704 -0.0254 0.0337 279 GLN B NE2 5352 N N . ASP B 281 ? 0.8710 0.5718 0.5564 -0.1239 0.0232 0.0372 280 ASP B N 5353 C CA . ASP B 281 ? 0.8775 0.5787 0.5493 -0.1361 0.0325 0.0404 280 ASP B CA 5354 C C . ASP B 281 ? 0.8610 0.5799 0.5445 -0.1493 0.0443 0.0366 280 ASP B C 5355 O O . ASP B 281 ? 0.8646 0.5789 0.5351 -0.1628 0.0530 0.0395 280 ASP B O 5356 C CB . ASP B 281 ? 0.8652 0.5849 0.5417 -0.1307 0.0344 0.0388 280 ASP B CB 5357 C CG . ASP B 281 ? 0.8852 0.5912 0.5500 -0.1201 0.0232 0.0421 280 ASP B CG 5358 O OD1 . ASP B 281 ? 0.9087 0.5880 0.5567 -0.1175 0.0144 0.0472 280 ASP B OD1 5359 O OD2 . ASP B 281 ? 0.8643 0.5860 0.5370 -0.1144 0.0226 0.0392 280 ASP B OD2 5360 N N . THR B 282 ? 0.8274 0.5695 0.5360 -0.1452 0.0447 0.0298 281 THR B N 5361 C CA . THR B 282 ? 0.8114 0.5791 0.5363 -0.1544 0.0544 0.0249 281 THR B CA 5362 C C . THR B 282 ? 0.8149 0.5825 0.5479 -0.1620 0.0541 0.0211 281 THR B C 5363 O O . THR B 282 ? 0.8091 0.5945 0.5523 -0.1735 0.0619 0.0177 281 THR B O 5364 C CB . THR B 282 ? 0.7789 0.5783 0.5266 -0.1445 0.0560 0.0195 281 THR B CB 5365 O OG1 . THR B 282 ? 0.7677 0.5693 0.5263 -0.1325 0.0476 0.0173 281 THR B OG1 5366 C CG2 . THR B 282 ? 0.7818 0.5835 0.5226 -0.1398 0.0581 0.0214 281 THR B CG2 5367 N N . GLU B 283 ? 0.8561 0.6039 0.5844 -0.1561 0.0452 0.0210 282 GLU B N 5368 C CA . GLU B 283 ? 0.8808 0.6275 0.6165 -0.1612 0.0433 0.0157 282 GLU B CA 5369 C C . GLU B 283 ? 0.8919 0.6253 0.6173 -0.1811 0.0490 0.0169 282 GLU B C 5370 O O . GLU B 283 ? 0.9016 0.6450 0.6382 -0.1897 0.0502 0.0109 282 GLU B O 5371 C CB . GLU B 283 ? 0.9224 0.6474 0.6525 -0.1494 0.0329 0.0145 282 GLU B CB 5372 C CG . GLU B 283 ? 0.9870 0.6715 0.6917 -0.1497 0.0274 0.0211 282 GLU B CG 5373 C CD . GLU B 283 ? 1.0301 0.6975 0.7331 -0.1347 0.0171 0.0184 282 GLU B CD 5374 O OE1 . GLU B 283 ? 1.0280 0.7098 0.7460 -0.1290 0.0156 0.0106 282 GLU B OE1 5375 O OE2 . GLU B 283 ? 1.0938 0.7336 0.7798 -0.1279 0.0102 0.0238 282 GLU B OE2 5376 N N . GLY B 284 ? 0.9096 0.6206 0.6130 -0.1893 0.0524 0.0247 283 GLY B N 5377 C CA . GLY B 284 ? 0.9229 0.6180 0.6136 -0.2103 0.0590 0.0274 283 GLY B CA 5378 C C . GLY B 284 ? 0.9119 0.6332 0.6093 -0.2247 0.0728 0.0273 283 GLY B C 5379 O O . GLY B 284 ? 0.9426 0.6533 0.6298 -0.2441 0.0801 0.0299 283 GLY B O 5380 N N . LEU B 285 ? 0.8874 0.6419 0.6017 -0.2155 0.0767 0.0240 284 LEU B N 5381 C CA . LEU B 285 ? 0.8846 0.6634 0.6039 -0.2264 0.0903 0.0234 284 LEU B CA 5382 C C . LEU B 285 ? 0.8859 0.6899 0.6251 -0.2427 0.0980 0.0171 284 LEU B C 5383 O O . LEU B 285 ? 0.9115 0.7183 0.6447 -0.2606 0.1095 0.0190 284 LEU B O 5384 C CB . LEU B 285 ? 0.8450 0.6522 0.5789 -0.2112 0.0919 0.0200 284 LEU B CB 5385 C CG . LEU B 285 ? 0.8309 0.6172 0.5450 -0.1985 0.0863 0.0258 284 LEU B CG 5386 C CD1 . LEU B 285 ? 0.7919 0.6053 0.5221 -0.1847 0.0874 0.0212 284 LEU B CD1 5387 C CD2 . LEU B 285 ? 0.8653 0.6267 0.5485 -0.2099 0.0923 0.0338 284 LEU B CD2 5388 N N . VAL B 286 ? 0.8740 0.6979 0.6367 -0.2370 0.0917 0.0094 285 VAL B N 5389 C CA . VAL B 286 ? 0.8843 0.7354 0.6687 -0.2513 0.0964 0.0020 285 VAL B CA 5390 C C . VAL B 286 ? 0.9471 0.7697 0.7211 -0.2638 0.0907 0.0019 285 VAL B C 5391 O O . VAL B 286 ? 0.9593 0.7631 0.7285 -0.2529 0.0794 0.0009 285 VAL B O 5392 C CB . VAL B 286 ? 0.8339 0.7238 0.6487 -0.2375 0.0917 -0.0065 285 VAL B CB 5393 C CG1 . VAL B 286 ? 0.8329 0.7449 0.6684 -0.2499 0.0905 -0.0148 285 VAL B CG1 5394 C CG2 . VAL B 286 ? 0.8086 0.7297 0.6367 -0.2295 0.0996 -0.0080 285 VAL B CG2 5395 N N . GLU B 287 ? 1.0093 0.8295 0.7804 -0.2873 0.0992 0.0024 286 GLU B N 5396 C CA . GLU B 287 ? 1.0766 0.8655 0.8357 -0.3018 0.0943 0.0022 286 GLU B CA 5397 C C . GLU B 287 ? 1.0524 0.8635 0.8358 -0.2995 0.0859 -0.0091 286 GLU B C 5398 O O . GLU B 287 ? 0.9680 0.8215 0.7789 -0.3056 0.0898 -0.0167 286 GLU B O 5399 C CB . GLU B 287 ? 1.1686 0.9497 0.9181 -0.3303 0.1067 0.0060 286 GLU B CB 5400 C CG . GLU B 287 ? 1.2701 0.9933 0.9853 -0.3425 0.1034 0.0141 286 GLU B CG 5401 C CD . GLU B 287 ? 1.3403 1.0430 1.0568 -0.3438 0.0913 0.0075 286 GLU B CD 5402 O OE1 . GLU B 287 ? 1.3646 1.1003 1.1087 -0.3480 0.0893 -0.0036 286 GLU B OE1 5403 O OE2 . GLU B 287 ? 1.4256 1.0783 1.1146 -0.3398 0.0831 0.0129 286 GLU B OE2 5404 N N . ALA B 288 ? 1.1023 0.8839 0.8743 -0.2904 0.0739 -0.0105 287 ALA B N 5405 C CA . ALA B 288 ? 1.1060 0.9029 0.8946 -0.2831 0.0640 -0.0209 287 ALA B CA 5406 C C . ALA B 288 ? 1.1169 0.9405 0.9262 -0.3031 0.0658 -0.0302 287 ALA B C 5407 O O . ALA B 288 ? 1.0886 0.9485 0.9214 -0.2962 0.0613 -0.0387 287 ALA B O 5408 C CB . ALA B 288 ? 1.1425 0.8955 0.9099 -0.2747 0.0533 -0.0210 287 ALA B CB 5409 N N . THR B 289 ? 1.1385 0.9434 0.9381 -0.3280 0.0720 -0.0283 288 THR B N 5410 C CA . THR B 289 ? 1.1315 0.9568 0.9494 -0.3499 0.0725 -0.0378 288 THR B CA 5411 C C . THR B 289 ? 1.1375 0.9998 0.9747 -0.3698 0.0866 -0.0379 288 THR B C 5412 O O . THR B 289 ? 1.1492 1.0434 1.0107 -0.3852 0.0867 -0.0474 288 THR B O 5413 C CB . THR B 289 ? 1.1567 0.9331 0.9521 -0.3672 0.0677 -0.0386 288 THR B CB 5414 O OG1 . THR B 289 ? 1.1689 0.9063 0.9373 -0.3805 0.0762 -0.0267 288 THR B OG1 5415 C CG2 . THR B 289 ? 1.1473 0.8916 0.9273 -0.3473 0.0537 -0.0417 288 THR B CG2 5416 N N . MET B 290 ? 1.1417 1.0006 0.9681 -0.3705 0.0984 -0.0281 289 MET B N 5417 C CA . MET B 290 ? 1.1547 1.0438 0.9946 -0.3912 0.1144 -0.0275 289 MET B CA 5418 C C . MET B 290 ? 1.0900 1.0442 0.9697 -0.3822 0.1169 -0.0369 289 MET B C 5419 O O . MET B 290 ? 1.0521 1.0213 0.9370 -0.3578 0.1146 -0.0360 289 MET B O 5420 C CB . MET B 290 ? 1.1957 1.0605 1.0084 -0.3912 0.1256 -0.0147 289 MET B CB 5421 C CG . MET B 290 ? 1.2454 1.1321 1.0636 -0.4153 0.1444 -0.0126 289 MET B CG 5422 S SD . MET B 290 ? 1.3207 1.1792 1.1030 -0.4110 0.1561 0.0019 289 MET B SD 5423 C CE . MET B 290 ? 1.3189 1.2123 1.1131 -0.4421 0.1798 0.0011 289 MET B CE 5424 N N . PRO B 291 ? 1.0630 1.0561 0.9714 -0.4017 0.1211 -0.0461 290 PRO B N 5425 C CA . PRO B 291 ? 0.9995 1.0560 0.9478 -0.3924 0.1221 -0.0557 290 PRO B CA 5426 C C . PRO B 291 ? 0.9568 1.0381 0.9108 -0.3905 0.1389 -0.0518 290 PRO B C 5427 O O . PRO B 291 ? 0.9714 1.0250 0.9004 -0.4034 0.1510 -0.0427 290 PRO B O 5428 C CB . PRO B 291 ? 1.0208 1.1057 0.9947 -0.4178 0.1218 -0.0661 290 PRO B CB 5429 C CG . PRO B 291 ? 1.0808 1.1261 1.0296 -0.4470 0.1318 -0.0592 290 PRO B CG 5430 C CD . PRO B 291 ? 1.1046 1.0851 1.0100 -0.4349 0.1264 -0.0475 290 PRO B CD 5431 N N . PRO B 292 ? 0.8975 1.0301 0.8831 -0.3746 0.1396 -0.0590 291 PRO B N 5432 C CA . PRO B 292 ? 0.8821 1.0383 0.8731 -0.3710 0.1558 -0.0571 291 PRO B CA 5433 C C . PRO B 292 ? 0.9063 1.0900 0.9116 -0.4005 0.1738 -0.0601 291 PRO B C 5434 O O . PRO B 292 ? 0.9238 1.1107 0.9201 -0.4048 0.1903 -0.0557 291 PRO B O 5435 C CB . PRO B 292 ? 0.8452 1.0475 0.8679 -0.3450 0.1492 -0.0654 291 PRO B CB 5436 C CG . PRO B 292 ? 0.8394 1.0575 0.8823 -0.3443 0.1329 -0.0737 291 PRO B CG 5437 C CD . PRO B 292 ? 0.8673 1.0325 0.8800 -0.3558 0.1247 -0.0684 291 PRO B CD 5438 N N . GLY B 293 ? 0.9012 1.1049 0.9281 -0.4215 0.1709 -0.0678 292 GLY B N 5439 C CA . GLY B 293 ? 0.9140 1.1434 0.9555 -0.4531 0.1881 -0.0708 292 GLY B CA 5440 C C . GLY B 293 ? 0.8781 1.1801 0.9644 -0.4496 0.1986 -0.0818 292 GLY B C 5441 O O . GLY B 293 ? 0.8921 1.2186 0.9879 -0.4709 0.2180 -0.0829 292 GLY B O 5442 N N . VAL B 294 ? 0.8327 1.1691 0.9462 -0.4222 0.1855 -0.0901 293 VAL B N 5443 C CA . VAL B 294 ? 0.8053 1.2127 0.9657 -0.4143 0.1911 -0.1023 293 VAL B CA 5444 C C . VAL B 294 ? 0.7945 1.2339 0.9866 -0.4020 0.1702 -0.1129 293 VAL B C 5445 O O . VAL B 294 ? 0.7924 1.1972 0.9667 -0.3944 0.1523 -0.1102 293 VAL B O 5446 C CB . VAL B 294 ? 0.7818 1.1986 0.9395 -0.3863 0.1984 -0.1006 293 VAL B CB 5447 C CG1 . VAL B 294 ? 0.8093 1.1908 0.9304 -0.3972 0.2174 -0.0898 293 VAL B CG1 5448 C CG2 . VAL B 294 ? 0.7593 1.1508 0.9038 -0.3533 0.1792 -0.0972 293 VAL B CG2 5449 N N . GLN B 295 ? 0.7903 1.2969 1.0292 -0.3991 0.1722 -0.1254 294 GLN B N 5450 C CA . GLN B 295 ? 0.7786 1.3201 1.0485 -0.3837 0.1512 -0.1356 294 GLN B CA 5451 C C . GLN B 295 ? 0.7649 1.2803 1.0162 -0.3474 0.1363 -0.1302 294 GLN B C 5452 O O . GLN B 295 ? 0.7589 1.2737 1.0047 -0.3273 0.1441 -0.1267 294 GLN B O 5453 C CB . GLN B 295 ? 0.7623 1.3829 1.0866 -0.3821 0.1563 -0.1497 294 GLN B CB 5454 C CG . GLN B 295 ? 0.7435 1.4016 1.0995 -0.3649 0.1329 -0.1600 294 GLN B CG 5455 C CD . GLN B 295 ? 0.7320 1.4708 1.1447 -0.3643 0.1364 -0.1748 294 GLN B CD 5456 O OE1 . GLN B 295 ? 0.7071 1.4783 1.1415 -0.3340 0.1306 -0.1795 294 GLN B OE1 5457 N NE2 . GLN B 295 ? 0.7475 1.5192 1.1853 -0.3978 0.1457 -0.1824 294 GLN B NE2 5458 N N . LEU B 296 ? 0.7761 1.2673 1.0154 -0.3410 0.1161 -0.1295 295 LEU B N 5459 C CA . LEU B 296 ? 0.7673 1.2245 0.9821 -0.3112 0.1030 -0.1224 295 LEU B CA 5460 C C . LEU B 296 ? 0.7543 1.2403 0.9908 -0.2930 0.0815 -0.1301 295 LEU B C 5461 O O . LEU B 296 ? 0.7645 1.2634 1.0127 -0.3071 0.0703 -0.1373 295 LEU B O 5462 C CB . LEU B 296 ? 0.7858 1.1761 0.9560 -0.3195 0.0995 -0.1123 295 LEU B CB 5463 C CG . LEU B 296 ? 0.7819 1.1340 0.9248 -0.2929 0.0865 -0.1049 295 LEU B CG 5464 C CD1 . LEU B 296 ? 0.7719 1.1221 0.9091 -0.2700 0.0942 -0.0991 295 LEU B CD1 5465 C CD2 . LEU B 296 ? 0.8051 1.0967 0.9086 -0.3036 0.0844 -0.0968 295 LEU B CD2 5466 N N . HIS B 297 ? 0.7402 1.2343 0.9799 -0.2620 0.0755 -0.1284 296 HIS B N 5467 C CA . HIS B 297 ? 0.7337 1.2459 0.9855 -0.2405 0.0545 -0.1326 296 HIS B CA 5468 C C . HIS B 297 ? 0.7379 1.1987 0.9518 -0.2205 0.0463 -0.1216 296 HIS B C 5469 O O . HIS B 297 ? 0.7315 1.1782 0.9346 -0.2026 0.0528 -0.1151 296 HIS B O 5470 C CB . HIS B 297 ? 0.7196 1.2866 1.0091 -0.2205 0.0538 -0.1400 296 HIS B CB 5471 C CG . HIS B 297 ? 0.7248 1.3485 1.0556 -0.2392 0.0638 -0.1516 296 HIS B CG 5472 N ND1 . HIS B 297 ? 0.7382 1.4135 1.1063 -0.2420 0.0506 -0.1635 296 HIS B ND1 5473 C CD2 . HIS B 297 ? 0.7314 1.3696 1.0721 -0.2571 0.0861 -0.1532 296 HIS B CD2 5474 C CE1 . HIS B 297 ? 0.7432 1.4648 1.1454 -0.2611 0.0647 -0.1725 296 HIS B CE1 5475 N NE2 . HIS B 297 ? 0.7443 1.4439 1.1297 -0.2709 0.0871 -0.1663 296 HIS B NE2 5476 N N . CYS B 298 ? 0.7571 1.1899 0.9506 -0.2246 0.0328 -0.1203 297 CYS B N 5477 C CA . CYS B 298 ? 0.7462 1.1313 0.9040 -0.2079 0.0257 -0.1105 297 CYS B CA 5478 C C . CYS B 298 ? 0.7077 1.1078 0.8708 -0.1844 0.0075 -0.1120 297 CYS B C 5479 O O . CYS B 298 ? 0.7285 1.1396 0.8958 -0.1885 -0.0069 -0.1181 297 CYS B O 5480 C CB . CYS B 298 ? 0.7914 1.1327 0.9199 -0.2249 0.0233 -0.1079 297 CYS B CB 5481 S SG . CYS B 298 ? 0.8926 1.2037 1.0055 -0.2510 0.0431 -0.1031 297 CYS B SG 5482 N N . LEU B 299 ? 0.6700 1.0685 0.8310 -0.1601 0.0078 -0.1062 298 LEU B N 5483 C CA . LEU B 299 ? 0.6476 1.0554 0.8097 -0.1361 -0.0086 -0.1054 298 LEU B CA 5484 C C . LEU B 299 ? 0.6458 1.0040 0.7697 -0.1245 -0.0122 -0.0944 298 LEU B C 5485 O O . LEU B 299 ? 0.6210 0.9504 0.7282 -0.1198 -0.0013 -0.0864 298 LEU B O 5486 C CB . LEU B 299 ? 0.6357 1.0755 0.8224 -0.1158 -0.0069 -0.1069 298 LEU B CB 5487 C CG . LEU B 299 ? 0.6356 1.1356 0.8655 -0.1180 -0.0111 -0.1193 298 LEU B CG 5488 C CD1 . LEU B 299 ? 0.6461 1.1649 0.8932 -0.1470 0.0032 -0.1264 298 LEU B CD1 5489 C CD2 . LEU B 299 ? 0.6250 1.1511 0.8761 -0.0933 -0.0098 -0.1205 298 LEU B CD2 5490 N N . TYR B 300 ? 0.6444 0.9942 0.7547 -0.1206 -0.0273 -0.0946 299 TYR B N 5491 C CA . TYR B 300 ? 0.6503 0.9560 0.7251 -0.1122 -0.0298 -0.0853 299 TYR B CA 5492 C C . TYR B 300 ? 0.6531 0.9639 0.7204 -0.0940 -0.0468 -0.0836 299 TYR B C 5493 O O . TYR B 300 ? 0.6535 0.9931 0.7345 -0.0951 -0.0598 -0.0913 299 TYR B O 5494 C CB . TYR B 300 ? 0.6681 0.9441 0.7224 -0.1316 -0.0272 -0.0866 299 TYR B CB 5495 C CG . TYR B 300 ? 0.6921 0.9857 0.7538 -0.1451 -0.0386 -0.0971 299 TYR B CG 5496 C CD1 . TYR B 300 ? 0.7129 1.0358 0.8008 -0.1642 -0.0356 -0.1064 299 TYR B CD1 5497 C CD2 . TYR B 300 ? 0.7027 0.9841 0.7447 -0.1396 -0.0520 -0.0982 299 TYR B CD2 5498 C CE1 . TYR B 300 ? 0.7377 1.0769 0.8331 -0.1781 -0.0468 -0.1170 299 TYR B CE1 5499 C CE2 . TYR B 300 ? 0.7331 1.0297 0.7803 -0.1522 -0.0634 -0.1090 299 TYR B CE2 5500 C CZ . TYR B 300 ? 0.7500 1.0752 0.8245 -0.1717 -0.0613 -0.1185 299 TYR B CZ 5501 O OH . TYR B 300 ? 0.7791 1.1193 0.8593 -0.1856 -0.0734 -0.1301 299 TYR B OH 5502 N N . GLY B 301 ? 0.6548 0.9380 0.7000 -0.0776 -0.0467 -0.0733 300 GLY B N 5503 C CA . GLY B 301 ? 0.6654 0.9462 0.6966 -0.0608 -0.0614 -0.0692 300 GLY B CA 5504 C C . GLY B 301 ? 0.6741 0.9322 0.6779 -0.0676 -0.0675 -0.0694 300 GLY B C 5505 O O . GLY B 301 ? 0.6797 0.9094 0.6670 -0.0787 -0.0584 -0.0680 300 GLY B O 5506 N N . THR B 302 ? 0.6825 0.9531 0.6805 -0.0593 -0.0837 -0.0713 301 THR B N 5507 C CA . THR B 302 ? 0.7074 0.9562 0.6753 -0.0616 -0.0903 -0.0711 301 THR B CA 5508 C C . THR B 302 ? 0.7056 0.9504 0.6549 -0.0417 -0.1018 -0.0629 301 THR B C 5509 O O . THR B 302 ? 0.6942 0.9548 0.6564 -0.0266 -0.1070 -0.0587 301 THR B O 5510 C CB . THR B 302 ? 0.7367 1.0029 0.7104 -0.0772 -0.0999 -0.0844 301 THR B CB 5511 O OG1 . THR B 302 ? 0.7699 1.0753 0.7639 -0.0703 -0.1156 -0.0900 301 THR B OG1 5512 C CG2 . THR B 302 ? 0.7366 1.0045 0.7273 -0.0986 -0.0886 -0.0917 301 THR B CG2 5513 N N . GLY B 303 ? 0.7131 0.9355 0.6309 -0.0415 -0.1054 -0.0608 302 GLY B N 5514 C CA . GLY B 303 ? 0.7273 0.9440 0.6218 -0.0253 -0.1167 -0.0530 302 GLY B CA 5515 C C . GLY B 303 ? 0.7302 0.9210 0.6093 -0.0121 -0.1084 -0.0381 302 GLY B C 5516 O O . GLY B 303 ? 0.7368 0.9227 0.5990 0.0024 -0.1173 -0.0296 302 GLY B O 5517 N N . VAL B 304 ? 0.7122 0.8859 0.5965 -0.0177 -0.0922 -0.0349 303 VAL B N 5518 C CA . VAL B 304 ? 0.7171 0.8645 0.5869 -0.0084 -0.0834 -0.0220 303 VAL B CA 5519 C C . VAL B 304 ? 0.7091 0.8289 0.5581 -0.0179 -0.0718 -0.0204 303 VAL B C 5520 O O . VAL B 304 ? 0.7212 0.8388 0.5793 -0.0307 -0.0637 -0.0272 303 VAL B O 5521 C CB . VAL B 304 ? 0.7175 0.8689 0.6109 -0.0048 -0.0751 -0.0197 303 VAL B CB 5522 C CG1 . VAL B 304 ? 0.7329 0.8556 0.6103 0.0041 -0.0675 -0.0069 303 VAL B CG1 5523 C CG2 . VAL B 304 ? 0.7082 0.8913 0.6261 0.0052 -0.0863 -0.0236 303 VAL B CG2 5524 N N . PRO B 305 ? 0.7159 0.8146 0.5371 -0.0116 -0.0704 -0.0112 304 PRO B N 5525 C CA . PRO B 305 ? 0.7092 0.7856 0.5139 -0.0197 -0.0588 -0.0108 304 PRO B CA 5526 C C . PRO B 305 ? 0.6844 0.7505 0.5040 -0.0252 -0.0454 -0.0095 304 PRO B C 5527 O O . PRO B 305 ? 0.6440 0.7058 0.4709 -0.0187 -0.0419 -0.0020 304 PRO B O 5528 C CB . PRO B 305 ? 0.7297 0.7884 0.5068 -0.0108 -0.0579 0.0010 304 PRO B CB 5529 C CG . PRO B 305 ? 0.7573 0.8278 0.5300 0.0007 -0.0725 0.0051 304 PRO B CG 5530 C CD . PRO B 305 ? 0.7384 0.8313 0.5428 0.0028 -0.0781 -0.0002 304 PRO B CD 5531 N N . THR B 306 ? 0.6756 0.7364 0.4982 -0.0367 -0.0390 -0.0171 305 THR B N 5532 C CA . THR B 306 ? 0.6507 0.7028 0.4867 -0.0428 -0.0282 -0.0170 305 THR B CA 5533 C C . THR B 306 ? 0.6555 0.6863 0.4769 -0.0471 -0.0194 -0.0166 305 THR B C 5534 O O . THR B 306 ? 0.6633 0.6909 0.4745 -0.0521 -0.0210 -0.0239 305 THR B O 5535 C CB . THR B 306 ? 0.6419 0.7083 0.4978 -0.0534 -0.0294 -0.0268 305 THR B CB 5536 O OG1 . THR B 306 ? 0.6341 0.7261 0.5051 -0.0494 -0.0388 -0.0293 305 THR B OG1 5537 C CG2 . THR B 306 ? 0.6266 0.6847 0.4948 -0.0588 -0.0187 -0.0252 305 THR B CG2 5538 N N . PRO B 307 ? 0.6656 0.6827 0.4864 -0.0446 -0.0106 -0.0090 306 PRO B N 5539 C CA . PRO B 307 ? 0.6612 0.6620 0.4722 -0.0476 -0.0026 -0.0093 306 PRO B CA 5540 C C . PRO B 307 ? 0.6496 0.6457 0.4640 -0.0566 -0.0014 -0.0190 306 PRO B C 5541 O O . PRO B 307 ? 0.6568 0.6554 0.4854 -0.0626 -0.0009 -0.0217 306 PRO B O 5542 C CB . PRO B 307 ? 0.6462 0.6374 0.4640 -0.0457 0.0048 -0.0015 306 PRO B CB 5543 C CG . PRO B 307 ? 0.6587 0.6563 0.4795 -0.0384 0.0008 0.0053 306 PRO B CG 5544 C CD . PRO B 307 ? 0.6643 0.6802 0.4941 -0.0387 -0.0080 -0.0009 306 PRO B CD 5545 N N . ASP B 308 ? 0.6523 0.6407 0.4527 -0.0572 -0.0006 -0.0241 307 ASP B N 5546 C CA . ASP B 308 ? 0.6629 0.6424 0.4623 -0.0644 -0.0005 -0.0339 307 ASP B CA 5547 C C . ASP B 308 ? 0.6572 0.6201 0.4510 -0.0623 0.0072 -0.0340 307 ASP B C 5548 O O . ASP B 308 ? 0.6484 0.5990 0.4457 -0.0671 0.0087 -0.0386 307 ASP B O 5549 C CB . ASP B 308 ? 0.6938 0.6795 0.4818 -0.0660 -0.0084 -0.0428 307 ASP B CB 5550 C CG . ASP B 308 ? 0.7281 0.6993 0.5086 -0.0714 -0.0080 -0.0536 307 ASP B CG 5551 O OD1 . ASP B 308 ? 0.7345 0.6959 0.5010 -0.0663 -0.0036 -0.0559 307 ASP B OD1 5552 O OD2 . ASP B 308 ? 0.7472 0.7168 0.5355 -0.0810 -0.0118 -0.0602 307 ASP B OD2 5553 N N . SER B 309 ? 0.6599 0.6226 0.4453 -0.0554 0.0121 -0.0288 308 SER B N 5554 C CA . SER B 309 ? 0.6640 0.6165 0.4469 -0.0524 0.0195 -0.0296 308 SER B CA 5555 C C . SER B 309 ? 0.6518 0.6096 0.4293 -0.0469 0.0255 -0.0213 308 SER B C 5556 O O . SER B 309 ? 0.6663 0.6317 0.4367 -0.0451 0.0231 -0.0157 308 SER B O 5557 C CB . SER B 309 ? 0.6802 0.6250 0.4517 -0.0520 0.0190 -0.0412 308 SER B CB 5558 O OG . SER B 309 ? 0.7034 0.6556 0.4608 -0.0517 0.0142 -0.0457 308 SER B OG 5559 N N . PHE B 310 ? 0.6403 0.5940 0.4213 -0.0445 0.0328 -0.0204 309 PHE B N 5560 C CA . PHE B 310 ? 0.6465 0.6049 0.4275 -0.0422 0.0397 -0.0118 309 PHE B CA 5561 C C . PHE B 310 ? 0.6575 0.6180 0.4351 -0.0388 0.0476 -0.0162 309 PHE B C 5562 O O . PHE B 310 ? 0.6463 0.6018 0.4300 -0.0369 0.0482 -0.0238 309 PHE B O 5563 C CB . PHE B 310 ? 0.6310 0.5860 0.4275 -0.0442 0.0406 -0.0048 309 PHE B CB 5564 C CG . PHE B 310 ? 0.6205 0.5747 0.4226 -0.0467 0.0342 -0.0021 309 PHE B CG 5565 C CD1 . PHE B 310 ? 0.6186 0.5771 0.4173 -0.0454 0.0320 0.0051 309 PHE B CD1 5566 C CD2 . PHE B 310 ? 0.6235 0.5724 0.4336 -0.0502 0.0306 -0.0069 309 PHE B CD2 5567 C CE1 . PHE B 310 ? 0.6136 0.5744 0.4195 -0.0461 0.0265 0.0063 309 PHE B CE1 5568 C CE2 . PHE B 310 ? 0.6231 0.5750 0.4397 -0.0530 0.0264 -0.0053 309 PHE B CE2 5569 C CZ . PHE B 310 ? 0.6250 0.5844 0.4409 -0.0503 0.0243 0.0007 309 PHE B CZ 5570 N N . TYR B 311 ? 0.6747 0.6427 0.4428 -0.0378 0.0540 -0.0110 310 TYR B N 5571 C CA . TYR B 311 ? 0.7001 0.6750 0.4683 -0.0353 0.0639 -0.0141 310 TYR B CA 5572 C C . TYR B 311 ? 0.6970 0.6773 0.4747 -0.0384 0.0708 -0.0038 310 TYR B C 5573 O O . TYR B 311 ? 0.7168 0.6965 0.4866 -0.0416 0.0716 0.0060 310 TYR B O 5574 C CB . TYR B 311 ? 0.7330 0.7138 0.4798 -0.0332 0.0682 -0.0181 310 TYR B CB 5575 C CG . TYR B 311 ? 0.7543 0.7458 0.5028 -0.0305 0.0804 -0.0221 310 TYR B CG 5576 C CD1 . TYR B 311 ? 0.7756 0.7677 0.5285 -0.0245 0.0824 -0.0354 310 TYR B CD1 5577 C CD2 . TYR B 311 ? 0.7857 0.7866 0.5325 -0.0341 0.0903 -0.0130 310 TYR B CD2 5578 C CE1 . TYR B 311 ? 0.7938 0.7994 0.5514 -0.0205 0.0939 -0.0404 310 TYR B CE1 5579 C CE2 . TYR B 311 ? 0.7969 0.8119 0.5484 -0.0325 0.1027 -0.0174 310 TYR B CE2 5580 C CZ . TYR B 311 ? 0.7946 0.8137 0.5527 -0.0250 0.1045 -0.0315 310 TYR B CZ 5581 O OH . TYR B 311 ? 0.8140 0.8508 0.5794 -0.0222 0.1173 -0.0368 310 TYR B OH 5582 N N . TYR B 312 ? 0.6864 0.6705 0.4813 -0.0374 0.0746 -0.0066 311 TYR B N 5583 C CA . TYR B 312 ? 0.6859 0.6768 0.4928 -0.0416 0.0809 0.0010 311 TYR B CA 5584 C C . TYR B 312 ? 0.7329 0.7399 0.5410 -0.0408 0.0926 -0.0022 311 TYR B C 5585 O O . TYR B 312 ? 0.7689 0.7828 0.5849 -0.0347 0.0948 -0.0125 311 TYR B O 5586 C CB . TYR B 312 ? 0.6593 0.6459 0.4861 -0.0418 0.0759 0.0006 311 TYR B CB 5587 C CG . TYR B 312 ? 0.6259 0.5994 0.4529 -0.0447 0.0674 0.0062 311 TYR B CG 5588 C CD1 . TYR B 312 ? 0.6223 0.5864 0.4454 -0.0428 0.0596 0.0016 311 TYR B CD1 5589 C CD2 . TYR B 312 ? 0.6157 0.5863 0.4476 -0.0497 0.0678 0.0152 311 TYR B CD2 5590 C CE1 . TYR B 312 ? 0.6036 0.5594 0.4287 -0.0455 0.0535 0.0058 311 TYR B CE1 5591 C CE2 . TYR B 312 ? 0.6120 0.5718 0.4444 -0.0510 0.0610 0.0189 311 TYR B CE2 5592 C CZ . TYR B 312 ? 0.5984 0.5525 0.4282 -0.0487 0.0544 0.0141 311 TYR B CZ 5593 O OH . TYR B 312 ? 0.5888 0.5356 0.4208 -0.0501 0.0492 0.0169 311 TYR B OH 5594 N N . GLU B 313 ? 0.7809 0.7932 0.5806 -0.0468 0.1005 0.0066 312 GLU B N 5595 C CA . GLU B 313 ? 0.8209 0.8514 0.6242 -0.0488 0.1138 0.0051 312 GLU B CA 5596 C C . GLU B 313 ? 0.7895 0.8305 0.6203 -0.0517 0.1161 0.0051 312 GLU B C 5597 O O . GLU B 313 ? 0.7662 0.8265 0.6111 -0.0497 0.1243 -0.0016 312 GLU B O 5598 C CB . GLU B 313 ? 0.9055 0.9359 0.6913 -0.0573 0.1219 0.0170 312 GLU B CB 5599 C CG . GLU B 313 ? 1.0173 1.0387 0.7726 -0.0556 0.1201 0.0197 312 GLU B CG 5600 C CD . GLU B 313 ? 1.1176 1.1355 0.8536 -0.0641 0.1277 0.0335 312 GLU B CD 5601 O OE1 . GLU B 313 ? 1.1630 1.1743 0.9072 -0.0715 0.1281 0.0439 312 GLU B OE1 5602 O OE2 . GLU B 313 ? 1.1584 1.1783 0.8692 -0.0637 0.1332 0.0340 312 GLU B OE2 5603 N N . SER B 314 ? 0.7748 0.8041 0.6131 -0.0564 0.1088 0.0127 313 SER B N 5604 C CA . SER B 314 ? 0.7568 0.7935 0.6193 -0.0601 0.1084 0.0131 313 SER B CA 5605 C C . SER B 314 ? 0.7155 0.7347 0.5827 -0.0582 0.0954 0.0140 313 SER B C 5606 O O . SER B 314 ? 0.6978 0.7007 0.5537 -0.0612 0.0904 0.0213 313 SER B O 5607 C CB . SER B 314 ? 0.7585 0.8019 0.6246 -0.0722 0.1172 0.0225 313 SER B CB 5608 O OG . SER B 314 ? 0.7653 0.7898 0.6270 -0.0783 0.1110 0.0321 313 SER B OG 5609 N N . PHE B 315 ? 0.6773 0.6999 0.5596 -0.0521 0.0901 0.0060 314 PHE B N 5610 C CA . PHE B 315 ? 0.6466 0.6526 0.5293 -0.0488 0.0786 0.0049 314 PHE B CA 5611 C C . PHE B 315 ? 0.6304 0.6390 0.5314 -0.0510 0.0742 0.0053 314 PHE B C 5612 O O . PHE B 315 ? 0.6016 0.6270 0.5188 -0.0487 0.0768 0.0004 314 PHE B O 5613 C CB . PHE B 315 ? 0.6415 0.6457 0.5216 -0.0392 0.0756 -0.0050 314 PHE B CB 5614 C CG . PHE B 315 ? 0.6256 0.6121 0.5038 -0.0365 0.0650 -0.0067 314 PHE B CG 5615 C CD1 . PHE B 315 ? 0.6076 0.5800 0.4721 -0.0392 0.0608 -0.0034 314 PHE B CD1 5616 C CD2 . PHE B 315 ? 0.6135 0.5981 0.5034 -0.0313 0.0593 -0.0113 314 PHE B CD2 5617 C CE1 . PHE B 315 ? 0.5810 0.5387 0.4437 -0.0385 0.0529 -0.0047 314 PHE B CE1 5618 C CE2 . PHE B 315 ? 0.6055 0.5716 0.4901 -0.0301 0.0505 -0.0117 314 PHE B CE2 5619 C CZ . PHE B 315 ? 0.5964 0.5495 0.4676 -0.0346 0.0482 -0.0084 314 PHE B CZ 5620 N N . PRO B 316 ? 0.6640 0.6577 0.5634 -0.0544 0.0670 0.0099 315 PRO B N 5621 C CA . PRO B 316 ? 0.6778 0.6542 0.5616 -0.0556 0.0632 0.0143 315 PRO B CA 5622 C C . PRO B 316 ? 0.6994 0.6696 0.5780 -0.0629 0.0655 0.0232 315 PRO B C 5623 O O . PRO B 316 ? 0.6956 0.6526 0.5648 -0.0629 0.0614 0.0265 315 PRO B O 5624 C CB . PRO B 316 ? 0.6621 0.6270 0.5489 -0.0532 0.0542 0.0117 315 PRO B CB 5625 C CG . PRO B 316 ? 0.6564 0.6293 0.5589 -0.0549 0.0526 0.0108 315 PRO B CG 5626 C CD . PRO B 316 ? 0.6544 0.6477 0.5676 -0.0545 0.0602 0.0083 315 PRO B CD 5627 N N . ASP B 317 ? 0.7637 0.7427 0.6487 -0.0693 0.0718 0.0269 316 ASP B N 5628 C CA . ASP B 317 ? 0.8189 0.7870 0.7001 -0.0771 0.0726 0.0352 316 ASP B CA 5629 C C . ASP B 317 ? 0.8369 0.7986 0.7009 -0.0797 0.0780 0.0432 316 ASP B C 5630 O O . ASP B 317 ? 0.8744 0.8247 0.7341 -0.0860 0.0790 0.0507 316 ASP B O 5631 C CB . ASP B 317 ? 0.8213 0.7986 0.7190 -0.0854 0.0751 0.0355 316 ASP B CB 5632 C CG . ASP B 317 ? 0.8184 0.7957 0.7293 -0.0837 0.0666 0.0299 316 ASP B CG 5633 O OD1 . ASP B 317 ? 0.7907 0.7572 0.6960 -0.0774 0.0595 0.0273 316 ASP B OD1 5634 O OD2 . ASP B 317 ? 0.8758 0.8644 0.8024 -0.0894 0.0670 0.0282 316 ASP B OD2 5635 N N . ARG B 318 ? 0.8546 0.8216 0.7077 -0.0745 0.0805 0.0415 317 ARG B N 5636 C CA . ARG B 318 ? 0.8763 0.8363 0.7097 -0.0753 0.0835 0.0490 317 ARG B CA 5637 C C . ARG B 318 ? 0.8315 0.7860 0.6527 -0.0672 0.0767 0.0465 317 ARG B C 5638 O O . ARG B 318 ? 0.8541 0.8143 0.6804 -0.0621 0.0735 0.0380 317 ARG B O 5639 C CB . ARG B 318 ? 0.9354 0.9090 0.7638 -0.0793 0.0945 0.0503 317 ARG B CB 5640 C CG . ARG B 318 ? 1.0222 0.9982 0.8573 -0.0907 0.1024 0.0568 317 ARG B CG 5641 C CD . ARG B 318 ? 1.1513 1.1386 0.9755 -0.0958 0.1148 0.0602 317 ARG B CD 5642 N NE . ARG B 318 ? 1.2225 1.2215 1.0609 -0.1078 0.1243 0.0627 317 ARG B NE 5643 C CZ . ARG B 318 ? 1.2800 1.2970 1.1174 -0.1140 0.1376 0.0631 317 ARG B CZ 5644 N NH1 . ARG B 318 ? 1.2968 1.3205 1.1170 -0.1084 0.1431 0.0611 317 ARG B NH1 5645 N NH2 . ARG B 318 ? 1.3046 1.3341 1.1583 -0.1265 0.1459 0.0650 317 ARG B NH2 5646 N N . ASP B 319 ? 0.8067 0.7497 0.6120 -0.0660 0.0741 0.0540 318 ASP B N 5647 C CA . ASP B 319 ? 0.7967 0.7368 0.5927 -0.0587 0.0663 0.0516 318 ASP B CA 5648 C C . ASP B 319 ? 0.7591 0.7106 0.5462 -0.0557 0.0684 0.0453 318 ASP B C 5649 O O . ASP B 319 ? 0.7565 0.7143 0.5349 -0.0582 0.0764 0.0469 318 ASP B O 5650 C CB . ASP B 319 ? 0.8399 0.7670 0.6210 -0.0567 0.0622 0.0612 318 ASP B CB 5651 C CG . ASP B 319 ? 0.9036 0.8177 0.6930 -0.0560 0.0572 0.0642 318 ASP B CG 5652 O OD1 . ASP B 319 ? 0.8932 0.8087 0.6984 -0.0570 0.0558 0.0584 318 ASP B OD1 5653 O OD2 . ASP B 319 ? 0.9699 0.8708 0.7478 -0.0537 0.0544 0.0724 318 ASP B OD2 5654 N N . PRO B 320 ? 0.7267 0.6804 0.5151 -0.0508 0.0616 0.0374 319 PRO B N 5655 C CA . PRO B 320 ? 0.7263 0.6882 0.5061 -0.0480 0.0627 0.0294 319 PRO B CA 5656 C C . PRO B 320 ? 0.7291 0.6903 0.4880 -0.0453 0.0589 0.0320 319 PRO B C 5657 O O . PRO B 320 ? 0.7087 0.6633 0.4621 -0.0439 0.0531 0.0392 319 PRO B O 5658 C CB . PRO B 320 ? 0.7107 0.6718 0.5018 -0.0459 0.0563 0.0202 319 PRO B CB 5659 C CG . PRO B 320 ? 0.6963 0.6505 0.4930 -0.0462 0.0497 0.0248 319 PRO B CG 5660 C CD . PRO B 320 ? 0.6961 0.6451 0.4951 -0.0490 0.0538 0.0343 319 PRO B CD 5661 N N . LYS B 321 ? 0.7447 0.7127 0.4917 -0.0436 0.0616 0.0252 320 LYS B N 5662 C CA . LYS B 321 ? 0.7696 0.7379 0.4965 -0.0404 0.0552 0.0242 320 LYS B CA 5663 C C . LYS B 321 ? 0.7348 0.7035 0.4710 -0.0386 0.0450 0.0153 320 LYS B C 5664 O O . LYS B 321 ? 0.7427 0.7112 0.4934 -0.0396 0.0456 0.0075 320 LYS B O 5665 C CB . LYS B 321 ? 0.8055 0.7803 0.5153 -0.0398 0.0623 0.0187 320 LYS B CB 5666 C CG . LYS B 321 ? 0.8619 0.8364 0.5453 -0.0372 0.0567 0.0197 320 LYS B CG 5667 C CD . LYS B 321 ? 0.9106 0.8908 0.5732 -0.0373 0.0667 0.0163 320 LYS B CD 5668 C CE . LYS B 321 ? 0.9300 0.9098 0.5648 -0.0342 0.0590 0.0139 320 LYS B CE 5669 N NZ . LYS B 321 ? 0.9563 0.9425 0.5745 -0.0332 0.0675 0.0035 320 LYS B NZ 5670 N N . ILE B 322 ? 0.7127 0.6821 0.4404 -0.0363 0.0353 0.0167 321 ILE B N 5671 C CA . ILE B 322 ? 0.6978 0.6698 0.4378 -0.0365 0.0259 0.0098 321 ILE B CA 5672 C C . ILE B 322 ? 0.7060 0.6839 0.4330 -0.0357 0.0182 0.0012 321 ILE B C 5673 O O . ILE B 322 ? 0.7348 0.7150 0.4424 -0.0326 0.0146 0.0048 321 ILE B O 5674 C CB . ILE B 322 ? 0.7010 0.6725 0.4508 -0.0346 0.0199 0.0175 321 ILE B CB 5675 C CG1 . ILE B 322 ? 0.6880 0.6517 0.4492 -0.0361 0.0270 0.0249 321 ILE B CG1 5676 C CG2 . ILE B 322 ? 0.6900 0.6681 0.4547 -0.0361 0.0120 0.0098 321 ILE B CG2 5677 C CD1 . ILE B 322 ? 0.6725 0.6337 0.4445 -0.0337 0.0221 0.0303 321 ILE B CD1 5678 N N . CYS B 323 ? 0.6933 0.6715 0.4294 -0.0389 0.0155 -0.0100 322 CYS B N 5679 C CA . CYS B 323 ? 0.7172 0.7004 0.4457 -0.0404 0.0064 -0.0202 322 CYS B CA 5680 C C . CYS B 323 ? 0.6852 0.6761 0.4301 -0.0430 -0.0029 -0.0209 322 CYS B C 5681 O O . CYS B 323 ? 0.6574 0.6457 0.4208 -0.0464 -0.0005 -0.0205 322 CYS B O 5682 C CB . CYS B 323 ? 0.7364 0.7126 0.4647 -0.0436 0.0091 -0.0329 322 CYS B CB 5683 S SG . CYS B 323 ? 0.8406 0.8137 0.5454 -0.0397 0.0164 -0.0395 322 CYS B SG 5684 N N . PHE B 324 ? 0.6812 0.6828 0.4193 -0.0413 -0.0135 -0.0221 323 PHE B N 5685 C CA . PHE B 324 ? 0.6476 0.6618 0.4035 -0.0424 -0.0224 -0.0224 323 PHE B CA 5686 C C . PHE B 324 ? 0.6550 0.6782 0.4137 -0.0491 -0.0312 -0.0354 323 PHE B C 5687 O O . PHE B 324 ? 0.6485 0.6716 0.3884 -0.0491 -0.0360 -0.0420 323 PHE B O 5688 C CB . PHE B 324 ? 0.6542 0.6765 0.4034 -0.0338 -0.0298 -0.0131 323 PHE B CB 5689 C CG . PHE B 324 ? 0.6385 0.6511 0.3877 -0.0282 -0.0227 0.0000 323 PHE B CG 5690 C CD1 . PHE B 324 ? 0.6228 0.6373 0.3926 -0.0269 -0.0218 0.0041 323 PHE B CD1 5691 C CD2 . PHE B 324 ? 0.6590 0.6603 0.3867 -0.0251 -0.0167 0.0078 323 PHE B CD2 5692 C CE1 . PHE B 324 ? 0.6149 0.6181 0.3837 -0.0223 -0.0160 0.0153 323 PHE B CE1 5693 C CE2 . PHE B 324 ? 0.6549 0.6459 0.3825 -0.0220 -0.0104 0.0198 323 PHE B CE2 5694 C CZ . PHE B 324 ? 0.6314 0.6221 0.3793 -0.0205 -0.0106 0.0233 323 PHE B CZ 5695 N N . GLY B 325 ? 0.6446 0.6758 0.4258 -0.0556 -0.0335 -0.0394 324 GLY B N 5696 C CA . GLY B 325 ? 0.6593 0.7029 0.4476 -0.0637 -0.0429 -0.0508 324 GLY B CA 5697 C C . GLY B 325 ? 0.6617 0.7288 0.4707 -0.0625 -0.0507 -0.0492 324 GLY B C 5698 O O . GLY B 325 ? 0.6531 0.7254 0.4652 -0.0526 -0.0512 -0.0394 324 GLY B O 5699 N N . ASP B 326 ? 0.6805 0.7618 0.5047 -0.0728 -0.0568 -0.0593 325 ASP B N 5700 C CA . ASP B 326 ? 0.6915 0.8007 0.5386 -0.0720 -0.0645 -0.0601 325 ASP B CA 5701 C C . ASP B 326 ? 0.6710 0.7828 0.5414 -0.0761 -0.0547 -0.0569 325 ASP B C 5702 O O . ASP B 326 ? 0.6683 0.7609 0.5373 -0.0837 -0.0443 -0.0568 325 ASP B O 5703 C CB . ASP B 326 ? 0.7138 0.8411 0.5680 -0.0828 -0.0758 -0.0735 325 ASP B CB 5704 C CG . ASP B 326 ? 0.7301 0.8912 0.6006 -0.0767 -0.0895 -0.0749 325 ASP B CG 5705 O OD1 . ASP B 326 ? 0.7182 0.8889 0.5989 -0.0646 -0.0891 -0.0661 325 ASP B OD1 5706 O OD2 . ASP B 326 ? 0.7482 0.9264 0.6216 -0.0837 -0.1015 -0.0857 325 ASP B OD2 5707 N N . GLY B 327 ? 0.6551 0.7906 0.5458 -0.0704 -0.0586 -0.0549 326 GLY B N 5708 C CA . GLY B 327 ? 0.6447 0.7867 0.5574 -0.0729 -0.0494 -0.0527 326 GLY B CA 5709 C C . GLY B 327 ? 0.6490 0.8077 0.5734 -0.0574 -0.0532 -0.0465 326 GLY B C 5710 O O . GLY B 327 ? 0.6544 0.8286 0.5775 -0.0477 -0.0658 -0.0466 326 GLY B O 5711 N N . ASP B 328 ? 0.6491 0.8022 0.5824 -0.0541 -0.0431 -0.0411 327 ASP B N 5712 C CA . ASP B 328 ? 0.6726 0.8385 0.6180 -0.0391 -0.0454 -0.0364 327 ASP B CA 5713 C C . ASP B 328 ? 0.6746 0.8139 0.6024 -0.0272 -0.0409 -0.0247 327 ASP B C 5714 O O . ASP B 328 ? 0.6820 0.8242 0.6181 -0.0155 -0.0404 -0.0205 327 ASP B O 5715 C CB . ASP B 328 ? 0.6700 0.8566 0.6433 -0.0439 -0.0381 -0.0416 327 ASP B CB 5716 C CG . ASP B 328 ? 0.6785 0.8427 0.6474 -0.0508 -0.0230 -0.0381 327 ASP B CG 5717 O OD1 . ASP B 328 ? 0.6983 0.8326 0.6454 -0.0506 -0.0189 -0.0316 327 ASP B OD1 5718 O OD2 . ASP B 328 ? 0.6917 0.8697 0.6789 -0.0566 -0.0151 -0.0422 327 ASP B OD2 5719 N N . GLY B 329 ? 0.6838 0.7974 0.5878 -0.0303 -0.0377 -0.0202 328 GLY B N 5720 C CA . GLY B 329 ? 0.6756 0.7638 0.5631 -0.0225 -0.0322 -0.0095 328 GLY B CA 5721 C C . GLY B 329 ? 0.6578 0.7271 0.5441 -0.0306 -0.0193 -0.0081 328 GLY B C 5722 O O . GLY B 329 ? 0.6433 0.6911 0.5139 -0.0291 -0.0144 -0.0014 328 GLY B O 5723 N N . THR B 330 ? 0.6485 0.7266 0.5510 -0.0399 -0.0139 -0.0145 329 THR B N 5724 C CA . THR B 330 ? 0.6486 0.7099 0.5499 -0.0474 -0.0030 -0.0134 329 THR B CA 5725 C C . THR B 330 ? 0.6543 0.7161 0.5579 -0.0623 -0.0005 -0.0208 329 THR B C 5726 O O . THR B 330 ? 0.6766 0.7186 0.5677 -0.0678 0.0034 -0.0200 329 THR B O 5727 C CB . THR B 330 ? 0.6428 0.7100 0.5586 -0.0439 0.0025 -0.0128 329 THR B CB 5728 O OG1 . THR B 330 ? 0.6619 0.7236 0.5739 -0.0298 -0.0001 -0.0061 329 THR B OG1 5729 C CG2 . THR B 330 ? 0.6423 0.6922 0.5545 -0.0519 0.0128 -0.0118 329 THR B CG2 5730 N N . VAL B 331 ? 0.6483 0.7327 0.5684 -0.0687 -0.0030 -0.0280 330 VAL B N 5731 C CA . VAL B 331 ? 0.6537 0.7379 0.5765 -0.0846 -0.0008 -0.0349 330 VAL B CA 5732 C C . VAL B 331 ? 0.6674 0.7545 0.5827 -0.0884 -0.0100 -0.0407 330 VAL B C 5733 O O . VAL B 331 ? 0.6872 0.7959 0.6094 -0.0838 -0.0194 -0.0440 330 VAL B O 5734 C CB . VAL B 331 ? 0.6565 0.7655 0.6022 -0.0925 0.0024 -0.0406 330 VAL B CB 5735 C CG1 . VAL B 331 ? 0.6547 0.7634 0.6026 -0.1112 0.0039 -0.0476 330 VAL B CG1 5736 C CG2 . VAL B 331 ? 0.6416 0.7454 0.5914 -0.0899 0.0127 -0.0362 330 VAL B CG2 5737 N N . ASN B 332 ? 0.6786 0.7431 0.5789 -0.0960 -0.0077 -0.0424 331 ASN B N 5738 C CA . ASN B 332 ? 0.6985 0.7608 0.5879 -0.0994 -0.0155 -0.0490 331 ASN B CA 5739 C C . ASN B 332 ? 0.7197 0.8017 0.6244 -0.1128 -0.0202 -0.0586 331 ASN B C 5740 O O . ASN B 332 ? 0.7468 0.8330 0.6647 -0.1239 -0.0139 -0.0602 331 ASN B O 5741 C CB . ASN B 332 ? 0.6989 0.7310 0.5691 -0.1021 -0.0114 -0.0492 331 ASN B CB 5742 C CG . ASN B 332 ? 0.6858 0.7020 0.5463 -0.0912 -0.0052 -0.0398 331 ASN B CG 5743 O OD1 . ASN B 332 ? 0.6577 0.6659 0.5229 -0.0919 0.0019 -0.0348 331 ASN B OD1 5744 N ND2 . ASN B 332 ? 0.6804 0.6927 0.5268 -0.0821 -0.0077 -0.0378 331 ASN B ND2 5745 N N . LEU B 333 ? 0.7562 0.8515 0.6587 -0.1123 -0.0312 -0.0650 332 LEU B N 5746 C CA . LEU B 333 ? 0.7689 0.8866 0.6875 -0.1257 -0.0375 -0.0754 332 LEU B CA 5747 C C . LEU B 333 ? 0.7896 0.8903 0.7078 -0.1448 -0.0314 -0.0807 332 LEU B C 5748 O O . LEU B 333 ? 0.7564 0.8747 0.6933 -0.1585 -0.0302 -0.0858 332 LEU B O 5749 C CB . LEU B 333 ? 0.7808 0.9088 0.6906 -0.1229 -0.0514 -0.0823 332 LEU B CB 5750 C CG . LEU B 333 ? 0.7930 0.9434 0.7174 -0.1378 -0.0604 -0.0948 332 LEU B CG 5751 C CD1 . LEU B 333 ? 0.7823 0.9696 0.7395 -0.1410 -0.0605 -0.0962 332 LEU B CD1 5752 C CD2 . LEU B 333 ? 0.8055 0.9640 0.7164 -0.1318 -0.0752 -0.1006 332 LEU B CD2 5753 N N . LYS B 334 ? 0.8511 0.9175 0.7478 -0.1460 -0.0274 -0.0796 333 LYS B N 5754 C CA . LYS B 334 ? 0.9236 0.9671 0.8159 -0.1626 -0.0223 -0.0835 333 LYS B CA 5755 C C . LYS B 334 ? 0.9327 0.9792 0.8393 -0.1729 -0.0121 -0.0791 333 LYS B C 5756 O O . LYS B 334 ? 0.9249 0.9633 0.8335 -0.1907 -0.0097 -0.0836 333 LYS B O 5757 C CB . LYS B 334 ? 0.9805 0.9860 0.8489 -0.1565 -0.0182 -0.0802 333 LYS B CB 5758 C CG . LYS B 334 ? 1.0766 1.0685 0.9263 -0.1536 -0.0256 -0.0882 333 LYS B CG 5759 C CD . LYS B 334 ? 1.1493 1.1080 0.9796 -0.1453 -0.0202 -0.0850 333 LYS B CD 5760 C CE . LYS B 334 ? 1.2369 1.1892 1.0488 -0.1356 -0.0254 -0.0910 333 LYS B CE 5761 N NZ . LYS B 334 ? 1.2788 1.2241 1.0828 -0.1464 -0.0333 -0.1045 333 LYS B NZ 5762 N N . SER B 335 ? 0.9475 1.0041 0.8623 -0.1628 -0.0059 -0.0707 334 SER B N 5763 C CA . SER B 335 ? 0.9606 1.0234 0.8881 -0.1722 0.0042 -0.0675 334 SER B CA 5764 C C . SER B 335 ? 1.0241 1.1180 0.9747 -0.1881 0.0034 -0.0755 334 SER B C 5765 O O . SER B 335 ? 1.0689 1.1582 1.0233 -0.2049 0.0116 -0.0759 334 SER B O 5766 C CB . SER B 335 ? 0.9435 1.0164 0.8771 -0.1571 0.0094 -0.0595 334 SER B CB 5767 O OG . SER B 335 ? 0.9849 1.0282 0.8990 -0.1469 0.0123 -0.0520 334 SER B OG 5768 N N . ALA B 336 ? 1.0462 1.1716 1.0115 -0.1837 -0.0066 -0.0819 335 ALA B N 5769 C CA . ALA B 336 ? 1.0590 1.2201 1.0503 -0.1982 -0.0089 -0.0908 335 ALA B CA 5770 C C . ALA B 336 ? 1.0964 1.2451 1.0836 -0.2215 -0.0109 -0.0991 335 ALA B C 5771 O O . ALA B 336 ? 1.1178 1.2938 1.1272 -0.2382 -0.0104 -0.1062 335 ALA B O 5772 C CB . ALA B 336 ? 1.0667 1.2642 1.0737 -0.1856 -0.0218 -0.0956 335 ALA B CB 5773 N N . LEU B 337 ? 1.1103 1.2191 1.0707 -0.2229 -0.0133 -0.0989 336 LEU B N 5774 C CA . LEU B 337 ? 1.1598 1.2478 1.1127 -0.2451 -0.0140 -0.1060 336 LEU B CA 5775 C C . LEU B 337 ? 1.1375 1.2083 1.0896 -0.2621 -0.0003 -0.1007 336 LEU B C 5776 O O . LEU B 337 ? 1.1540 1.2148 1.1061 -0.2847 0.0008 -0.1060 336 LEU B O 5777 C CB . LEU B 337 ? 1.2177 1.2659 1.1411 -0.2396 -0.0203 -0.1082 336 LEU B CB 5778 C CG . LEU B 337 ? 1.2625 1.3246 1.1828 -0.2314 -0.0347 -0.1172 336 LEU B CG 5779 C CD1 . LEU B 337 ? 1.2779 1.3024 1.1679 -0.2201 -0.0376 -0.1175 336 LEU B CD1 5780 C CD2 . LEU B 337 ? 1.2672 1.3476 1.2007 -0.2518 -0.0431 -0.1304 336 LEU B CD2 5781 N N . GLN B 338 ? 1.1105 1.1765 1.0601 -0.2519 0.0096 -0.0902 337 GLN B N 5782 C CA . GLN B 338 ? 1.1237 1.1729 1.0688 -0.2660 0.0228 -0.0838 337 GLN B CA 5783 C C . GLN B 338 ? 1.1084 1.1955 1.0810 -0.2844 0.0298 -0.0882 337 GLN B C 5784 O O . GLN B 338 ? 1.1529 1.2261 1.1216 -0.3064 0.0382 -0.0874 337 GLN B O 5785 C CB . GLN B 338 ? 1.1212 1.1574 1.0557 -0.2490 0.0303 -0.0726 337 GLN B CB 5786 C CG . GLN B 338 ? 1.1619 1.1754 1.0850 -0.2612 0.0431 -0.0648 337 GLN B CG 5787 C CD . GLN B 338 ? 1.2178 1.1836 1.1150 -0.2738 0.0423 -0.0631 337 GLN B CD 5788 O OE1 . GLN B 338 ? 1.2026 1.1467 1.0872 -0.2686 0.0326 -0.0671 337 GLN B OE1 5789 N NE2 . GLN B 338 ? 1.2551 1.2027 1.1427 -0.2899 0.0526 -0.0572 337 GLN B NE2 5790 N N . CYS B 339 ? 1.0765 1.2111 1.0765 -0.2754 0.0266 -0.0928 338 CYS B N 5791 C CA . CYS B 339 ? 1.1015 1.2802 1.1330 -0.2914 0.0321 -0.0992 338 CYS B CA 5792 C C . CYS B 339 ? 1.1135 1.2977 1.1529 -0.3153 0.0258 -0.1097 338 CYS B C 5793 O O . CYS B 339 ? 1.1381 1.3389 1.1933 -0.3387 0.0344 -0.1131 338 CYS B O 5794 C CB . CYS B 339 ? 1.0948 1.3227 1.1542 -0.2729 0.0264 -0.1031 338 CYS B CB 5795 S SG . CYS B 339 ? 1.1687 1.3898 1.2192 -0.2431 0.0308 -0.0924 338 CYS B SG 5796 N N . GLN B 340 ? 1.1069 1.2780 1.1351 -0.3099 0.0110 -0.1153 339 GLN B N 5797 C CA . GLN B 340 ? 1.1313 1.3041 1.1641 -0.3313 0.0026 -0.1266 339 GLN B CA 5798 C C . GLN B 340 ? 1.0984 1.2277 1.1114 -0.3559 0.0118 -0.1238 339 GLN B C 5799 O O . GLN B 340 ? 1.1205 1.2614 1.1473 -0.3825 0.0138 -0.1308 339 GLN B O 5800 C CB . GLN B 340 ? 1.1758 1.3374 1.1941 -0.3183 -0.0145 -0.1329 339 GLN B CB 5801 C CG . GLN B 340 ? 1.2348 1.4231 1.2701 -0.3343 -0.0273 -0.1478 339 GLN B CG 5802 C CD . GLN B 340 ? 1.2725 1.4554 1.2930 -0.3190 -0.0447 -0.1543 339 GLN B CD 5803 O OE1 . GLN B 340 ? 1.2733 1.4521 1.2818 -0.2934 -0.0478 -0.1480 339 GLN B OE1 5804 N NE2 . GLN B 340 ? 1.3096 1.4922 1.3298 -0.3358 -0.0558 -0.1673 339 GLN B NE2 5805 N N . ALA B 341 ? 1.0509 1.1316 1.0329 -0.3474 0.0171 -0.1135 340 ALA B N 5806 C CA . ALA B 341 ? 1.0676 1.1008 1.0263 -0.3675 0.0246 -0.1091 340 ALA B CA 5807 C C . ALA B 341 ? 1.0638 1.1119 1.0356 -0.3892 0.0406 -0.1046 340 ALA B C 5808 O O . ALA B 341 ? 1.1115 1.1361 1.0747 -0.4157 0.0459 -0.1049 340 ALA B O 5809 C CB . ALA B 341 ? 1.0717 1.0554 0.9973 -0.3497 0.0260 -0.0986 340 ALA B CB 5810 N N . TRP B 342 ? 1.0146 1.1012 1.0063 -0.3785 0.0489 -0.1008 341 TRP B N 5811 C CA . TRP B 342 ? 1.0154 1.1196 1.0190 -0.3969 0.0658 -0.0969 341 TRP B CA 5812 C C . TRP B 342 ? 1.0413 1.1877 1.0770 -0.4239 0.0678 -0.1080 341 TRP B C 5813 O O . TRP B 342 ? 1.0485 1.1978 1.0879 -0.4482 0.0824 -0.1054 341 TRP B O 5814 C CB . TRP B 342 ? 0.9733 1.1075 0.9893 -0.3761 0.0740 -0.0915 341 TRP B CB 5815 C CG . TRP B 342 ? 0.9521 1.0457 0.9372 -0.3561 0.0764 -0.0794 341 TRP B CG 5816 C CD1 . TRP B 342 ? 0.9620 0.9985 0.9115 -0.3599 0.0774 -0.0710 341 TRP B CD1 5817 C CD2 . TRP B 342 ? 0.9065 1.0145 0.8950 -0.3295 0.0775 -0.0750 341 TRP B CD2 5818 N NE1 . TRP B 342 ? 0.9529 0.9707 0.8851 -0.3376 0.0786 -0.0620 341 TRP B NE1 5819 C CE2 . TRP B 342 ? 0.9140 0.9739 0.8691 -0.3196 0.0791 -0.0643 341 TRP B CE2 5820 C CE3 . TRP B 342 ? 0.8764 1.0318 0.8927 -0.3129 0.0766 -0.0793 341 TRP B CE3 5821 C CZ2 . TRP B 342 ? 0.8909 0.9501 0.8404 -0.2959 0.0802 -0.0581 341 TRP B CZ2 5822 C CZ3 . TRP B 342 ? 0.8680 1.0188 0.8766 -0.2887 0.0779 -0.0727 341 TRP B CZ3 5823 C CH2 . TRP B 342 ? 0.8773 0.9807 0.8530 -0.2814 0.0799 -0.0625 341 TRP B CH2 5824 N N . GLN B 343 ? 1.0553 1.2349 1.1137 -0.4202 0.0533 -0.1201 342 GLN B N 5825 C CA . GLN B 343 ? 1.0974 1.3216 1.1896 -0.4451 0.0526 -0.1322 342 GLN B CA 5826 C C . GLN B 343 ? 1.1342 1.3278 1.2147 -0.4817 0.0600 -0.1326 342 GLN B C 5827 O O . GLN B 343 ? 1.1181 1.3449 1.2234 -0.5063 0.0705 -0.1366 342 GLN B O 5828 C CB . GLN B 343 ? 1.1241 1.3763 1.2335 -0.4364 0.0320 -0.1453 342 GLN B CB 5829 C CG . GLN B 343 ? 1.1099 1.4196 1.2505 -0.4117 0.0268 -0.1488 342 GLN B CG 5830 C CD . GLN B 343 ? 1.1150 1.4569 1.2740 -0.4060 0.0060 -0.1619 342 GLN B CD 5831 O OE1 . GLN B 343 ? 1.1063 1.5012 1.3024 -0.4186 0.0028 -0.1727 342 GLN B OE1 5832 N NE2 . GLN B 343 ? 1.1186 1.4302 1.2514 -0.3869 -0.0081 -0.1612 342 GLN B NE2 5833 N N . SER B 344 ? 1.1621 1.2921 1.2047 -0.4849 0.0548 -0.1286 343 SER B N 5834 C CA . SER B 344 ? 1.2068 1.2993 1.2339 -0.5188 0.0598 -0.1287 343 SER B CA 5835 C C . SER B 344 ? 1.2394 1.2936 1.2406 -0.5294 0.0782 -0.1133 343 SER B C 5836 O O . SER B 344 ? 1.2934 1.3145 1.2797 -0.5589 0.0846 -0.1110 343 SER B O 5837 C CB . SER B 344 ? 1.2203 1.2601 1.2181 -0.5170 0.0440 -0.1334 343 SER B CB 5838 O OG . SER B 344 ? 1.1987 1.1900 1.1616 -0.4914 0.0421 -0.1230 343 SER B OG 5839 N N . ARG B 345 ? 1.2367 1.2920 1.2300 -0.5059 0.0857 -0.1027 344 ARG B N 5840 C CA . ARG B 345 ? 1.2713 1.2873 1.2352 -0.5126 0.1013 -0.0876 344 ARG B CA 5841 C C . ARG B 345 ? 1.2429 1.3022 1.2274 -0.5222 0.1209 -0.0840 344 ARG B C 5842 O O . ARG B 345 ? 1.2418 1.2724 1.2019 -0.5309 0.1351 -0.0718 344 ARG B O 5843 C CB . ARG B 345 ? 1.2905 1.2664 1.2233 -0.4810 0.0962 -0.0774 344 ARG B CB 5844 C CG . ARG B 345 ? 1.3310 1.2602 1.2400 -0.4701 0.0794 -0.0801 344 ARG B CG 5845 C CD . ARG B 345 ? 1.3614 1.2378 1.2331 -0.4498 0.0787 -0.0674 344 ARG B CD 5846 N NE . ARG B 345 ? 1.3983 1.2450 1.2549 -0.4307 0.0626 -0.0720 344 ARG B NE 5847 C CZ . ARG B 345 ? 1.3674 1.2308 1.2299 -0.4012 0.0541 -0.0743 344 ARG B CZ 5848 N NH1 . ARG B 345 ? 1.3424 1.2497 1.2255 -0.3858 0.0586 -0.0723 344 ARG B NH1 5849 N NH2 . ARG B 345 ? 1.3687 1.2033 1.2155 -0.3870 0.0413 -0.0788 344 ARG B NH2 5850 N N . GLN B 346 ? 1.1962 1.3246 1.2246 -0.5193 0.1213 -0.0947 345 GLN B N 5851 C CA . GLN B 346 ? 1.1792 1.3533 1.2306 -0.5292 0.1408 -0.0937 345 GLN B CA 5852 C C . GLN B 346 ? 1.1965 1.4337 1.2948 -0.5497 0.1415 -0.1084 345 GLN B C 5853 O O . GLN B 346 ? 1.1867 1.4414 1.3033 -0.5463 0.1242 -0.1196 345 GLN B O 5854 C CB . GLN B 346 ? 1.1261 1.3254 1.1844 -0.4959 0.1437 -0.0905 345 GLN B CB 5855 C CG . GLN B 346 ? 1.0774 1.3255 1.1695 -0.4703 0.1290 -0.1017 345 GLN B CG 5856 C CD . GLN B 346 ? 1.0292 1.3031 1.1299 -0.4410 0.1341 -0.0988 345 GLN B CD 5857 O OE1 . GLN B 346 ? 1.0368 1.2746 1.1072 -0.4288 0.1403 -0.0876 345 GLN B OE1 5858 N NE2 . GLN B 346 ? 0.9864 1.3218 1.1280 -0.4289 0.1306 -0.1093 345 GLN B NE2 5859 N N . GLU B 347 ? 1.2137 1.4847 1.3304 -0.5719 0.1614 -0.1084 346 GLU B N 5860 C CA . GLU B 347 ? 1.2114 1.5503 1.3779 -0.5926 0.1642 -0.1229 346 GLU B CA 5861 C C . GLU B 347 ? 1.1406 1.5503 1.3509 -0.5668 0.1599 -0.1332 346 GLU B C 5862 O O . GLU B 347 ? 1.1352 1.5961 1.3856 -0.5713 0.1496 -0.1473 346 GLU B O 5863 C CB . GLU B 347 ? 1.2729 1.6234 1.4433 -0.6283 0.1895 -0.1192 346 GLU B CB 5864 C CG . GLU B 347 ? 1.3138 1.7257 1.5325 -0.6594 0.1931 -0.1339 346 GLU B CG 5865 C CD . GLU B 347 ? 1.3437 1.8097 1.5899 -0.6762 0.2195 -0.1351 346 GLU B CD 5866 O OE1 . GLU B 347 ? 1.3720 1.8468 1.6267 -0.7165 0.2339 -0.1364 346 GLU B OE1 5867 O OE2 . GLU B 347 ? 1.3322 1.8320 1.5914 -0.6492 0.2265 -0.1351 346 GLU B OE2 5868 N N . HIS B 348 ? 1.0933 1.5074 1.2971 -0.5391 0.1671 -0.1267 347 HIS B N 5869 C CA . HIS B 348 ? 1.0350 1.5088 1.2761 -0.5099 0.1616 -0.1354 347 HIS B CA 5870 C C . HIS B 348 ? 1.0070 1.4798 1.2528 -0.4869 0.1348 -0.1415 347 HIS B C 5871 O O . HIS B 348 ? 1.0145 1.4305 1.2244 -0.4812 0.1225 -0.1354 347 HIS B O 5872 C CB . HIS B 348 ? 1.0131 1.4787 1.2382 -0.4844 0.1731 -0.1265 347 HIS B CB 5873 C CG . HIS B 348 ? 1.0337 1.5141 1.2599 -0.5035 0.1999 -0.1231 347 HIS B CG 5874 N ND1 . HIS B 348 ? 1.0631 1.4892 1.2471 -0.5242 0.2137 -0.1101 347 HIS B ND1 5875 C CD2 . HIS B 348 ? 1.0164 1.5598 1.2796 -0.5047 0.2158 -0.1311 347 HIS B CD2 5876 C CE1 . HIS B 348 ? 1.0728 1.5272 1.2657 -0.5384 0.2375 -0.1098 347 HIS B CE1 5877 N NE2 . HIS B 348 ? 1.0448 1.5714 1.2865 -0.5269 0.2399 -0.1230 347 HIS B NE2 5878 N N . GLN B 349 ? 0.9789 1.5156 1.2687 -0.4734 0.1260 -0.1537 348 GLN B N 5879 C CA . GLN B 349 ? 0.9594 1.5020 1.2556 -0.4525 0.1005 -0.1601 348 GLN B CA 5880 C C . GLN B 349 ? 0.9259 1.4289 1.1903 -0.4166 0.0921 -0.1502 348 GLN B C 5881 O O . GLN B 349 ? 0.9126 1.4126 1.1697 -0.3998 0.1040 -0.1429 348 GLN B O 5882 C CB . GLN B 349 ? 0.9541 1.5767 1.3053 -0.4448 0.0936 -0.1747 348 GLN B CB 5883 C CG . GLN B 349 ? 0.9663 1.6033 1.3293 -0.4355 0.0668 -0.1842 348 GLN B CG 5884 C CD . GLN B 349 ? 0.9656 1.6831 1.3854 -0.4395 0.0601 -0.2001 348 GLN B CD 5885 O OE1 . GLN B 349 ? 0.9782 1.7135 1.4114 -0.4403 0.0391 -0.2098 348 GLN B OE1 5886 N NE2 . GLN B 349 ? 0.9472 1.7152 1.4011 -0.4417 0.0777 -0.2036 348 GLN B NE2 5887 N N . VAL B 350 ? 0.9042 1.3763 1.1489 -0.4070 0.0726 -0.1503 349 VAL B N 5888 C CA . VAL B 350 ? 0.8812 1.3229 1.1006 -0.3740 0.0622 -0.1428 349 VAL B CA 5889 C C . VAL B 350 ? 0.8652 1.3402 1.1051 -0.3559 0.0402 -0.1521 349 VAL B C 5890 O O . VAL B 350 ? 0.8789 1.3507 1.1184 -0.3687 0.0265 -0.1596 349 VAL B O 5891 C CB . VAL B 350 ? 0.8933 1.2629 1.0651 -0.3773 0.0591 -0.1336 349 VAL B CB 5892 C CG1 . VAL B 350 ? 0.8795 1.2228 1.0285 -0.3442 0.0490 -0.1266 349 VAL B CG1 5893 C CG2 . VAL B 350 ? 0.9191 1.2527 1.0679 -0.3959 0.0787 -0.1238 349 VAL B CG2 5894 N N . LEU B 351 ? 0.8421 1.3477 1.0985 -0.3275 0.0365 -0.1520 350 LEU B N 5895 C CA . LEU B 351 ? 0.8277 1.3664 1.1029 -0.3081 0.0154 -0.1596 350 LEU B CA 5896 C C . LEU B 351 ? 0.8075 1.3063 1.0496 -0.2796 0.0058 -0.1500 350 LEU B C 5897 O O . LEU B 351 ? 0.7823 1.2626 1.0109 -0.2630 0.0154 -0.1406 350 LEU B O 5898 C CB . LEU B 351 ? 0.8218 1.4270 1.1426 -0.2967 0.0174 -0.1671 350 LEU B CB 5899 C CG . LEU B 351 ? 0.8502 1.5041 1.2097 -0.3264 0.0264 -0.1785 350 LEU B CG 5900 C CD1 . LEU B 351 ? 0.8444 1.5489 1.2394 -0.3187 0.0416 -0.1819 350 LEU B CD1 5901 C CD2 . LEU B 351 ? 0.8585 1.5494 1.2434 -0.3344 0.0058 -0.1917 350 LEU B CD2 5902 N N . LEU B 352 ? 0.8101 1.2944 1.0377 -0.2751 -0.0126 -0.1527 351 LEU B N 5903 C CA . LEU B 352 ? 0.7969 1.2485 0.9948 -0.2484 -0.0225 -0.1444 351 LEU B CA 5904 C C . LEU B 352 ? 0.7661 1.2583 0.9850 -0.2246 -0.0383 -0.1484 351 LEU B C 5905 O O . LEU B 352 ? 0.7772 1.3096 1.0217 -0.2309 -0.0508 -0.1595 351 LEU B O 5906 C CB . LEU B 352 ? 0.8348 1.2423 0.9993 -0.2565 -0.0318 -0.1445 351 LEU B CB 5907 C CG . LEU B 352 ? 0.8699 1.2199 1.0000 -0.2653 -0.0186 -0.1352 351 LEU B CG 5908 C CD1 . LEU B 352 ? 0.8865 1.2374 1.0267 -0.2928 -0.0022 -0.1363 351 LEU B CD1 5909 C CD2 . LEU B 352 ? 0.9039 1.2128 1.0024 -0.2687 -0.0291 -0.1368 351 LEU B CD2 5910 N N . GLN B 353 ? 0.7377 1.2197 0.9464 -0.1974 -0.0383 -0.1394 352 GLN B N 5911 C CA . GLN B 353 ? 0.7256 1.2371 0.9474 -0.1721 -0.0548 -0.1410 352 GLN B CA 5912 C C . GLN B 353 ? 0.7226 1.1935 0.9082 -0.1495 -0.0622 -0.1299 352 GLN B C 5913 O O . GLN B 353 ? 0.7096 1.1554 0.8808 -0.1368 -0.0520 -0.1200 352 GLN B O 5914 C CB . GLN B 353 ? 0.7084 1.2620 0.9649 -0.1595 -0.0475 -0.1430 352 GLN B CB 5915 C CG . GLN B 353 ? 0.7068 1.2919 0.9795 -0.1315 -0.0649 -0.1447 352 GLN B CG 5916 C CD . GLN B 353 ? 0.7145 1.3390 1.0082 -0.1366 -0.0849 -0.1561 352 GLN B CD 5917 O OE1 . GLN B 353 ? 0.7112 1.3820 1.0420 -0.1524 -0.0834 -0.1678 352 GLN B OE1 5918 N NE2 . GLN B 353 ? 0.7202 1.3274 0.9898 -0.1238 -0.1038 -0.1531 352 GLN B NE2 5919 N N . GLU B 354 ? 0.7442 1.2089 0.9145 -0.1462 -0.0796 -0.1322 353 GLU B N 5920 C CA . GLU B 354 ? 0.7520 1.1850 0.8897 -0.1248 -0.0881 -0.1225 353 GLU B CA 5921 C C . GLU B 354 ? 0.7411 1.1964 0.8911 -0.0973 -0.0962 -0.1182 353 GLU B C 5922 O O . GLU B 354 ? 0.7574 1.2590 0.9390 -0.0921 -0.1063 -0.1261 353 GLU B O 5923 C CB . GLU B 354 ? 0.7893 1.2141 0.9076 -0.1294 -0.1047 -0.1277 353 GLU B CB 5924 C CG . GLU B 354 ? 0.8161 1.2051 0.8961 -0.1111 -0.1113 -0.1178 353 GLU B CG 5925 C CD . GLU B 354 ? 0.8416 1.2253 0.9013 -0.1152 -0.1275 -0.1242 353 GLU B CD 5926 O OE1 . GLU B 354 ? 0.8631 1.2765 0.9417 -0.1288 -0.1376 -0.1368 353 GLU B OE1 5927 O OE2 . GLU B 354 ? 0.8555 1.2060 0.8801 -0.1054 -0.1298 -0.1172 353 GLU B OE2 5928 N N . LEU B 355 ? 0.7418 1.1629 0.8666 -0.0798 -0.0920 -0.1058 354 LEU B N 5929 C CA . LEU B 355 ? 0.7522 1.1817 0.8802 -0.0525 -0.0996 -0.0994 354 LEU B CA 5930 C C . LEU B 355 ? 0.7701 1.1657 0.8599 -0.0394 -0.1102 -0.0899 354 LEU B C 5931 O O . LEU B 355 ? 0.7817 1.1382 0.8453 -0.0331 -0.1015 -0.0789 354 LEU B O 5932 C CB . LEU B 355 ? 0.7453 1.1633 0.8781 -0.0446 -0.0828 -0.0929 354 LEU B CB 5933 C CG . LEU B 355 ? 0.7461 1.1945 0.9125 -0.0576 -0.0689 -0.1014 354 LEU B CG 5934 C CD1 . LEU B 355 ? 0.7439 1.1734 0.9066 -0.0492 -0.0525 -0.0946 354 LEU B CD1 5935 C CD2 . LEU B 355 ? 0.7469 1.2527 0.9537 -0.0515 -0.0794 -0.1123 354 LEU B CD2 5936 N N . PRO B 356 ? 0.7851 1.1966 0.8711 -0.0357 -0.1294 -0.0942 355 PRO B N 5937 C CA . PRO B 356 ? 0.7919 1.1706 0.8378 -0.0267 -0.1381 -0.0858 355 PRO B CA 5938 C C . PRO B 356 ? 0.7847 1.1494 0.8188 -0.0014 -0.1412 -0.0729 355 PRO B C 5939 O O . PRO B 356 ? 0.7882 1.1803 0.8442 0.0143 -0.1502 -0.0738 355 PRO B O 5940 C CB . PRO B 356 ? 0.8024 1.2079 0.8506 -0.0289 -0.1590 -0.0952 355 PRO B CB 5941 C CG . PRO B 356 ? 0.7973 1.2468 0.8872 -0.0439 -0.1594 -0.1094 355 PRO B CG 5942 C CD . PRO B 356 ? 0.7832 1.2437 0.8999 -0.0397 -0.1441 -0.1070 355 PRO B CD 5943 N N . GLY B 357 ? 0.7865 1.1080 0.7866 0.0018 -0.1334 -0.0615 356 GLY B N 5944 C CA . GLY B 357 ? 0.8000 1.1001 0.7834 0.0229 -0.1349 -0.0480 356 GLY B CA 5945 C C . GLY B 357 ? 0.7877 1.0823 0.7873 0.0289 -0.1208 -0.0441 356 GLY B C 5946 O O . GLY B 357 ? 0.8000 1.0794 0.7906 0.0467 -0.1228 -0.0344 356 GLY B O 5947 N N . SER B 358 ? 0.7691 1.0737 0.7902 0.0138 -0.1068 -0.0515 357 SER B N 5948 C CA . SER B 358 ? 0.7690 1.0710 0.8052 0.0191 -0.0935 -0.0493 357 SER B CA 5949 C C . SER B 358 ? 0.7556 1.0166 0.7688 0.0112 -0.0775 -0.0416 357 SER B C 5950 O O . SER B 358 ? 0.7308 0.9829 0.7395 -0.0073 -0.0684 -0.0450 357 SER B O 5951 C CB . SER B 358 ? 0.7670 1.1076 0.8410 0.0085 -0.0871 -0.0618 357 SER B CB 5952 O OG . SER B 358 ? 0.7851 1.1308 0.8757 0.0196 -0.0780 -0.0611 357 SER B OG 5953 N N . GLU B 359 ? 0.7627 0.9977 0.7612 0.0254 -0.0749 -0.0313 358 GLU B N 5954 C CA . GLU B 359 ? 0.7620 0.9602 0.7408 0.0194 -0.0609 -0.0239 358 GLU B CA 5955 C C . GLU B 359 ? 0.7186 0.9208 0.7150 0.0112 -0.0458 -0.0288 358 GLU B C 5956 O O . GLU B 359 ? 0.7030 0.9320 0.7255 0.0161 -0.0445 -0.0353 358 GLU B O 5957 C CB . GLU B 359 ? 0.7930 0.9620 0.7506 0.0359 -0.0634 -0.0115 358 GLU B CB 5958 C CG . GLU B 359 ? 0.8077 0.9384 0.7414 0.0294 -0.0518 -0.0030 358 GLU B CG 5959 C CD . GLU B 359 ? 0.8066 0.9266 0.7491 0.0283 -0.0386 -0.0032 358 GLU B CD 5960 O OE1 . GLU B 359 ? 0.8061 0.9372 0.7651 0.0400 -0.0393 -0.0056 358 GLU B OE1 5961 O OE2 . GLU B 359 ? 0.7983 0.8987 0.7307 0.0165 -0.0279 -0.0015 358 GLU B OE2 5962 N N . HIS B 360 ? 0.6977 0.8732 0.6789 -0.0006 -0.0342 -0.0255 359 HIS B N 5963 C CA . HIS B 360 ? 0.6852 0.8599 0.6763 -0.0117 -0.0200 -0.0294 359 HIS B CA 5964 C C . HIS B 360 ? 0.6902 0.8742 0.6976 -0.0011 -0.0142 -0.0311 359 HIS B C 5965 O O . HIS B 360 ? 0.6818 0.8881 0.7095 -0.0081 -0.0068 -0.0389 359 HIS B O 5966 C CB . HIS B 360 ? 0.6695 0.8084 0.6372 -0.0200 -0.0113 -0.0229 359 HIS B CB 5967 C CG . HIS B 360 ? 0.6516 0.7860 0.6240 -0.0328 0.0016 -0.0260 359 HIS B CG 5968 N ND1 . HIS B 360 ? 0.6408 0.7875 0.6216 -0.0492 0.0053 -0.0328 359 HIS B ND1 5969 C CD2 . HIS B 360 ? 0.6483 0.7645 0.6150 -0.0323 0.0113 -0.0228 359 HIS B CD2 5970 C CE1 . HIS B 360 ? 0.6395 0.7752 0.6185 -0.0576 0.0169 -0.0328 359 HIS B CE1 5971 N NE2 . HIS B 360 ? 0.6425 0.7607 0.6132 -0.0473 0.0205 -0.0271 359 HIS B NE2 5972 N N . ILE B 361 ? 0.7080 0.8731 0.7052 0.0148 -0.0166 -0.0240 360 ILE B N 5973 C CA . ILE B 361 ? 0.7314 0.9018 0.7420 0.0270 -0.0119 -0.0264 360 ILE B CA 5974 C C . ILE B 361 ? 0.7599 0.9617 0.7927 0.0431 -0.0222 -0.0316 360 ILE B C 5975 O O . ILE B 361 ? 0.7729 0.9988 0.8289 0.0480 -0.0170 -0.0397 360 ILE B O 5976 C CB . ILE B 361 ? 0.7544 0.8870 0.7440 0.0372 -0.0101 -0.0171 360 ILE B CB 5977 C CG1 . ILE B 361 ? 0.7472 0.8497 0.7162 0.0229 -0.0009 -0.0120 360 ILE B CG1 5978 C CG2 . ILE B 361 ? 0.7741 0.9097 0.7762 0.0501 -0.0050 -0.0213 360 ILE B CG2 5979 C CD1 . ILE B 361 ? 0.7421 0.8468 0.7177 0.0114 0.0122 -0.0178 360 ILE B CD1 5980 N N . GLU B 362 ? 0.7996 1.0022 0.8248 0.0523 -0.0370 -0.0270 361 GLU B N 5981 C CA . GLU B 362 ? 0.8060 1.0373 0.8508 0.0705 -0.0499 -0.0310 361 GLU B CA 5982 C C . GLU B 362 ? 0.7765 1.0566 0.8553 0.0630 -0.0497 -0.0443 361 GLU B C 5983 O O . GLU B 362 ? 0.7715 1.0821 0.8759 0.0775 -0.0551 -0.0509 361 GLU B O 5984 C CB . GLU B 362 ? 0.8423 1.0640 0.8683 0.0797 -0.0668 -0.0229 361 GLU B CB 5985 C CG . GLU B 362 ? 0.8856 1.0638 0.8821 0.0915 -0.0687 -0.0096 361 GLU B CG 5986 C CD . GLU B 362 ? 0.9504 1.1165 0.9229 0.0975 -0.0834 -0.0004 361 GLU B CD 5987 O OE1 . GLU B 362 ? 1.0160 1.2110 0.9989 0.1020 -0.0970 -0.0049 361 GLU B OE1 5988 O OE2 . GLU B 362 ? 0.9826 1.1108 0.9252 0.0970 -0.0814 0.0110 361 GLU B OE2 5989 N N . MET B 363 ? 0.7609 1.0481 0.8411 0.0403 -0.0426 -0.0486 362 MET B N 5990 C CA . MET B 363 ? 0.7640 1.0963 0.8760 0.0294 -0.0414 -0.0610 362 MET B CA 5991 C C . MET B 363 ? 0.7463 1.1035 0.8859 0.0336 -0.0295 -0.0692 362 MET B C 5992 O O . MET B 363 ? 0.7176 1.1198 0.8895 0.0332 -0.0314 -0.0797 362 MET B O 5993 C CB . MET B 363 ? 0.7745 1.1031 0.8796 0.0027 -0.0352 -0.0635 362 MET B CB 5994 C CG . MET B 363 ? 0.7834 1.0927 0.8812 -0.0129 -0.0163 -0.0629 362 MET B CG 5995 S SD . MET B 363 ? 0.7875 1.0989 0.8838 -0.0432 -0.0104 -0.0679 362 MET B SD 5996 C CE . MET B 363 ? 0.8082 1.0909 0.8744 -0.0436 -0.0237 -0.0614 362 MET B CE 5997 N N . LEU B 364 ? 0.7471 1.0766 0.8740 0.0377 -0.0174 -0.0651 363 LEU B N 5998 C CA . LEU B 364 ? 0.7446 1.0930 0.8925 0.0430 -0.0050 -0.0730 363 LEU B CA 5999 C C . LEU B 364 ? 0.7550 1.1278 0.9254 0.0694 -0.0133 -0.0781 363 LEU B C 6000 O O . LEU B 364 ? 0.7513 1.1536 0.9475 0.0739 -0.0040 -0.0881 363 LEU B O 6001 C CB . LEU B 364 ? 0.7496 1.0574 0.8736 0.0412 0.0083 -0.0674 363 LEU B CB 6002 C CG . LEU B 364 ? 0.7553 1.0494 0.8669 0.0164 0.0228 -0.0668 363 LEU B CG 6003 C CD1 . LEU B 364 ? 0.7620 1.0174 0.8504 0.0190 0.0325 -0.0615 363 LEU B CD1 6004 C CD2 . LEU B 364 ? 0.7602 1.0942 0.8986 0.0027 0.0341 -0.0778 363 LEU B CD2 6005 N N . ALA B 365 ? 0.7696 1.1284 0.9288 0.0875 -0.0304 -0.0709 364 ALA B N 6006 C CA . ALA B 365 ? 0.7952 1.1718 0.9724 0.1153 -0.0414 -0.0741 364 ALA B CA 6007 C C . ALA B 365 ? 0.8039 1.2129 0.9962 0.1220 -0.0612 -0.0763 364 ALA B C 6008 O O . ALA B 365 ? 0.8153 1.2361 1.0186 0.1466 -0.0749 -0.0770 364 ALA B O 6009 C CB . ALA B 365 ? 0.8149 1.1424 0.9628 0.1334 -0.0457 -0.0629 364 ALA B CB 6010 N N . ASN B 366 ? 0.7978 1.2206 0.9904 0.1006 -0.0634 -0.0778 365 ASN B N 6011 C CA . ASN B 366 ? 0.8086 1.2571 1.0095 0.1043 -0.0833 -0.0794 365 ASN B CA 6012 C C . ASN B 366 ? 0.8019 1.3145 1.0504 0.1049 -0.0857 -0.0949 365 ASN B C 6013 O O . ASN B 366 ? 0.8030 1.3398 1.0722 0.0860 -0.0701 -0.1040 365 ASN B O 6014 C CB . ASN B 366 ? 0.8165 1.2487 0.9944 0.0809 -0.0849 -0.0754 365 ASN B CB 6015 C CG . ASN B 366 ? 0.8493 1.3049 1.0311 0.0835 -0.1061 -0.0775 365 ASN B CG 6016 O OD1 . ASN B 366 ? 0.8664 1.3719 1.0832 0.0836 -0.1133 -0.0891 365 ASN B OD1 6017 N ND2 . ASN B 366 ? 0.8914 1.3125 1.0370 0.0855 -0.1164 -0.0667 365 ASN B ND2 6018 N N . ALA B 367 ? 0.8090 1.3486 1.0740 0.1262 -0.1056 -0.0975 366 ALA B N 6019 C CA . ALA B 367 ? 0.8045 1.4094 1.1188 0.1312 -0.1102 -0.1128 366 ALA B CA 6020 C C . ALA B 367 ? 0.7890 1.4304 1.1230 0.1015 -0.1074 -0.1225 366 ALA B C 6021 O O . ALA B 367 ? 0.7794 1.4709 1.1541 0.0941 -0.0994 -0.1358 366 ALA B O 6022 C CB . ALA B 367 ? 0.8103 1.4335 1.1343 0.1605 -0.1357 -0.1123 366 ALA B CB 6023 N N . THR B 368 ? 0.7910 1.4082 1.0967 0.0848 -0.1143 -0.1164 367 THR B N 6024 C CA . THR B 368 ? 0.7842 1.4269 1.1031 0.0554 -0.1119 -0.1250 367 THR B CA 6025 C C . THR B 368 ? 0.7706 1.4063 1.0921 0.0299 -0.0860 -0.1279 367 THR B C 6026 O O . THR B 368 ? 0.7649 1.4400 1.1165 0.0102 -0.0784 -0.1392 367 THR B O 6027 C CB . THR B 368 ? 0.8019 1.4133 1.0847 0.0448 -0.1247 -0.1180 367 THR B CB 6028 O OG1 . THR B 368 ? 0.8154 1.4310 1.0911 0.0681 -0.1490 -0.1143 367 THR B OG1 6029 C CG2 . THR B 368 ? 0.8094 1.4470 1.1066 0.0150 -0.1244 -0.1286 367 THR B CG2 6030 N N . THR B 369 ? 0.7621 1.3474 1.0514 0.0301 -0.0724 -0.1175 368 THR B N 6031 C CA . THR B 369 ? 0.7405 1.3149 1.0281 0.0096 -0.0487 -0.1187 368 THR B CA 6032 C C . THR B 369 ? 0.7300 1.3493 1.0572 0.0139 -0.0362 -0.1299 368 THR B C 6033 O O . THR B 369 ? 0.6999 1.3424 1.0450 -0.0086 -0.0211 -0.1374 368 THR B O 6034 C CB . THR B 369 ? 0.7351 1.2504 0.9833 0.0143 -0.0389 -0.1059 368 THR B CB 6035 O OG1 . THR B 369 ? 0.7507 1.2274 0.9637 0.0118 -0.0497 -0.0960 368 THR B OG1 6036 C CG2 . THR B 369 ? 0.7217 1.2239 0.9646 -0.0071 -0.0160 -0.1067 368 THR B CG2 6037 N N . LEU B 370 ? 0.7330 1.3620 1.0719 0.0433 -0.0420 -0.1306 369 LEU B N 6038 C CA . LEU B 370 ? 0.7219 1.3911 1.0966 0.0517 -0.0295 -0.1417 369 LEU B CA 6039 C C . LEU B 370 ? 0.7123 1.4510 1.1352 0.0441 -0.0343 -0.1565 369 LEU B C 6040 O O . LEU B 370 ? 0.7102 1.4862 1.1627 0.0328 -0.0169 -0.1670 369 LEU B O 6041 C CB . LEU B 370 ? 0.7368 1.3957 1.1109 0.0872 -0.0360 -0.1395 369 LEU B CB 6042 C CG . LEU B 370 ? 0.7504 1.3431 1.0803 0.0951 -0.0304 -0.1261 369 LEU B CG 6043 C CD1 . LEU B 370 ? 0.7690 1.3509 1.0985 0.1305 -0.0409 -0.1240 369 LEU B CD1 6044 C CD2 . LEU B 370 ? 0.7432 1.3192 1.0634 0.0778 -0.0051 -0.1272 369 LEU B CD2 6045 N N . ALA B 371 ? 0.7160 1.4732 1.1467 0.0487 -0.0571 -0.1576 370 ALA B N 6046 C CA . ALA B 371 ? 0.7193 1.5431 1.1957 0.0386 -0.0638 -0.1720 370 ALA B CA 6047 C C . ALA B 371 ? 0.7104 1.5423 1.1905 -0.0010 -0.0483 -0.1765 370 ALA B C 6048 O O . ALA B 371 ? 0.7422 1.6292 1.2639 -0.0149 -0.0397 -0.1895 370 ALA B O 6049 C CB . ALA B 371 ? 0.7211 1.5559 1.1975 0.0502 -0.0932 -0.1712 370 ALA B CB 6050 N N . TYR B 372 ? 0.6969 1.4745 1.1344 -0.0194 -0.0446 -0.1658 371 TYR B N 6051 C CA . TYR B 372 ? 0.6800 1.4551 1.1150 -0.0562 -0.0301 -0.1684 371 TYR B CA 6052 C C . TYR B 372 ? 0.6819 1.4646 1.1274 -0.0669 -0.0025 -0.1714 371 TYR B C 6053 O O . TYR B 372 ? 0.6816 1.5019 1.1546 -0.0907 0.0099 -0.1808 371 TYR B O 6054 C CB . TYR B 372 ? 0.6698 1.3814 1.0551 -0.0690 -0.0321 -0.1562 371 TYR B CB 6055 C CG . TYR B 372 ? 0.6607 1.3682 1.0426 -0.1055 -0.0227 -0.1594 371 TYR B CG 6056 C CD1 . TYR B 372 ? 0.6589 1.3518 1.0343 -0.1254 0.0012 -0.1576 371 TYR B CD1 6057 C CD2 . TYR B 372 ? 0.6621 1.3780 1.0452 -0.1204 -0.0382 -0.1640 371 TYR B CD2 6058 C CE1 . TYR B 372 ? 0.6617 1.3466 1.0316 -0.1589 0.0094 -0.1595 371 TYR B CE1 6059 C CE2 . TYR B 372 ? 0.6691 1.3773 1.0478 -0.1541 -0.0300 -0.1672 371 TYR B CE2 6060 C CZ . TYR B 372 ? 0.6663 1.3580 1.0384 -0.1731 -0.0062 -0.1644 371 TYR B CZ 6061 O OH . TYR B 372 ? 0.6636 1.3434 1.0291 -0.2065 0.0014 -0.1665 371 TYR B OH 6062 N N . LEU B 373 ? 0.6895 1.4367 1.1122 -0.0498 0.0070 -0.1636 372 LEU B N 6063 C CA . LEU B 373 ? 0.6982 1.4501 1.1266 -0.0567 0.0323 -0.1664 372 LEU B CA 6064 C C . LEU B 373 ? 0.7040 1.5266 1.1852 -0.0510 0.0390 -0.1819 372 LEU B C 6065 O O . LEU B 373 ? 0.6902 1.5384 1.1884 -0.0717 0.0596 -0.1886 372 LEU B O 6066 C CB . LEU B 373 ? 0.7043 1.4080 1.1006 -0.0353 0.0379 -0.1569 372 LEU B CB 6067 C CG . LEU B 373 ? 0.7205 1.4202 1.1139 -0.0414 0.0637 -0.1589 372 LEU B CG 6068 C CD1 . LEU B 373 ? 0.7244 1.4029 1.0978 -0.0763 0.0795 -0.1548 372 LEU B CD1 6069 C CD2 . LEU B 373 ? 0.7277 1.3813 1.0912 -0.0179 0.0651 -0.1509 372 LEU B CD2 6070 N N . LYS B 374 ? 0.7227 1.5774 1.2298 -0.0223 0.0218 -0.1876 373 LYS B N 6071 C CA . LYS B 374 ? 0.7330 1.6596 1.2944 -0.0131 0.0257 -0.2035 373 LYS B CA 6072 C C . LYS B 374 ? 0.7343 1.7136 1.3308 -0.0453 0.0306 -0.2144 373 LYS B C 6073 O O . LYS B 374 ? 0.7295 1.7569 1.3607 -0.0554 0.0493 -0.2258 373 LYS B O 6074 C CB . LYS B 374 ? 0.7435 1.6937 1.3253 0.0229 0.0008 -0.2069 373 LYS B CB 6075 C CG . LYS B 374 ? 0.7476 1.7621 1.3806 0.0431 0.0062 -0.2224 373 LYS B CG 6076 C CD . LYS B 374 ? 0.7557 1.7946 1.4099 0.0790 -0.0210 -0.2257 373 LYS B CD 6077 C CE . LYS B 374 ? 0.7558 1.8691 1.4688 0.0965 -0.0162 -0.2437 373 LYS B CE 6078 N NZ . LYS B 374 ? 0.7644 1.8992 1.4973 0.1353 -0.0435 -0.2466 373 LYS B NZ 6079 N N . ARG B 375 ? 0.7414 1.7117 1.3283 -0.0615 0.0141 -0.2114 374 ARG B N 6080 C CA . ARG B 375 ? 0.7680 1.7788 1.3822 -0.0951 0.0164 -0.2207 374 ARG B CA 6081 C C . ARG B 375 ? 0.7595 1.7545 1.3612 -0.1297 0.0448 -0.2188 374 ARG B C 6082 O O . ARG B 375 ? 0.7773 1.8231 1.4153 -0.1521 0.0586 -0.2299 374 ARG B O 6083 C CB . ARG B 375 ? 0.7988 1.7887 1.3942 -0.1045 -0.0073 -0.2167 374 ARG B CB 6084 C CG . ARG B 375 ? 0.8417 1.8915 1.4792 -0.1265 -0.0166 -0.2306 374 ARG B CG 6085 C CD . ARG B 375 ? 0.8657 1.8894 1.4795 -0.1383 -0.0386 -0.2274 374 ARG B CD 6086 N NE . ARG B 375 ? 0.8908 1.8483 1.4562 -0.1624 -0.0280 -0.2163 374 ARG B NE 6087 C CZ . ARG B 375 ? 0.9099 1.8388 1.4511 -0.1800 -0.0407 -0.2143 374 ARG B CZ 6088 N NH1 . ARG B 375 ? 0.9059 1.7742 1.4043 -0.1987 -0.0296 -0.2044 374 ARG B NH1 6089 N NH2 . ARG B 375 ? 0.9111 1.8714 1.4702 -0.1784 -0.0649 -0.2228 374 ARG B NH2 6090 N N . VAL B 376 ? 0.7458 1.6711 1.2961 -0.1339 0.0530 -0.2046 375 VAL B N 6091 C CA . VAL B 376 ? 0.7401 1.6417 1.2710 -0.1640 0.0785 -0.2006 375 VAL B CA 6092 C C . VAL B 376 ? 0.7376 1.6760 1.2934 -0.1609 0.1028 -0.2083 375 VAL B C 6093 O O . VAL B 376 ? 0.7426 1.7068 1.3138 -0.1894 0.1224 -0.2136 375 VAL B O 6094 C CB . VAL B 376 ? 0.7390 1.5598 1.2107 -0.1636 0.0810 -0.1840 375 VAL B CB 6095 C CG1 . VAL B 376 ? 0.7471 1.5442 1.1983 -0.1892 0.1074 -0.1795 375 VAL B CG1 6096 C CG2 . VAL B 376 ? 0.7366 1.5207 1.1822 -0.1723 0.0616 -0.1773 375 VAL B CG2 6097 N N . LEU B 377 ? 0.7359 1.6762 1.2947 -0.1264 0.1015 -0.2092 376 LEU B N 6098 C CA . LEU B 377 ? 0.7528 1.7194 1.3280 -0.1195 0.1249 -0.2164 376 LEU B CA 6099 C C . LEU B 377 ? 0.7802 1.8316 1.4173 -0.1165 0.1295 -0.2344 376 LEU B C 6100 O O . LEU B 377 ? 0.7829 1.8661 1.4376 -0.1324 0.1545 -0.2418 376 LEU B O 6101 C CB . LEU B 377 ? 0.7372 1.6669 1.2882 -0.0839 0.1223 -0.2109 376 LEU B CB 6102 C CG . LEU B 377 ? 0.7255 1.5738 1.2168 -0.0861 0.1213 -0.1939 376 LEU B CG 6103 C CD1 . LEU B 377 ? 0.7330 1.5510 1.2064 -0.0508 0.1169 -0.1902 376 LEU B CD1 6104 C CD2 . LEU B 377 ? 0.7252 1.5480 1.1903 -0.1168 0.1455 -0.1888 376 LEU B CD2 6105 N N . LEU B 378 ? 0.8130 1.9015 1.4823 -0.0951 0.1058 -0.2414 377 LEU B N 6106 C CA . LEU B 378 ? 0.8444 2.0164 1.5761 -0.0841 0.1064 -0.2593 377 LEU B CA 6107 C C . LEU B 378 ? 0.8936 2.1198 1.6642 -0.1117 0.0987 -0.2686 377 LEU B C 6108 O O . LEU B 378 ? 0.8984 2.2008 1.7249 -0.1107 0.1033 -0.2847 377 LEU B O 6109 C CB . LEU B 378 ? 0.8329 2.0152 1.5787 -0.0377 0.0846 -0.2624 377 LEU B CB 6110 C CG . LEU B 378 ? 0.8203 1.9926 1.5610 -0.0071 0.0977 -0.2646 377 LEU B CG 6111 C CD1 . LEU B 378 ? 0.8232 1.9242 1.5079 -0.0181 0.1162 -0.2515 377 LEU B CD1 6112 C CD2 . LEU B 378 ? 0.8144 1.9772 1.5562 0.0370 0.0721 -0.2632 377 LEU B CD2 6113 N N . GLY B 379 ? 0.9617 2.1511 1.7048 -0.1358 0.0878 -0.2599 378 GLY B N 6114 C CA . GLY B 379 ? 1.0273 2.2577 1.7993 -0.1717 0.0874 -0.2680 378 GLY B CA 6115 C C . GLY B 379 ? 1.0960 2.3712 1.9031 -0.1631 0.0586 -0.2771 378 GLY B C 6116 O O . GLY B 379 ? 1.0922 2.4051 1.9264 -0.1952 0.0582 -0.2855 378 GLY B O 6117 N N . PRO B 380 ? 1.1776 2.4513 1.9856 -0.1227 0.0336 -0.2761 379 PRO B N 6118 C CA . PRO B 380 ? 1.2029 2.5291 2.0495 -0.1123 0.0046 -0.2864 379 PRO B CA 6119 C C . PRO B 380 ? 1.2136 2.5100 2.0351 -0.1340 -0.0156 -0.2813 379 PRO B C 6120 O O . PRO B 380 ? 1.2038 2.4296 1.9724 -0.1484 -0.0109 -0.2677 379 PRO B O 6121 C CB . PRO B 380 ? 1.2172 2.5342 2.0592 -0.0626 -0.0145 -0.2831 379 PRO B CB 6122 C CG . PRO B 380 ? 1.2061 2.4759 2.0159 -0.0483 0.0066 -0.2740 379 PRO B CG 6123 C CD . PRO B 380 ? 1.1881 2.4103 1.9603 -0.0858 0.0292 -0.2650 379 PRO B CD 6124 C C1 . NAG C . ? 1.0662 1.1057 0.7999 0.0106 -0.2244 0.0769 401 NAG A C1 6125 C C2 . NAG C . ? 1.0786 1.1422 0.8230 0.0288 -0.2296 0.0986 401 NAG A C2 6126 C C3 . NAG C . ? 1.1123 1.2140 0.8487 0.0184 -0.2498 0.1084 401 NAG A C3 6127 C C4 . NAG C . ? 1.1405 1.2262 0.8381 -0.0043 -0.2562 0.0931 401 NAG A C4 6128 C C5 . NAG C . ? 1.1379 1.1941 0.8287 -0.0200 -0.2470 0.0705 401 NAG A C5 6129 C C6 . NAG C . ? 1.1617 1.1954 0.8121 -0.0411 -0.2496 0.0544 401 NAG A C6 6130 C C7 . NAG C . ? 1.0817 1.1541 0.8749 0.0665 -0.2130 0.1207 401 NAG A C7 6131 C C8 . NAG C . ? 1.0620 1.1506 0.8923 0.0795 -0.2058 0.1284 401 NAG A C8 6132 N N2 . NAG C . ? 1.0740 1.1539 0.8555 0.0440 -0.2235 0.1084 401 NAG A N2 6133 O O3 . NAG C . ? 1.1160 1.2284 0.8524 0.0369 -0.2519 0.1281 401 NAG A O3 6134 O O4 . NAG C . ? 1.1560 1.2826 0.8506 -0.0194 -0.2759 0.0992 401 NAG A O4 6135 O O5 . NAG C . ? 1.1001 1.1225 0.7976 -0.0049 -0.2287 0.0662 401 NAG A O5 6136 O O6 . NAG C . ? 1.1599 1.1523 0.7878 -0.0326 -0.2361 0.0485 401 NAG A O6 6137 O O7 . NAG C . ? 1.0884 1.1406 0.8631 0.0762 -0.2083 0.1255 401 NAG A O7 6138 C C1 . NAG D . ? 1.3980 0.9700 1.1033 0.0545 0.0576 -0.0104 402 NAG A C1 6139 C C2 . NAG D . ? 1.4831 1.0249 1.1792 0.0437 0.0664 -0.0146 402 NAG A C2 6140 C C3 . NAG D . ? 1.5078 1.0276 1.1815 0.0251 0.0635 -0.0309 402 NAG A C3 6141 C C4 . NAG D . ? 1.4857 1.0370 1.1645 0.0153 0.0421 -0.0360 402 NAG A C4 6142 C C5 . NAG D . ? 1.4383 1.0190 1.1285 0.0288 0.0345 -0.0296 402 NAG A C5 6143 C C6 . NAG D . ? 1.3931 1.0042 1.0914 0.0207 0.0151 -0.0324 402 NAG A C6 6144 C C7 . NAG D . ? 1.5469 1.0638 1.2533 0.0633 0.0935 0.0053 402 NAG A C7 6145 C C8 . NAG D . ? 1.5298 1.0708 1.2505 0.0550 0.0810 0.0079 402 NAG A C8 6146 N N2 . NAG D . ? 1.5332 1.0509 1.2282 0.0571 0.0864 -0.0057 402 NAG A N2 6147 O O3 . NAG D . ? 1.5291 1.0254 1.1961 0.0120 0.0698 -0.0353 402 NAG A O3 6148 O O4 . NAG D . ? 1.5290 1.0648 1.1864 -0.0007 0.0381 -0.0496 402 NAG A O4 6149 O O5 . NAG D . ? 1.4290 1.0252 1.1377 0.0444 0.0395 -0.0164 402 NAG A O5 6150 O O6 . NAG D . ? 1.2984 0.9334 1.0063 0.0319 0.0097 -0.0270 402 NAG A O6 6151 O O7 . NAG D . ? 1.5741 1.0705 1.2795 0.0765 0.1112 0.0143 402 NAG A O7 6152 C C1 . NAG E . ? 1.1023 0.9852 0.9525 0.0694 0.0223 0.1004 403 NAG A C1 6153 C C2 . NAG E . ? 1.1207 1.0274 0.9667 0.0773 0.0227 0.1133 403 NAG A C2 6154 C C3 . NAG E . ? 1.0786 0.9735 0.9231 0.0857 0.0324 0.1299 403 NAG A C3 6155 C C4 . NAG E . ? 1.0964 0.9733 0.9428 0.0785 0.0391 0.1298 403 NAG A C4 6156 C C5 . NAG E . ? 1.0827 0.9379 0.9334 0.0686 0.0375 0.1143 403 NAG A C5 6157 C C6 . NAG E . ? 1.0407 0.8813 0.8952 0.0587 0.0432 0.1125 403 NAG A C6 6158 C C7 . NAG E . ? 1.2205 1.1592 1.0627 0.0901 0.0161 0.1215 403 NAG A C7 6159 C C8 . NAG E . ? 1.2198 1.1732 1.0616 0.0902 0.0092 0.1146 403 NAG A C8 6160 N N2 . NAG E . ? 1.1584 1.0802 1.0026 0.0811 0.0163 0.1103 403 NAG A N2 6161 O O3 . NAG E . ? 1.0457 0.9665 0.8867 0.0918 0.0322 0.1434 403 NAG A O3 6162 O O4 . NAG E . ? 1.1076 0.9701 0.9514 0.0868 0.0497 0.1457 403 NAG A O4 6163 O O5 . NAG E . ? 1.1359 1.0086 0.9893 0.0630 0.0277 0.1018 403 NAG A O5 6164 O O6 . NAG E . ? 0.9658 0.7762 0.8177 0.0592 0.0532 0.1175 403 NAG A O6 6165 O O7 . NAG E . ? 1.2792 1.2233 1.1206 0.0984 0.0214 0.1376 403 NAG A O7 6166 C C1 . NAG F . ? 0.8815 1.2656 0.7821 -0.0773 0.0005 0.0311 404 NAG A C1 6167 C C2 . NAG F . ? 0.9061 1.3031 0.7942 -0.0954 -0.0079 0.0240 404 NAG A C2 6168 C C3 . NAG F . ? 0.8913 1.3498 0.7976 -0.0924 -0.0177 0.0406 404 NAG A C3 6169 C C4 . NAG F . ? 0.8590 1.3208 0.7833 -0.0605 -0.0174 0.0602 404 NAG A C4 6170 C C5 . NAG F . ? 0.8605 1.3011 0.7945 -0.0440 -0.0069 0.0640 404 NAG A C5 6171 C C6 . NAG F . ? 0.8475 1.2811 0.7946 -0.0130 -0.0044 0.0810 404 NAG A C6 6172 C C7 . NAG F . ? 0.9719 1.3278 0.8214 -0.1392 -0.0025 -0.0098 404 NAG A C7 6173 C C8 . NAG F . ? 0.9870 1.3452 0.8237 -0.1703 0.0024 -0.0255 404 NAG A C8 6174 N N2 . NAG F . ? 0.9425 1.3393 0.8168 -0.1251 -0.0052 0.0075 404 NAG A N2 6175 O O3 . NAG F . ? 0.9168 1.3762 0.8076 -0.1049 -0.0249 0.0340 404 NAG A O3 6176 O O4 . NAG F . ? 0.8370 1.3623 0.7820 -0.0577 -0.0246 0.0782 404 NAG A O4 6177 O O5 . NAG F . ? 0.8702 1.2531 0.7834 -0.0494 -0.0002 0.0467 404 NAG A O5 6178 O O6 . NAG F . ? 0.8750 1.2982 0.8325 0.0007 0.0060 0.0857 404 NAG A O6 6179 O O7 . NAG F . ? 0.9650 1.2827 0.8024 -0.1285 -0.0030 -0.0132 404 NAG A O7 6180 N N1 . EPE G . ? 1.3047 0.7487 0.9537 0.1855 0.1472 0.1006 405 EPE A N1 6181 C C2 . EPE G . ? 1.3850 0.7895 1.0287 0.1983 0.1727 0.1099 405 EPE A C2 6182 C C3 . EPE G . ? 1.4452 0.8274 1.0703 0.2045 0.1780 0.1236 405 EPE A C3 6183 N N4 . EPE G . ? 1.4724 0.8428 1.0781 0.1819 0.1794 0.1075 405 EPE A N4 6184 C C5 . EPE G . ? 1.3871 0.7972 0.9987 0.1694 0.1548 0.0974 405 EPE A C5 6185 C C6 . EPE G . ? 1.3351 0.7675 0.9656 0.1644 0.1491 0.0852 405 EPE A C6 6186 C C7 . EPE G . ? 1.5977 0.9452 1.1845 0.1874 0.1859 0.1207 405 EPE A C7 6187 C C8 . EPE G . ? 1.6896 0.9850 1.2607 0.1834 0.2167 0.1166 405 EPE A C8 6188 O O8 . EPE G . ? 1.7315 1.0197 1.2933 0.1563 0.2219 0.0922 405 EPE A O8 6189 C C9 . EPE G . ? 1.2227 0.6900 0.8900 0.1810 0.1411 0.0898 405 EPE A C9 6190 C C10 . EPE G . ? 1.1740 0.6690 0.8632 0.2011 0.1299 0.1071 405 EPE A C10 6191 S S . EPE G . ? 1.0945 0.6198 0.8048 0.1957 0.1205 0.0962 405 EPE A S 6192 O O1S . EPE G . ? 1.0535 0.6158 0.7685 0.1865 0.0950 0.0922 405 EPE A O1S 6193 O O2S . EPE G . ? 1.1053 0.6409 0.8363 0.2164 0.1238 0.1119 405 EPE A O2S 6194 O O3S . EPE G . ? 1.0948 0.5999 0.7983 0.1798 0.1358 0.0760 405 EPE A O3S 6195 C C1 . NAG H . ? 1.1965 0.8730 0.7438 -0.0855 -0.0570 0.0349 401 NAG B C1 6196 C C2 . NAG H . ? 1.2120 0.8921 0.7511 -0.0853 -0.0659 0.0279 401 NAG B C2 6197 C C3 . NAG H . ? 1.2548 0.9136 0.7579 -0.0829 -0.0815 0.0331 401 NAG B C3 6198 C C4 . NAG H . ? 1.2892 0.9221 0.7544 -0.0887 -0.0736 0.0427 401 NAG B C4 6199 C C5 . NAG H . ? 1.3078 0.9387 0.7883 -0.0885 -0.0656 0.0492 401 NAG B C5 6200 C C6 . NAG H . ? 1.3513 0.9549 0.7954 -0.0964 -0.0575 0.0595 401 NAG B C6 6201 C C7 . NAG H . ? 1.2156 0.9338 0.8120 -0.0827 -0.0679 0.0134 401 NAG B C7 6202 C C8 . NAG H . ? 1.1825 0.9217 0.8142 -0.0787 -0.0769 0.0088 401 NAG B C8 6203 N N2 . NAG H . ? 1.2161 0.9178 0.7910 -0.0797 -0.0746 0.0218 401 NAG B N2 6204 O O3 . NAG H . ? 1.2593 0.9197 0.7494 -0.0852 -0.0870 0.0254 401 NAG B O3 6205 O O4 . NAG H . ? 1.3106 0.9220 0.7438 -0.0844 -0.0908 0.0493 401 NAG B O4 6206 O O5 . NAG H . ? 1.2635 0.9171 0.7762 -0.0918 -0.0504 0.0426 401 NAG B O5 6207 O O6 . NAG H . ? 1.3652 0.9727 0.7981 -0.1077 -0.0380 0.0564 401 NAG B O6 6208 O O7 . NAG H . ? 1.2497 0.9666 0.8381 -0.0884 -0.0546 0.0094 401 NAG B O7 6209 C C1 . NAG I . ? 1.3479 0.9729 1.0537 -0.1754 0.0104 -0.0211 402 NAG B C1 6210 C C2 . NAG I . ? 1.4434 1.0177 1.1257 -0.1808 0.0053 -0.0207 402 NAG B C2 6211 C C3 . NAG I . ? 1.4572 1.0062 1.1211 -0.1880 0.0078 -0.0075 402 NAG B C3 6212 C C4 . NAG I . ? 1.3994 0.9594 1.0655 -0.1689 0.0062 -0.0008 402 NAG B C4 6213 C C5 . NAG I . ? 1.3466 0.9579 1.0380 -0.1651 0.0119 -0.0034 402 NAG B C5 6214 C C6 . NAG I . ? 1.3127 0.9370 1.0083 -0.1480 0.0105 0.0019 402 NAG B C6 6215 C C7 . NAG I . ? 1.5176 1.0807 1.2010 -0.1960 0.0001 -0.0408 402 NAG B C7 6216 C C8 . NAG I . ? 1.5051 1.0616 1.1867 -0.1712 -0.0062 -0.0466 402 NAG B C8 6217 N N2 . NAG I . ? 1.4949 1.0660 1.1784 -0.1993 0.0059 -0.0288 402 NAG B N2 6218 O O3 . NAG I . ? 1.5232 1.0204 1.1621 -0.1920 0.0023 -0.0053 402 NAG B O3 6219 O O4 . NAG I . ? 1.3675 0.9059 1.0148 -0.1751 0.0079 0.0111 402 NAG B O4 6220 O O5 . NAG I . ? 1.3428 0.9738 1.0495 -0.1591 0.0098 -0.0144 402 NAG B O5 6221 O O6 . NAG I . ? 1.1872 0.8544 0.9044 -0.1468 0.0160 -0.0005 402 NAG B O6 6222 O O7 . NAG I . ? 1.4940 1.0559 1.1788 -0.2134 0.0002 -0.0479 402 NAG B O7 6223 C C1 . NAG J . ? 1.0087 0.8710 0.7795 0.0129 0.0401 -0.1070 403 NAG B C1 6224 C C2 . NAG J . ? 1.0083 0.8826 0.7654 0.0166 0.0468 -0.1174 403 NAG B C2 6225 C C3 . NAG J . ? 1.0222 0.8714 0.7651 0.0234 0.0429 -0.1337 403 NAG B C3 6226 C C4 . NAG J . ? 0.9986 0.8388 0.7532 0.0384 0.0431 -0.1392 403 NAG B C4 6227 C C5 . NAG J . ? 1.0354 0.8667 0.8041 0.0341 0.0364 -0.1261 403 NAG B C5 6228 C C6 . NAG J . ? 1.0496 0.8712 0.8310 0.0487 0.0335 -0.1286 403 NAG B C6 6229 C C7 . NAG J . ? 1.0038 0.9088 0.7418 0.0053 0.0539 -0.1117 403 NAG B C7 6230 C C8 . NAG J . ? 1.0513 0.9744 0.7919 0.0162 0.0659 -0.1173 403 NAG B C8 6231 N N2 . NAG J . ? 0.9934 0.8776 0.7397 0.0052 0.0465 -0.1121 403 NAG B N2 6232 O O3 . NAG J . ? 1.0475 0.9052 0.7740 0.0264 0.0484 -0.1448 403 NAG B O3 6233 O O4 . NAG J . ? 0.9543 0.7657 0.6946 0.0446 0.0382 -0.1538 403 NAG B O4 6234 O O5 . NAG J . ? 1.0517 0.9087 0.8326 0.0266 0.0405 -0.1124 403 NAG B O5 6235 O O6 . NAG J . ? 1.0234 0.8184 0.8032 0.0421 0.0235 -0.1203 403 NAG B O6 6236 O O7 . NAG J . ? 0.9895 0.8994 0.7176 -0.0036 0.0509 -0.1067 403 NAG B O7 6237 C C1 . NAG K . ? 0.9642 1.3970 1.1024 0.0896 -0.1373 -0.0663 404 NAG B C1 6238 C C2 . NAG K . ? 0.9958 1.3864 1.0905 0.0993 -0.1481 -0.0521 404 NAG B C2 6239 C C3 . NAG K . ? 1.0314 1.4358 1.1161 0.0932 -0.1655 -0.0548 404 NAG B C3 6240 C C4 . NAG K . ? 1.0187 1.4398 1.1145 0.0647 -0.1573 -0.0660 404 NAG B C4 6241 C C5 . NAG K . ? 0.9898 1.4507 1.1301 0.0559 -0.1463 -0.0786 404 NAG B C5 6242 C C6 . NAG K . ? 0.9788 1.4496 1.1263 0.0259 -0.1373 -0.0880 404 NAG B C6 6243 C C7 . NAG K . ? 1.0406 1.3787 1.1095 0.1366 -0.1490 -0.0332 404 NAG B C7 6244 C C8 . NAG K . ? 1.0698 1.3997 1.1378 0.1663 -0.1610 -0.0268 404 NAG B C8 6245 N N2 . NAG K . ? 1.0190 1.4003 1.1110 0.1274 -0.1573 -0.0447 404 NAG B N2 6246 O O3 . NAG K . ? 1.0574 1.4188 1.0971 0.0967 -0.1702 -0.0416 404 NAG B O3 6247 O O4 . NAG K . ? 1.0396 1.4796 1.1314 0.0605 -0.1752 -0.0714 404 NAG B O4 6248 O O5 . NAG K . ? 0.9747 1.4166 1.1166 0.0618 -0.1293 -0.0737 404 NAG B O5 6249 O O6 . NAG K . ? 0.9867 1.4957 1.1746 0.0171 -0.1269 -0.0989 404 NAG B O6 6250 O O7 . NAG K . ? 1.0301 1.3350 1.0790 0.1224 -0.1331 -0.0279 404 NAG B O7 6251 N N1 . EPE L . ? 1.5989 1.2076 1.3262 0.0002 0.0451 -0.0850 405 EPE B N1 6252 C C2 . EPE L . ? 1.6372 1.2072 1.3497 -0.0047 0.0390 -0.0916 405 EPE B C2 6253 C C3 . EPE L . ? 1.6662 1.2215 1.3641 0.0073 0.0437 -0.1092 405 EPE B C3 6254 N N4 . EPE L . ? 1.6674 1.2240 1.3745 0.0286 0.0487 -0.1113 405 EPE B N4 6255 C C5 . EPE L . ? 1.6547 1.2533 1.3796 0.0334 0.0548 -0.1042 405 EPE B C5 6256 C C6 . EPE L . ? 1.6320 1.2446 1.3684 0.0200 0.0497 -0.0869 405 EPE B C6 6257 C C7 . EPE L . ? 1.6783 1.2225 1.3727 0.0420 0.0543 -0.1296 405 EPE B C7 6258 C C8 . EPE L . ? 1.7134 1.2088 1.3907 0.0408 0.0472 -0.1373 405 EPE B C8 6259 O O8 . EPE L . ? 1.7536 1.2337 1.4233 0.0608 0.0525 -0.1535 405 EPE B O8 6260 C C9 . EPE L . ? 1.5917 1.2131 1.3313 -0.0104 0.0407 -0.0694 405 EPE B C9 6261 C C10 . EPE L . ? 1.6076 1.2443 1.3446 -0.0268 0.0385 -0.0674 405 EPE B C10 6262 S S . EPE L . ? 1.6426 1.2788 1.3892 -0.0412 0.0314 -0.0539 405 EPE B S 6263 O O1S . EPE L . ? 1.5420 1.2061 1.2946 -0.0502 0.0310 -0.0486 405 EPE B O1S 6264 O O2S . EPE L . ? 1.7252 1.3617 1.4831 -0.0343 0.0322 -0.0433 405 EPE B O2S 6265 O O3S . EPE L . ? 1.5886 1.1963 1.3259 -0.0521 0.0247 -0.0578 405 EPE B O3S 6266 C C1 . PEG M . ? 1.1629 1.1834 1.0704 -0.0747 0.0353 -0.0129 406 PEG B C1 6267 O O1 . PEG M . ? 1.1761 1.2173 1.0990 -0.0741 0.0390 -0.0170 406 PEG B O1 6268 C C2 . PEG M . ? 1.1694 1.1710 1.0667 -0.0665 0.0364 -0.0066 406 PEG B C2 6269 O O2 . PEG M . ? 1.1489 1.1308 1.0330 -0.0706 0.0362 -0.0039 406 PEG B O2 6270 C C3 . PEG M . ? 1.1098 1.0777 0.9864 -0.0639 0.0360 0.0015 406 PEG B C3 6271 C C4 . PEG M . ? 1.0445 1.0005 0.9176 -0.0657 0.0410 0.0028 406 PEG B C4 6272 O O4 . PEG M . ? 0.9915 0.9423 0.8640 -0.0577 0.0408 0.0063 406 PEG B O4 6273 O O1 . PE8 N . ? 1.1523 1.2215 0.8848 -0.0365 -0.0736 -0.0402 407 PE8 B O1 6274 C C2 . PE8 N . ? 1.1355 1.2162 0.8868 -0.0294 -0.0773 -0.0315 407 PE8 B C2 6275 C C3 . PE8 N . ? 1.1289 1.2333 0.9101 -0.0356 -0.0853 -0.0410 407 PE8 B C3 6276 O O4 . PE8 N . ? 1.1709 1.2969 0.9533 -0.0283 -0.1019 -0.0419 407 PE8 B O4 6277 C C5 . PE8 N . ? 1.1852 1.3169 0.9762 -0.0150 -0.1049 -0.0306 407 PE8 B C5 6278 C C6 . PE8 N . ? 1.2326 1.3745 1.0072 -0.0027 -0.1222 -0.0269 407 PE8 B C6 6279 O O7 . PE8 N . ? 1.2505 1.3793 1.0153 0.0116 -0.1213 -0.0115 407 PE8 B O7 6280 C C8 . PE8 N . ? 1.2752 1.3789 1.0019 0.0151 -0.1177 -0.0017 407 PE8 B C8 6281 C C9 . PE8 N . ? 1.2539 1.3376 0.9740 0.0255 -0.1114 0.0146 407 PE8 B C9 6282 O O10 . PE8 N . ? 1.2209 1.2784 0.9086 0.0231 -0.1009 0.0233 407 PE8 B O10 6283 C C11 . PE8 N . ? 1.2048 1.2414 0.8936 0.0244 -0.0876 0.0346 407 PE8 B C11 6284 C C12 . PE8 N . ? 1.1845 1.2103 0.8725 0.0117 -0.0701 0.0306 407 PE8 B C12 6285 O O13 . PE8 N . ? 1.1664 1.1730 0.8556 0.0116 -0.0575 0.0410 407 PE8 B O13 6286 C C14 . PE8 N . ? 1.2069 1.2175 0.9272 0.0101 -0.0529 0.0380 407 PE8 B C14 6287 C C15 . PE8 N . ? 1.2385 1.2275 0.9564 0.0084 -0.0399 0.0480 407 PE8 B C15 6288 O O16 . PE8 N . ? 1.3116 1.2893 1.0075 0.0019 -0.0303 0.0507 407 PE8 B O16 6289 C C17 . PE8 N . ? 1.3310 1.2880 1.0093 0.0033 -0.0239 0.0648 407 PE8 B C17 6290 C C18 . PE8 N . ? 1.3168 1.2675 0.9765 -0.0050 -0.0115 0.0655 407 PE8 B C18 6291 O O19 . PE8 N . ? 1.3281 1.2606 0.9623 -0.0038 -0.0080 0.0803 407 PE8 B O19 6292 C C20 . PE8 N . ? 1.3173 1.2474 0.9289 -0.0104 0.0023 0.0814 407 PE8 B C20 6293 C C21 . PE8 N . ? 1.3472 1.2588 0.9257 -0.0082 0.0020 0.0977 407 PE8 B C21 6294 O O22 . PE8 N . ? 1.3695 1.2785 0.9405 0.0032 -0.0151 0.1024 407 PE8 B O22 6295 C C23 . PE8 N . ? 1.4088 1.2964 0.9470 0.0069 -0.0178 0.1191 407 PE8 B C23 6296 C C24 . PE8 N . ? 1.4156 1.2820 0.9631 0.0095 -0.0172 0.1304 407 PE8 B C24 6297 O O25 . PE8 N . ? 1.4357 1.2887 0.9788 -0.0029 0.0002 0.1370 407 PE8 B O25 # 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 GLY 1 0 ? ? ? A . n A 1 2 ALA 2 1 ? ? ? A . n A 1 3 GLY 3 2 ? ? ? A . n A 1 4 ARG 4 3 ? ? ? A . n A 1 5 HIS 5 4 4 HIS HIS A . n A 1 6 PRO 6 5 5 PRO PRO A . n A 1 7 PRO 7 6 6 PRO PRO A . n A 1 8 VAL 8 7 7 VAL VAL A . n A 1 9 VAL 9 8 8 VAL VAL A . n A 1 10 LEU 10 9 9 LEU LEU A . n A 1 11 VAL 11 10 10 VAL VAL A . n A 1 12 PRO 12 11 11 PRO PRO A . n A 1 13 GLY 13 12 12 GLY GLY A . n A 1 14 ASP 14 13 13 ASP ASP A . n A 1 15 LEU 15 14 14 LEU LEU A . n A 1 16 GLY 16 15 15 GLY GLY A . n A 1 17 ASN 17 16 16 ASN ASN A . n A 1 18 GLN 18 17 17 GLN GLN A . n A 1 19 LEU 19 18 18 LEU LEU A . n A 1 20 GLU 20 19 19 GLU GLU A . n A 1 21 ALA 21 20 20 ALA ALA A . n A 1 22 LYS 22 21 21 LYS LYS A . n A 1 23 LEU 23 22 22 LEU LEU A . n A 1 24 ASP 24 23 23 ASP ASP A . n A 1 25 LYS 25 24 24 LYS LYS A . n A 1 26 PRO 26 25 25 PRO PRO A . n A 1 27 THR 27 26 26 THR THR A . n A 1 28 VAL 28 27 27 VAL VAL A . n A 1 29 VAL 29 28 28 VAL VAL A . n A 1 30 HIS 30 29 29 HIS HIS A . n A 1 31 TYR 31 30 30 TYR TYR A . n A 1 32 LEU 32 31 31 LEU LEU A . n A 1 33 CYS 33 32 32 CYS CYS A . n A 1 34 SER 34 33 33 SER SER A . n A 1 35 LYS 35 34 34 LYS LYS A . n A 1 36 LYS 36 35 35 LYS LYS A . n A 1 37 THR 37 36 36 THR THR A . n A 1 38 GLU 38 37 37 GLU GLU A . n A 1 39 SER 39 38 38 SER SER A . n A 1 40 TYR 40 39 39 TYR TYR A . n A 1 41 PHE 41 40 40 PHE PHE A . n A 1 42 THR 42 41 41 THR THR A . n A 1 43 ILE 43 42 42 ILE ILE A . n A 1 44 TRP 44 43 43 TRP TRP A . n A 1 45 LEU 45 44 44 LEU LEU A . n A 1 46 ASN 46 45 45 ASN ASN A . n A 1 47 LEU 47 46 46 LEU LEU A . n A 1 48 GLU 48 47 47 GLU GLU A . n A 1 49 LEU 49 48 48 LEU LEU A . n A 1 50 LEU 50 49 49 LEU LEU A . n A 1 51 LEU 51 50 50 LEU LEU A . n A 1 52 PRO 52 51 51 PRO PRO A . n A 1 53 VAL 53 52 52 VAL VAL A . n A 1 54 ILE 54 53 53 ILE ILE A . n A 1 55 ILE 55 54 54 ILE ILE A . n A 1 56 ASP 56 55 55 ASP ASP A . n A 1 57 CYS 57 56 56 CYS CYS A . n A 1 58 TRP 58 57 57 TRP TRP A . n A 1 59 ILE 59 58 58 ILE ILE A . n A 1 60 ASP 60 59 59 ASP ASP A . n A 1 61 ASN 61 60 60 ASN ASN A . n A 1 62 ILE 62 61 61 ILE ILE A . n A 1 63 ARG 63 62 62 ARG ARG A . n A 1 64 LEU 64 63 63 LEU LEU A . n A 1 65 VAL 65 64 64 VAL VAL A . n A 1 66 TYR 66 65 65 TYR TYR A . n A 1 67 ASN 67 66 66 ASN ASN A . n A 1 68 LYS 68 67 67 LYS LYS A . n A 1 69 THR 69 68 68 THR THR A . n A 1 70 SER 70 69 69 SER SER A . n A 1 71 ARG 71 70 70 ARG ARG A . n A 1 72 ALA 72 71 71 ALA ALA A . n A 1 73 THR 73 72 72 THR THR A . n A 1 74 GLN 74 73 73 GLN GLN A . n A 1 75 PHE 75 74 74 PHE PHE A . n A 1 76 PRO 76 75 75 PRO PRO A . n A 1 77 ASP 77 76 76 ASP ASP A . n A 1 78 GLY 78 77 77 GLY GLY A . n A 1 79 VAL 79 78 78 VAL VAL A . n A 1 80 ASP 80 79 79 ASP ASP A . n A 1 81 VAL 81 80 80 VAL VAL A . n A 1 82 ARG 82 81 81 ARG ARG A . n A 1 83 VAL 83 82 82 VAL VAL A . n A 1 84 PRO 84 83 83 PRO PRO A . n A 1 85 GLY 85 84 84 GLY GLY A . n A 1 86 PHE 86 85 85 PHE PHE A . n A 1 87 GLY 87 86 86 GLY GLY A . n A 1 88 LYS 88 87 87 LYS LYS A . n A 1 89 THR 89 88 88 THR THR A . n A 1 90 PHE 90 89 89 PHE PHE A . n A 1 91 SER 91 90 90 SER SER A . n A 1 92 LEU 92 91 91 LEU LEU A . n A 1 93 GLU 93 92 92 GLU GLU A . n A 1 94 PHE 94 93 93 PHE PHE A . n A 1 95 LEU 95 94 94 LEU LEU A . n A 1 96 ASP 96 95 95 ASP ASP A . n A 1 97 PRO 97 96 96 PRO PRO A . n A 1 98 SER 98 97 97 SER SER A . n A 1 99 LYS 99 98 98 LYS LYS A . n A 1 100 SER 100 99 99 SER SER A . n A 1 101 SER 101 100 100 SER SER A . n A 1 102 VAL 102 101 101 VAL VAL A . n A 1 103 GLY 103 102 102 GLY GLY A . n A 1 104 SER 104 103 103 SER SER A . n A 1 105 TYR 105 104 104 TYR TYR A . n A 1 106 PHE 106 105 105 PHE PHE A . n A 1 107 HIS 107 106 106 HIS HIS A . n A 1 108 THR 108 107 107 THR THR A . n A 1 109 MET 109 108 108 MET MET A . n A 1 110 VAL 110 109 109 VAL VAL A . n A 1 111 GLU 111 110 110 GLU GLU A . n A 1 112 SER 112 111 111 SER SER A . n A 1 113 LEU 113 112 112 LEU LEU A . n A 1 114 VAL 114 113 113 VAL VAL A . n A 1 115 GLY 115 114 114 GLY GLY A . n A 1 116 TRP 116 115 115 TRP TRP A . n A 1 117 GLY 117 116 116 GLY GLY A . n A 1 118 TYR 118 117 117 TYR TYR A . n A 1 119 THR 119 118 118 THR THR A . n A 1 120 ARG 120 119 119 ARG ARG A . n A 1 121 GLY 121 120 120 GLY GLY A . n A 1 122 GLU 122 121 121 GLU GLU A . n A 1 123 ASP 123 122 122 ASP ASP A . n A 1 124 VAL 124 123 123 VAL VAL A . n A 1 125 ARG 125 124 124 ARG ARG A . n A 1 126 GLY 126 125 125 GLY GLY A . n A 1 127 ALA 127 126 126 ALA ALA A . n A 1 128 PRO 128 127 127 PRO PRO A . n A 1 129 TYR 129 128 128 TYR TYR A . n A 1 130 ASP 130 129 129 ASP ASP A . n A 1 131 TRP 131 130 130 TRP TRP A . n A 1 132 ARG 132 131 131 ARG ARG A . n A 1 133 ARG 133 132 132 ARG ARG A . n A 1 134 ALA 134 133 133 ALA ALA A . n A 1 135 PRO 135 134 134 PRO PRO A . n A 1 136 ASN 136 135 135 ASN ASN A . n A 1 137 GLU 137 136 136 GLU GLU A . n A 1 138 ASN 138 137 137 ASN ASN A . n A 1 139 GLY 139 138 138 GLY GLY A . n A 1 140 PRO 140 139 139 PRO PRO A . n A 1 141 TYR 141 140 140 TYR TYR A . n A 1 142 PHE 142 141 141 PHE PHE A . n A 1 143 LEU 143 142 142 LEU LEU A . n A 1 144 ALA 144 143 143 ALA ALA A . n A 1 145 LEU 145 144 144 LEU LEU A . n A 1 146 ARG 146 145 145 ARG ARG A . n A 1 147 GLU 147 146 146 GLU GLU A . n A 1 148 MET 148 147 147 MET MET A . n A 1 149 ILE 149 148 148 ILE ILE A . n A 1 150 GLU 150 149 149 GLU GLU A . n A 1 151 GLU 151 150 150 GLU GLU A . n A 1 152 MET 152 151 151 MET MET A . n A 1 153 TYR 153 152 152 TYR TYR A . n A 1 154 GLN 154 153 153 GLN GLN A . n A 1 155 LEU 155 154 154 LEU LEU A . n A 1 156 TYR 156 155 155 TYR TYR A . n A 1 157 GLY 157 156 156 GLY GLY A . n A 1 158 GLY 158 157 157 GLY GLY A . n A 1 159 PRO 159 158 158 PRO PRO A . n A 1 160 VAL 160 159 159 VAL VAL A . n A 1 161 VAL 161 160 160 VAL VAL A . n A 1 162 LEU 162 161 161 LEU LEU A . n A 1 163 VAL 163 162 162 VAL VAL A . n A 1 164 ALA 164 163 163 ALA ALA A . n A 1 165 HIS 165 164 164 HIS HIS A . n A 1 166 SER 166 165 165 SER SER A . n A 1 167 MET 167 166 166 MET MET A . n A 1 168 GLY 168 167 167 GLY GLY A . n A 1 169 ASN 169 168 168 ASN ASN A . n A 1 170 MET 170 169 169 MET MET A . n A 1 171 TYR 171 170 170 TYR TYR A . n A 1 172 THR 172 171 171 THR THR A . n A 1 173 LEU 173 172 172 LEU LEU A . n A 1 174 TYR 174 173 173 TYR TYR A . n A 1 175 PHE 175 174 174 PHE PHE A . n A 1 176 LEU 176 175 175 LEU LEU A . n A 1 177 GLN 177 176 176 GLN GLN A . n A 1 178 ARG 178 177 177 ARG ARG A . n A 1 179 GLN 179 178 178 GLN GLN A . n A 1 180 PRO 180 179 179 PRO PRO A . n A 1 181 GLN 181 180 180 GLN GLN A . n A 1 182 ALA 182 181 181 ALA ALA A . n A 1 183 TRP 183 182 182 TRP TRP A . n A 1 184 LYS 184 183 183 LYS LYS A . n A 1 185 ASP 185 184 184 ASP ASP A . n A 1 186 LYS 186 185 185 LYS LYS A . n A 1 187 TYR 187 186 186 TYR TYR A . n A 1 188 ILE 188 187 187 ILE ILE A . n A 1 189 ARG 189 188 188 ARG ARG A . n A 1 190 ALA 190 189 189 ALA ALA A . n A 1 191 PHE 191 190 190 PHE PHE A . n A 1 192 VAL 192 191 191 VAL VAL A . n A 1 193 SER 193 192 192 SER SER A . n A 1 194 LEU 194 193 193 LEU LEU A . n A 1 195 GLY 195 194 194 GLY GLY A . n A 1 196 ALA 196 195 195 ALA ALA A . n A 1 197 PRO 197 196 196 PRO PRO A . n A 1 198 TRP 198 197 197 TRP TRP A . n A 1 199 GLY 199 198 198 GLY GLY A . n A 1 200 GLY 200 199 199 GLY GLY A . n A 1 201 VAL 201 200 200 VAL VAL A . n A 1 202 ALA 202 201 201 ALA ALA A . n A 1 203 LYS 203 202 202 LYS LYS A . n A 1 204 THR 204 203 203 THR THR A . n A 1 205 LEU 205 204 204 LEU LEU A . n A 1 206 ARG 206 205 205 ARG ARG A . n A 1 207 VAL 207 206 206 VAL VAL A . n A 1 208 LEU 208 207 207 LEU LEU A . n A 1 209 ALA 209 208 208 ALA ALA A . n A 1 210 SER 210 209 209 SER SER A . n A 1 211 GLY 211 210 210 GLY GLY A . n A 1 212 ASP 212 211 211 ASP ASP A . n A 1 213 ASN 213 212 212 ASN ASN A . n A 1 214 ASN 214 213 213 ASN ASN A . n A 1 215 ARG 215 214 214 ARG ARG A . n A 1 216 ILE 216 215 215 ILE ILE A . n A 1 217 PRO 217 216 216 PRO PRO A . n A 1 218 VAL 218 217 217 VAL VAL A . n A 1 219 ILE 219 218 218 ILE ILE A . n A 1 220 GLY 220 219 219 GLY GLY A . n A 1 221 PRO 221 220 220 PRO PRO A . n A 1 222 LEU 222 221 221 LEU LEU A . n A 1 223 LYS 223 222 222 LYS LYS A . n A 1 224 ILE 224 223 223 ILE ILE A . n A 1 225 ARG 225 224 224 ARG ARG A . n A 1 226 GLU 226 225 225 GLU GLU A . n A 1 227 GLN 227 226 226 GLN GLN A . n A 1 228 GLN 228 227 227 GLN GLN A . n A 1 229 ARG 229 228 228 ARG ARG A . n A 1 230 SER 230 229 229 SER SER A . n A 1 231 ALA 231 230 230 ALA ALA A . n A 1 232 VAL 232 231 231 VAL VAL A . n A 1 233 SER 233 232 232 SER SER A . n A 1 234 THR 234 233 233 THR THR A . n A 1 235 SER 235 234 234 SER SER A . n A 1 236 TRP 236 235 235 TRP TRP A . n A 1 237 LEU 237 236 236 LEU LEU A . n A 1 238 LEU 238 237 237 LEU LEU A . n A 1 239 PRO 239 238 238 PRO PRO A . n A 1 240 TYR 240 239 239 TYR TYR A . n A 1 241 ASN 241 240 240 ASN ASN A . n A 1 242 TYR 242 241 241 TYR TYR A . n A 1 243 THR 243 242 242 THR THR A . n A 1 244 TRP 244 243 243 TRP TRP A . n A 1 245 SER 245 244 244 SER SER A . n A 1 246 PRO 246 245 245 PRO PRO A . n A 1 247 GLU 247 246 246 GLU GLU A . n A 1 248 LYS 248 247 247 LYS LYS A . n A 1 249 VAL 249 248 248 VAL VAL A . n A 1 250 PHE 250 249 249 PHE PHE A . n A 1 251 VAL 251 250 250 VAL VAL A . n A 1 252 GLN 252 251 251 GLN GLN A . n A 1 253 THR 253 252 252 THR THR A . n A 1 254 PRO 254 253 253 PRO PRO A . n A 1 255 THR 255 254 254 THR THR A . n A 1 256 ILE 256 255 255 ILE ILE A . n A 1 257 ASN 257 256 256 ASN ASN A . n A 1 258 TYR 258 257 257 TYR TYR A . n A 1 259 THR 259 258 258 THR THR A . n A 1 260 LEU 260 259 259 LEU LEU A . n A 1 261 ARG 261 260 260 ARG ARG A . n A 1 262 ASP 262 261 261 ASP ASP A . n A 1 263 TYR 263 262 262 TYR TYR A . n A 1 264 ARG 264 263 263 ARG ARG A . n A 1 265 LYS 265 264 264 LYS LYS A . n A 1 266 PHE 266 265 265 PHE PHE A . n A 1 267 PHE 267 266 266 PHE PHE A . n A 1 268 GLN 268 267 267 GLN GLN A . n A 1 269 ASP 269 268 268 ASP ASP A . n A 1 270 ILE 270 269 269 ILE ILE A . n A 1 271 GLY 271 270 270 GLY GLY A . n A 1 272 PHE 272 271 271 PHE PHE A . n A 1 273 GLU 273 272 272 GLU GLU A . n A 1 274 ASP 274 273 273 ASP ASP A . n A 1 275 GLY 275 274 274 GLY GLY A . n A 1 276 TRP 276 275 275 TRP TRP A . n A 1 277 LEU 277 276 276 LEU LEU A . n A 1 278 MET 278 277 277 MET MET A . n A 1 279 ARG 279 278 278 ARG ARG A . n A 1 280 GLN 280 279 279 GLN GLN A . n A 1 281 ASP 281 280 280 ASP ASP A . n A 1 282 THR 282 281 281 THR THR A . n A 1 283 GLU 283 282 282 GLU GLU A . n A 1 284 GLY 284 283 283 GLY GLY A . n A 1 285 LEU 285 284 284 LEU LEU A . n A 1 286 VAL 286 285 285 VAL VAL A . n A 1 287 GLU 287 286 286 GLU GLU A . n A 1 288 ALA 288 287 287 ALA ALA A . n A 1 289 THR 289 288 288 THR THR A . n A 1 290 MET 290 289 289 MET MET A . n A 1 291 PRO 291 290 290 PRO PRO A . n A 1 292 PRO 292 291 291 PRO PRO A . n A 1 293 GLY 293 292 292 GLY GLY A . n A 1 294 VAL 294 293 293 VAL VAL A . n A 1 295 GLN 295 294 294 GLN GLN A . n A 1 296 LEU 296 295 295 LEU LEU A . n A 1 297 HIS 297 296 296 HIS HIS A . n A 1 298 CYS 298 297 297 CYS CYS A . n A 1 299 LEU 299 298 298 LEU LEU A . n A 1 300 TYR 300 299 299 TYR TYR A . n A 1 301 GLY 301 300 300 GLY GLY A . n A 1 302 THR 302 301 301 THR THR A . n A 1 303 GLY 303 302 302 GLY GLY A . n A 1 304 VAL 304 303 303 VAL VAL A . n A 1 305 PRO 305 304 304 PRO PRO A . n A 1 306 THR 306 305 305 THR THR A . n A 1 307 PRO 307 306 306 PRO PRO A . n A 1 308 ASP 308 307 307 ASP ASP A . n A 1 309 SER 309 308 308 SER SER A . n A 1 310 PHE 310 309 309 PHE PHE A . n A 1 311 TYR 311 310 310 TYR TYR A . n A 1 312 TYR 312 311 311 TYR TYR A . n A 1 313 GLU 313 312 312 GLU GLU A . n A 1 314 SER 314 313 313 SER SER A . n A 1 315 PHE 315 314 314 PHE PHE A . n A 1 316 PRO 316 315 315 PRO PRO A . n A 1 317 ASP 317 316 316 ASP ASP A . n A 1 318 ARG 318 317 317 ARG ARG A . n A 1 319 ASP 319 318 318 ASP ASP A . n A 1 320 PRO 320 319 319 PRO PRO A . n A 1 321 LYS 321 320 320 LYS LYS A . n A 1 322 ILE 322 321 321 ILE ILE A . n A 1 323 CYS 323 322 322 CYS CYS A . n A 1 324 PHE 324 323 323 PHE PHE A . n A 1 325 GLY 325 324 324 GLY GLY A . n A 1 326 ASP 326 325 325 ASP ASP A . n A 1 327 GLY 327 326 326 GLY GLY A . n A 1 328 ASP 328 327 327 ASP ASP A . n A 1 329 GLY 329 328 328 GLY GLY A . n A 1 330 THR 330 329 329 THR THR A . n A 1 331 VAL 331 330 330 VAL VAL A . n A 1 332 ASN 332 331 331 ASN ASN A . n A 1 333 LEU 333 332 332 LEU LEU A . n A 1 334 LYS 334 333 333 LYS LYS A . n A 1 335 SER 335 334 334 SER SER A . n A 1 336 ALA 336 335 335 ALA ALA A . n A 1 337 LEU 337 336 336 LEU LEU A . n A 1 338 GLN 338 337 337 GLN GLN A . n A 1 339 CYS 339 338 338 CYS CYS A . n A 1 340 GLN 340 339 339 GLN GLN A . n A 1 341 ALA 341 340 340 ALA ALA A . n A 1 342 TRP 342 341 341 TRP TRP A . n A 1 343 GLN 343 342 342 GLN GLN A . n A 1 344 SER 344 343 343 SER SER A . n A 1 345 ARG 345 344 344 ARG ARG A . n A 1 346 GLN 346 345 345 GLN GLN A . n A 1 347 GLU 347 346 346 GLU GLU A . n A 1 348 HIS 348 347 347 HIS HIS A . n A 1 349 GLN 349 348 348 GLN GLN A . n A 1 350 VAL 350 349 349 VAL VAL A . n A 1 351 LEU 351 350 350 LEU LEU A . n A 1 352 LEU 352 351 351 LEU LEU A . n A 1 353 GLN 353 352 352 GLN GLN A . n A 1 354 GLU 354 353 353 GLU GLU A . n A 1 355 LEU 355 354 354 LEU LEU A . n A 1 356 PRO 356 355 355 PRO PRO A . n A 1 357 GLY 357 356 356 GLY GLY A . n A 1 358 SER 358 357 357 SER SER A . n A 1 359 GLU 359 358 358 GLU GLU A . n A 1 360 HIS 360 359 359 HIS HIS A . n A 1 361 ILE 361 360 360 ILE ILE A . n A 1 362 GLU 362 361 361 GLU GLU A . n A 1 363 MET 363 362 362 MET MET A . n A 1 364 LEU 364 363 363 LEU LEU A . n A 1 365 ALA 365 364 364 ALA ALA A . n A 1 366 ASN 366 365 365 ASN ASN A . n A 1 367 ALA 367 366 366 ALA ALA A . n A 1 368 THR 368 367 367 THR THR A . n A 1 369 THR 369 368 368 THR THR A . n A 1 370 LEU 370 369 369 LEU LEU A . n A 1 371 ALA 371 370 370 ALA ALA A . n A 1 372 TYR 372 371 371 TYR TYR A . n A 1 373 LEU 373 372 372 LEU LEU A . n A 1 374 LYS 374 373 373 LYS LYS A . n A 1 375 ARG 375 374 374 ARG ARG A . n A 1 376 VAL 376 375 375 VAL VAL A . n A 1 377 LEU 377 376 376 LEU LEU A . n A 1 378 LEU 378 377 377 LEU LEU A . n A 1 379 GLY 379 378 378 GLY GLY A . n A 1 380 PRO 380 379 379 PRO PRO A . n B 1 1 GLY 1 0 ? ? ? B . n B 1 2 ALA 2 1 ? ? ? B . n B 1 3 GLY 3 2 ? ? ? B . n B 1 4 ARG 4 3 3 ARG ARG B . n B 1 5 HIS 5 4 4 HIS HIS B . n B 1 6 PRO 6 5 5 PRO PRO B . n B 1 7 PRO 7 6 6 PRO PRO B . n B 1 8 VAL 8 7 7 VAL VAL B . n B 1 9 VAL 9 8 8 VAL VAL B . n B 1 10 LEU 10 9 9 LEU LEU B . n B 1 11 VAL 11 10 10 VAL VAL B . n B 1 12 PRO 12 11 11 PRO PRO B . n B 1 13 GLY 13 12 12 GLY GLY B . n B 1 14 ASP 14 13 13 ASP ASP B . n B 1 15 LEU 15 14 14 LEU LEU B . n B 1 16 GLY 16 15 15 GLY GLY B . n B 1 17 ASN 17 16 16 ASN ASN B . n B 1 18 GLN 18 17 17 GLN GLN B . n B 1 19 LEU 19 18 18 LEU LEU B . n B 1 20 GLU 20 19 19 GLU GLU B . n B 1 21 ALA 21 20 20 ALA ALA B . n B 1 22 LYS 22 21 21 LYS LYS B . n B 1 23 LEU 23 22 22 LEU LEU B . n B 1 24 ASP 24 23 23 ASP ASP B . n B 1 25 LYS 25 24 24 LYS LYS B . n B 1 26 PRO 26 25 25 PRO PRO B . n B 1 27 THR 27 26 26 THR THR B . n B 1 28 VAL 28 27 27 VAL VAL B . n B 1 29 VAL 29 28 28 VAL VAL B . n B 1 30 HIS 30 29 29 HIS HIS B . n B 1 31 TYR 31 30 30 TYR TYR B . n B 1 32 LEU 32 31 31 LEU LEU B . n B 1 33 CYS 33 32 32 CYS CYS B . n B 1 34 SER 34 33 33 SER SER B . n B 1 35 LYS 35 34 34 LYS LYS B . n B 1 36 LYS 36 35 35 LYS LYS B . n B 1 37 THR 37 36 36 THR THR B . n B 1 38 GLU 38 37 37 GLU GLU B . n B 1 39 SER 39 38 38 SER SER B . n B 1 40 TYR 40 39 39 TYR TYR B . n B 1 41 PHE 41 40 40 PHE PHE B . n B 1 42 THR 42 41 41 THR THR B . n B 1 43 ILE 43 42 42 ILE ILE B . n B 1 44 TRP 44 43 43 TRP TRP B . n B 1 45 LEU 45 44 44 LEU LEU B . n B 1 46 ASN 46 45 45 ASN ASN B . n B 1 47 LEU 47 46 46 LEU LEU B . n B 1 48 GLU 48 47 47 GLU GLU B . n B 1 49 LEU 49 48 48 LEU LEU B . n B 1 50 LEU 50 49 49 LEU LEU B . n B 1 51 LEU 51 50 50 LEU LEU B . n B 1 52 PRO 52 51 51 PRO PRO B . n B 1 53 VAL 53 52 52 VAL VAL B . n B 1 54 ILE 54 53 53 ILE ILE B . n B 1 55 ILE 55 54 54 ILE ILE B . n B 1 56 ASP 56 55 55 ASP ASP B . n B 1 57 CYS 57 56 56 CYS CYS B . n B 1 58 TRP 58 57 57 TRP TRP B . n B 1 59 ILE 59 58 58 ILE ILE B . n B 1 60 ASP 60 59 59 ASP ASP B . n B 1 61 ASN 61 60 60 ASN ASN B . n B 1 62 ILE 62 61 61 ILE ILE B . n B 1 63 ARG 63 62 62 ARG ARG B . n B 1 64 LEU 64 63 63 LEU LEU B . n B 1 65 VAL 65 64 64 VAL VAL B . n B 1 66 TYR 66 65 65 TYR TYR B . n B 1 67 ASN 67 66 66 ASN ASN B . n B 1 68 LYS 68 67 67 LYS LYS B . n B 1 69 THR 69 68 68 THR THR B . n B 1 70 SER 70 69 69 SER SER B . n B 1 71 ARG 71 70 70 ARG ARG B . n B 1 72 ALA 72 71 71 ALA ALA B . n B 1 73 THR 73 72 72 THR THR B . n B 1 74 GLN 74 73 73 GLN GLN B . n B 1 75 PHE 75 74 74 PHE PHE B . n B 1 76 PRO 76 75 75 PRO PRO B . n B 1 77 ASP 77 76 76 ASP ASP B . n B 1 78 GLY 78 77 77 GLY GLY B . n B 1 79 VAL 79 78 78 VAL VAL B . n B 1 80 ASP 80 79 79 ASP ASP B . n B 1 81 VAL 81 80 80 VAL VAL B . n B 1 82 ARG 82 81 81 ARG ARG B . n B 1 83 VAL 83 82 82 VAL VAL B . n B 1 84 PRO 84 83 83 PRO PRO B . n B 1 85 GLY 85 84 84 GLY GLY B . n B 1 86 PHE 86 85 85 PHE PHE B . n B 1 87 GLY 87 86 86 GLY GLY B . n B 1 88 LYS 88 87 87 LYS LYS B . n B 1 89 THR 89 88 88 THR THR B . n B 1 90 PHE 90 89 89 PHE PHE B . n B 1 91 SER 91 90 90 SER SER B . n B 1 92 LEU 92 91 91 LEU LEU B . n B 1 93 GLU 93 92 92 GLU GLU B . n B 1 94 PHE 94 93 93 PHE PHE B . n B 1 95 LEU 95 94 94 LEU LEU B . n B 1 96 ASP 96 95 95 ASP ASP B . n B 1 97 PRO 97 96 96 PRO PRO B . n B 1 98 SER 98 97 97 SER SER B . n B 1 99 LYS 99 98 98 LYS LYS B . n B 1 100 SER 100 99 99 SER SER B . n B 1 101 SER 101 100 100 SER SER B . n B 1 102 VAL 102 101 101 VAL VAL B . n B 1 103 GLY 103 102 102 GLY GLY B . n B 1 104 SER 104 103 103 SER SER B . n B 1 105 TYR 105 104 104 TYR TYR B . n B 1 106 PHE 106 105 105 PHE PHE B . n B 1 107 HIS 107 106 106 HIS HIS B . n B 1 108 THR 108 107 107 THR THR B . n B 1 109 MET 109 108 108 MET MET B . n B 1 110 VAL 110 109 109 VAL VAL B . n B 1 111 GLU 111 110 110 GLU GLU B . n B 1 112 SER 112 111 111 SER SER B . n B 1 113 LEU 113 112 112 LEU LEU B . n B 1 114 VAL 114 113 113 VAL VAL B . n B 1 115 GLY 115 114 114 GLY GLY B . n B 1 116 TRP 116 115 115 TRP TRP B . n B 1 117 GLY 117 116 116 GLY GLY B . n B 1 118 TYR 118 117 117 TYR TYR B . n B 1 119 THR 119 118 118 THR THR B . n B 1 120 ARG 120 119 119 ARG ARG B . n B 1 121 GLY 121 120 120 GLY GLY B . n B 1 122 GLU 122 121 121 GLU GLU B . n B 1 123 ASP 123 122 122 ASP ASP B . n B 1 124 VAL 124 123 123 VAL VAL B . n B 1 125 ARG 125 124 124 ARG ARG B . n B 1 126 GLY 126 125 125 GLY GLY B . n B 1 127 ALA 127 126 126 ALA ALA B . n B 1 128 PRO 128 127 127 PRO PRO B . n B 1 129 TYR 129 128 128 TYR TYR B . n B 1 130 ASP 130 129 129 ASP ASP B . n B 1 131 TRP 131 130 130 TRP TRP B . n B 1 132 ARG 132 131 131 ARG ARG B . n B 1 133 ARG 133 132 132 ARG ARG B . n B 1 134 ALA 134 133 133 ALA ALA B . n B 1 135 PRO 135 134 134 PRO PRO B . n B 1 136 ASN 136 135 135 ASN ASN B . n B 1 137 GLU 137 136 136 GLU GLU B . n B 1 138 ASN 138 137 137 ASN ASN B . n B 1 139 GLY 139 138 138 GLY GLY B . n B 1 140 PRO 140 139 139 PRO PRO B . n B 1 141 TYR 141 140 140 TYR TYR B . n B 1 142 PHE 142 141 141 PHE PHE B . n B 1 143 LEU 143 142 142 LEU LEU B . n B 1 144 ALA 144 143 143 ALA ALA B . n B 1 145 LEU 145 144 144 LEU LEU B . n B 1 146 ARG 146 145 145 ARG ARG B . n B 1 147 GLU 147 146 146 GLU GLU B . n B 1 148 MET 148 147 147 MET MET B . n B 1 149 ILE 149 148 148 ILE ILE B . n B 1 150 GLU 150 149 149 GLU GLU B . n B 1 151 GLU 151 150 150 GLU GLU B . n B 1 152 MET 152 151 151 MET MET B . n B 1 153 TYR 153 152 152 TYR TYR B . n B 1 154 GLN 154 153 153 GLN GLN B . n B 1 155 LEU 155 154 154 LEU LEU B . n B 1 156 TYR 156 155 155 TYR TYR B . n B 1 157 GLY 157 156 156 GLY GLY B . n B 1 158 GLY 158 157 157 GLY GLY B . n B 1 159 PRO 159 158 158 PRO PRO B . n B 1 160 VAL 160 159 159 VAL VAL B . n B 1 161 VAL 161 160 160 VAL VAL B . n B 1 162 LEU 162 161 161 LEU LEU B . n B 1 163 VAL 163 162 162 VAL VAL B . n B 1 164 ALA 164 163 163 ALA ALA B . n B 1 165 HIS 165 164 164 HIS HIS B . n B 1 166 SER 166 165 165 SER SER B . n B 1 167 MET 167 166 166 MET MET B . n B 1 168 GLY 168 167 167 GLY GLY B . n B 1 169 ASN 169 168 168 ASN ASN B . n B 1 170 MET 170 169 169 MET MET B . n B 1 171 TYR 171 170 170 TYR TYR B . n B 1 172 THR 172 171 171 THR THR B . n B 1 173 LEU 173 172 172 LEU LEU B . n B 1 174 TYR 174 173 173 TYR TYR B . n B 1 175 PHE 175 174 174 PHE PHE B . n B 1 176 LEU 176 175 175 LEU LEU B . n B 1 177 GLN 177 176 176 GLN GLN B . n B 1 178 ARG 178 177 177 ARG ARG B . n B 1 179 GLN 179 178 178 GLN GLN B . n B 1 180 PRO 180 179 179 PRO PRO B . n B 1 181 GLN 181 180 180 GLN GLN B . n B 1 182 ALA 182 181 181 ALA ALA B . n B 1 183 TRP 183 182 182 TRP TRP B . n B 1 184 LYS 184 183 183 LYS LYS B . n B 1 185 ASP 185 184 184 ASP ASP B . n B 1 186 LYS 186 185 185 LYS LYS B . n B 1 187 TYR 187 186 186 TYR TYR B . n B 1 188 ILE 188 187 187 ILE ILE B . n B 1 189 ARG 189 188 188 ARG ARG B . n B 1 190 ALA 190 189 189 ALA ALA B . n B 1 191 PHE 191 190 190 PHE PHE B . n B 1 192 VAL 192 191 191 VAL VAL B . n B 1 193 SER 193 192 192 SER SER B . n B 1 194 LEU 194 193 193 LEU LEU B . n B 1 195 GLY 195 194 194 GLY GLY B . n B 1 196 ALA 196 195 195 ALA ALA B . n B 1 197 PRO 197 196 196 PRO PRO B . n B 1 198 TRP 198 197 197 TRP TRP B . n B 1 199 GLY 199 198 198 GLY GLY B . n B 1 200 GLY 200 199 199 GLY GLY B . n B 1 201 VAL 201 200 200 VAL VAL B . n B 1 202 ALA 202 201 201 ALA ALA B . n B 1 203 LYS 203 202 202 LYS LYS B . n B 1 204 THR 204 203 203 THR THR B . n B 1 205 LEU 205 204 204 LEU LEU B . n B 1 206 ARG 206 205 205 ARG ARG B . n B 1 207 VAL 207 206 206 VAL VAL B . n B 1 208 LEU 208 207 207 LEU LEU B . n B 1 209 ALA 209 208 208 ALA ALA B . n B 1 210 SER 210 209 209 SER SER B . n B 1 211 GLY 211 210 210 GLY GLY B . n B 1 212 ASP 212 211 211 ASP ASP B . n B 1 213 ASN 213 212 212 ASN ASN B . n B 1 214 ASN 214 213 213 ASN ASN B . n B 1 215 ARG 215 214 214 ARG ARG B . n B 1 216 ILE 216 215 215 ILE ILE B . n B 1 217 PRO 217 216 216 PRO PRO B . n B 1 218 VAL 218 217 217 VAL VAL B . n B 1 219 ILE 219 218 218 ILE ILE B . n B 1 220 GLY 220 219 219 GLY GLY B . n B 1 221 PRO 221 220 220 PRO PRO B . n B 1 222 LEU 222 221 221 LEU LEU B . n B 1 223 LYS 223 222 222 LYS LYS B . n B 1 224 ILE 224 223 223 ILE ILE B . n B 1 225 ARG 225 224 224 ARG ARG B . n B 1 226 GLU 226 225 225 GLU GLU B . n B 1 227 GLN 227 226 226 GLN GLN B . n B 1 228 GLN 228 227 227 GLN GLN B . n B 1 229 ARG 229 228 228 ARG ARG B . n B 1 230 SER 230 229 229 SER SER B . n B 1 231 ALA 231 230 230 ALA ALA B . n B 1 232 VAL 232 231 231 VAL VAL B . n B 1 233 SER 233 232 232 SER SER B . n B 1 234 THR 234 233 233 THR THR B . n B 1 235 SER 235 234 234 SER SER B . n B 1 236 TRP 236 235 235 TRP TRP B . n B 1 237 LEU 237 236 236 LEU LEU B . n B 1 238 LEU 238 237 237 LEU LEU B . n B 1 239 PRO 239 238 238 PRO PRO B . n B 1 240 TYR 240 239 239 TYR TYR B . n B 1 241 ASN 241 240 240 ASN ASN B . n B 1 242 TYR 242 241 241 TYR TYR B . n B 1 243 THR 243 242 242 THR THR B . n B 1 244 TRP 244 243 243 TRP TRP B . n B 1 245 SER 245 244 244 SER SER B . n B 1 246 PRO 246 245 245 PRO PRO B . n B 1 247 GLU 247 246 246 GLU GLU B . n B 1 248 LYS 248 247 247 LYS LYS B . n B 1 249 VAL 249 248 248 VAL VAL B . n B 1 250 PHE 250 249 249 PHE PHE B . n B 1 251 VAL 251 250 250 VAL VAL B . n B 1 252 GLN 252 251 251 GLN GLN B . n B 1 253 THR 253 252 252 THR THR B . n B 1 254 PRO 254 253 253 PRO PRO B . n B 1 255 THR 255 254 254 THR THR B . n B 1 256 ILE 256 255 255 ILE ILE B . n B 1 257 ASN 257 256 256 ASN ASN B . n B 1 258 TYR 258 257 257 TYR TYR B . n B 1 259 THR 259 258 258 THR THR B . n B 1 260 LEU 260 259 259 LEU LEU B . n B 1 261 ARG 261 260 260 ARG ARG B . n B 1 262 ASP 262 261 261 ASP ASP B . n B 1 263 TYR 263 262 262 TYR TYR B . n B 1 264 ARG 264 263 263 ARG ARG B . n B 1 265 LYS 265 264 264 LYS LYS B . n B 1 266 PHE 266 265 265 PHE PHE B . n B 1 267 PHE 267 266 266 PHE PHE B . n B 1 268 GLN 268 267 267 GLN GLN B . n B 1 269 ASP 269 268 268 ASP ASP B . n B 1 270 ILE 270 269 269 ILE ILE B . n B 1 271 GLY 271 270 270 GLY GLY B . n B 1 272 PHE 272 271 271 PHE PHE B . n B 1 273 GLU 273 272 272 GLU GLU B . n B 1 274 ASP 274 273 273 ASP ASP B . n B 1 275 GLY 275 274 274 GLY GLY B . n B 1 276 TRP 276 275 275 TRP TRP B . n B 1 277 LEU 277 276 276 LEU LEU B . n B 1 278 MET 278 277 277 MET MET B . n B 1 279 ARG 279 278 278 ARG ARG B . n B 1 280 GLN 280 279 279 GLN GLN B . n B 1 281 ASP 281 280 280 ASP ASP B . n B 1 282 THR 282 281 281 THR THR B . n B 1 283 GLU 283 282 282 GLU GLU B . n B 1 284 GLY 284 283 283 GLY GLY B . n B 1 285 LEU 285 284 284 LEU LEU B . n B 1 286 VAL 286 285 285 VAL VAL B . n B 1 287 GLU 287 286 286 GLU GLU B . n B 1 288 ALA 288 287 287 ALA ALA B . n B 1 289 THR 289 288 288 THR THR B . n B 1 290 MET 290 289 289 MET MET B . n B 1 291 PRO 291 290 290 PRO PRO B . n B 1 292 PRO 292 291 291 PRO PRO B . n B 1 293 GLY 293 292 292 GLY GLY B . n B 1 294 VAL 294 293 293 VAL VAL B . n B 1 295 GLN 295 294 294 GLN GLN B . n B 1 296 LEU 296 295 295 LEU LEU B . n B 1 297 HIS 297 296 296 HIS HIS B . n B 1 298 CYS 298 297 297 CYS CYS B . n B 1 299 LEU 299 298 298 LEU LEU B . n B 1 300 TYR 300 299 299 TYR TYR B . n B 1 301 GLY 301 300 300 GLY GLY B . n B 1 302 THR 302 301 301 THR THR B . n B 1 303 GLY 303 302 302 GLY GLY B . n B 1 304 VAL 304 303 303 VAL VAL B . n B 1 305 PRO 305 304 304 PRO PRO B . n B 1 306 THR 306 305 305 THR THR B . n B 1 307 PRO 307 306 306 PRO PRO B . n B 1 308 ASP 308 307 307 ASP ASP B . n B 1 309 SER 309 308 308 SER SER B . n B 1 310 PHE 310 309 309 PHE PHE B . n B 1 311 TYR 311 310 310 TYR TYR B . n B 1 312 TYR 312 311 311 TYR TYR B . n B 1 313 GLU 313 312 312 GLU GLU B . n B 1 314 SER 314 313 313 SER SER B . n B 1 315 PHE 315 314 314 PHE PHE B . n B 1 316 PRO 316 315 315 PRO PRO B . n B 1 317 ASP 317 316 316 ASP ASP B . n B 1 318 ARG 318 317 317 ARG ARG B . n B 1 319 ASP 319 318 318 ASP ASP B . n B 1 320 PRO 320 319 319 PRO PRO B . n B 1 321 LYS 321 320 320 LYS LYS B . n B 1 322 ILE 322 321 321 ILE ILE B . n B 1 323 CYS 323 322 322 CYS CYS B . n B 1 324 PHE 324 323 323 PHE PHE B . n B 1 325 GLY 325 324 324 GLY GLY B . n B 1 326 ASP 326 325 325 ASP ASP B . n B 1 327 GLY 327 326 326 GLY GLY B . n B 1 328 ASP 328 327 327 ASP ASP B . n B 1 329 GLY 329 328 328 GLY GLY B . n B 1 330 THR 330 329 329 THR THR B . n B 1 331 VAL 331 330 330 VAL VAL B . n B 1 332 ASN 332 331 331 ASN ASN B . n B 1 333 LEU 333 332 332 LEU LEU B . n B 1 334 LYS 334 333 333 LYS LYS B . n B 1 335 SER 335 334 334 SER SER B . n B 1 336 ALA 336 335 335 ALA ALA B . n B 1 337 LEU 337 336 336 LEU LEU B . n B 1 338 GLN 338 337 337 GLN GLN B . n B 1 339 CYS 339 338 338 CYS CYS B . n B 1 340 GLN 340 339 339 GLN GLN B . n B 1 341 ALA 341 340 340 ALA ALA B . n B 1 342 TRP 342 341 341 TRP TRP B . n B 1 343 GLN 343 342 342 GLN GLN B . n B 1 344 SER 344 343 343 SER SER B . n B 1 345 ARG 345 344 344 ARG ARG B . n B 1 346 GLN 346 345 345 GLN GLN B . n B 1 347 GLU 347 346 346 GLU GLU B . n B 1 348 HIS 348 347 347 HIS HIS B . n B 1 349 GLN 349 348 348 GLN GLN B . n B 1 350 VAL 350 349 349 VAL VAL B . n B 1 351 LEU 351 350 350 LEU LEU B . n B 1 352 LEU 352 351 351 LEU LEU B . n B 1 353 GLN 353 352 352 GLN GLN B . n B 1 354 GLU 354 353 353 GLU GLU B . n B 1 355 LEU 355 354 354 LEU LEU B . n B 1 356 PRO 356 355 355 PRO PRO B . n B 1 357 GLY 357 356 356 GLY GLY B . n B 1 358 SER 358 357 357 SER SER B . n B 1 359 GLU 359 358 358 GLU GLU B . n B 1 360 HIS 360 359 359 HIS HIS B . n B 1 361 ILE 361 360 360 ILE ILE B . n B 1 362 GLU 362 361 361 GLU GLU B . n B 1 363 MET 363 362 362 MET MET B . n B 1 364 LEU 364 363 363 LEU LEU B . n B 1 365 ALA 365 364 364 ALA ALA B . n B 1 366 ASN 366 365 365 ASN ASN B . n B 1 367 ALA 367 366 366 ALA ALA B . n B 1 368 THR 368 367 367 THR THR B . n B 1 369 THR 369 368 368 THR THR B . n B 1 370 LEU 370 369 369 LEU LEU B . n B 1 371 ALA 371 370 370 ALA ALA B . n B 1 372 TYR 372 371 371 TYR TYR B . n B 1 373 LEU 373 372 372 LEU LEU B . n B 1 374 LYS 374 373 373 LYS LYS B . n B 1 375 ARG 375 374 374 ARG ARG B . n B 1 376 VAL 376 375 375 VAL VAL B . n B 1 377 LEU 377 376 376 LEU LEU B . n B 1 378 LEU 378 377 377 LEU LEU B . n B 1 379 GLY 379 378 378 GLY GLY B . n B 1 380 PRO 380 379 379 PRO PRO 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 1 401 380 NAG NAG A . D 2 NAG 1 402 381 NAG NAG A . E 2 NAG 1 403 382 NAG NAG A . F 2 NAG 1 404 383 NAG NAG A . G 3 EPE 1 405 385 EPE EPE A . H 2 NAG 1 401 380 NAG NAG B . I 2 NAG 1 402 381 NAG NAG B . J 2 NAG 1 403 382 NAG NAG B . K 2 NAG 1 404 383 NAG NAG B . L 3 EPE 1 405 385 EPE EPE B . M 4 PEG 1 406 391 PEG PEG B . N 5 PE8 1 407 397 PE8 PE8 B . O 6 HOH 1 501 39 HOH HOH A . O 6 HOH 2 502 38 HOH HOH A . O 6 HOH 3 503 87 HOH HOH A . O 6 HOH 4 504 64 HOH HOH A . O 6 HOH 5 505 1 HOH HOH A . O 6 HOH 6 506 2 HOH HOH A . O 6 HOH 7 507 3 HOH HOH A . O 6 HOH 8 508 4 HOH HOH A . O 6 HOH 9 509 5 HOH HOH A . O 6 HOH 10 510 6 HOH HOH A . O 6 HOH 11 511 8 HOH HOH A . O 6 HOH 12 512 9 HOH HOH A . O 6 HOH 13 513 10 HOH HOH A . O 6 HOH 14 514 11 HOH HOH A . O 6 HOH 15 515 13 HOH HOH A . O 6 HOH 16 516 14 HOH HOH A . O 6 HOH 17 517 16 HOH HOH A . O 6 HOH 18 518 17 HOH HOH A . O 6 HOH 19 519 20 HOH HOH A . O 6 HOH 20 520 23 HOH HOH A . O 6 HOH 21 521 29 HOH HOH A . O 6 HOH 22 522 32 HOH HOH A . O 6 HOH 23 523 41 HOH HOH A . O 6 HOH 24 524 42 HOH HOH A . O 6 HOH 25 525 44 HOH HOH A . O 6 HOH 26 526 46 HOH HOH A . O 6 HOH 27 527 47 HOH HOH A . O 6 HOH 28 528 49 HOH HOH A . O 6 HOH 29 529 50 HOH HOH A . O 6 HOH 30 530 53 HOH HOH A . O 6 HOH 31 531 56 HOH HOH A . O 6 HOH 32 532 59 HOH HOH A . O 6 HOH 33 533 60 HOH HOH A . O 6 HOH 34 534 61 HOH HOH A . O 6 HOH 35 535 63 HOH HOH A . O 6 HOH 36 536 70 HOH HOH A . O 6 HOH 37 537 74 HOH HOH A . O 6 HOH 38 538 75 HOH HOH A . O 6 HOH 39 539 77 HOH HOH A . O 6 HOH 40 540 78 HOH HOH A . O 6 HOH 41 541 80 HOH HOH A . O 6 HOH 42 542 83 HOH HOH A . O 6 HOH 43 543 84 HOH HOH A . O 6 HOH 44 544 86 HOH HOH A . O 6 HOH 45 545 88 HOH HOH A . P 6 HOH 1 501 91 HOH HOH B . P 6 HOH 2 502 36 HOH HOH B . P 6 HOH 3 503 73 HOH HOH B . P 6 HOH 4 504 22 HOH HOH B . P 6 HOH 5 505 65 HOH HOH B . P 6 HOH 6 506 18 HOH HOH B . P 6 HOH 7 507 89 HOH HOH B . P 6 HOH 8 508 7 HOH HOH B . P 6 HOH 9 509 12 HOH HOH B . P 6 HOH 10 510 15 HOH HOH B . P 6 HOH 11 511 19 HOH HOH B . P 6 HOH 12 512 21 HOH HOH B . P 6 HOH 13 513 24 HOH HOH B . P 6 HOH 14 514 25 HOH HOH B . P 6 HOH 15 515 26 HOH HOH B . P 6 HOH 16 516 27 HOH HOH B . P 6 HOH 17 517 28 HOH HOH B . P 6 HOH 18 518 30 HOH HOH B . P 6 HOH 19 519 31 HOH HOH B . P 6 HOH 20 520 33 HOH HOH B . P 6 HOH 21 521 34 HOH HOH B . P 6 HOH 22 522 35 HOH HOH B . P 6 HOH 23 523 37 HOH HOH B . P 6 HOH 24 524 40 HOH HOH B . P 6 HOH 25 525 43 HOH HOH B . P 6 HOH 26 526 45 HOH HOH B . P 6 HOH 27 527 48 HOH HOH B . P 6 HOH 28 528 51 HOH HOH B . P 6 HOH 29 529 52 HOH HOH B . P 6 HOH 30 530 54 HOH HOH B . P 6 HOH 31 531 55 HOH HOH B . P 6 HOH 32 532 57 HOH HOH B . P 6 HOH 33 533 58 HOH HOH B . P 6 HOH 34 534 62 HOH HOH B . P 6 HOH 35 535 66 HOH HOH B . P 6 HOH 36 536 67 HOH HOH B . P 6 HOH 37 537 68 HOH HOH B . P 6 HOH 38 538 69 HOH HOH B . P 6 HOH 39 539 71 HOH HOH B . P 6 HOH 40 540 72 HOH HOH B . P 6 HOH 41 541 76 HOH HOH B . P 6 HOH 42 542 79 HOH HOH B . P 6 HOH 43 543 81 HOH HOH B . P 6 HOH 44 544 82 HOH HOH B . P 6 HOH 45 545 85 HOH HOH B . P 6 HOH 46 546 90 HOH HOH B . # 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_defined_assembly ? monomeric 1 2 author_defined_assembly ? 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,O 2 1 B,H,I,J,K,L,M,N,P # _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 2015-03-25 2 'Structure model' 1 1 2017-09-13 3 'Structure model' 1 2 2017-11-22 # _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' 'Author supporting evidence' 3 2 'Structure model' 'Derived calculations' 4 2 'Structure model' 'Source and taxonomy' 5 3 'Structure model' 'Refinement description' # loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 2 'Structure model' entity_src_gen 2 2 'Structure model' pdbx_audit_support 3 2 'Structure model' pdbx_struct_oper_list 4 2 'Structure model' pdbx_validate_close_contact 5 2 'Structure model' struct_conn 6 3 'Structure model' software # loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 2 'Structure model' '_entity_src_gen.pdbx_alt_source_flag' 2 2 'Structure model' '_pdbx_audit_support.funding_organization' 3 2 'Structure model' '_pdbx_struct_oper_list.symmetry_operation' 4 2 'Structure model' '_struct_conn.id' # 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[2][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] 'X-RAY DIFFRACTION' 1 ? refined 34.9694 86.6045 65.8475 0.2837 0.0702 0.0072 0.0562 -0.0078 -0.0189 1.4662 1.2504 2.1161 0.4173 -1.1085 -0.5144 0.0438 -0.0274 -0.0165 -0.0694 -0.0277 -0.0289 -0.2888 -0.0410 0.1720 'X-RAY DIFFRACTION' 2 ? refined 41.3750 79.1221 21.6907 0.1884 0.2236 0.1080 -0.0830 0.0711 -0.0214 1.4174 1.8129 2.3236 0.0627 0.2363 0.4705 0.0584 -0.1614 0.1030 -0.0224 0.0378 0.3851 0.1609 0.0575 -0.6038 # 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.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection_details _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection 'X-RAY DIFFRACTION' 1 1 A 4 A 385 ? ? ? ? ? ? 'X-RAY DIFFRACTION' 2 2 B 3 B 397 ? ? ? ? ? ? # loop_ _software.citation_id _software.classification _software.compiler_name _software.compiler_version _software.contact_author _software.contact_author_email _software.date _software.description _software.dependencies _software.hardware _software.language _software.location _software.mods _software.name _software.os _software.os_version _software.type _software.version _software.pdbx_ordinal ? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0073 1 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? . 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 ? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot ? ? ? . 5 ? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.15 6 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 ND2 A ASN 256 ? ? O5 A NAG 403 ? ? 1.95 2 1 ND2 B ASN 365 ? ? O5 B NAG 404 ? ? 2.04 3 1 O1S B EPE 405 ? ? O B HOH 546 ? ? 2.12 4 1 ND2 B ASN 240 ? ? O5 B NAG 402 ? ? 2.12 5 1 N B VAL 52 ? ? O B HOH 501 ? ? 2.13 6 1 ND2 A ASN 240 ? ? O5 A NAG 402 ? ? 2.15 7 1 ND2 B ASN 66 ? ? O5 B NAG 401 ? ? 2.16 # _pdbx_validate_rmsd_angle.id 1 _pdbx_validate_rmsd_angle.PDB_model_num 1 _pdbx_validate_rmsd_angle.auth_atom_id_1 N _pdbx_validate_rmsd_angle.auth_asym_id_1 B _pdbx_validate_rmsd_angle.auth_comp_id_1 PRO _pdbx_validate_rmsd_angle.auth_seq_id_1 51 _pdbx_validate_rmsd_angle.PDB_ins_code_1 ? _pdbx_validate_rmsd_angle.label_alt_id_1 ? _pdbx_validate_rmsd_angle.auth_atom_id_2 CA _pdbx_validate_rmsd_angle.auth_asym_id_2 B _pdbx_validate_rmsd_angle.auth_comp_id_2 PRO _pdbx_validate_rmsd_angle.auth_seq_id_2 51 _pdbx_validate_rmsd_angle.PDB_ins_code_2 ? _pdbx_validate_rmsd_angle.label_alt_id_2 ? _pdbx_validate_rmsd_angle.auth_atom_id_3 C _pdbx_validate_rmsd_angle.auth_asym_id_3 B _pdbx_validate_rmsd_angle.auth_comp_id_3 PRO _pdbx_validate_rmsd_angle.auth_seq_id_3 51 _pdbx_validate_rmsd_angle.PDB_ins_code_3 ? _pdbx_validate_rmsd_angle.label_alt_id_3 ? _pdbx_validate_rmsd_angle.angle_value 134.88 _pdbx_validate_rmsd_angle.angle_target_value 112.10 _pdbx_validate_rmsd_angle.angle_deviation 22.78 _pdbx_validate_rmsd_angle.angle_standard_deviation 2.60 _pdbx_validate_rmsd_angle.linker_flag 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 ASP A 23 ? ? -151.65 70.55 2 1 VAL A 52 ? ? -49.23 -15.76 3 1 ILE A 53 ? ? -144.96 -3.89 4 1 TYR A 104 ? ? -125.39 -79.51 5 1 GLU A 121 ? ? -113.03 -92.61 6 1 SER A 165 ? ? 56.79 -130.03 7 1 THR A 329 ? ? -127.73 -54.73 8 1 ASP B 23 ? ? -151.96 70.28 9 1 TYR B 104 ? ? -125.48 -80.31 10 1 GLU B 121 ? ? -111.61 -90.99 11 1 SER B 165 ? ? 56.89 -130.67 12 1 ASN B 212 ? B -102.89 -79.57 13 1 ASN B 213 ? B 42.86 -25.69 14 1 ILE B 215 ? B 155.92 85.64 15 1 THR B 329 ? ? -127.95 -54.58 # 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 GLY 0 ? A GLY 1 2 1 Y 1 A ALA 1 ? A ALA 2 3 1 Y 1 A GLY 2 ? A GLY 3 4 1 Y 1 A ARG 3 ? A ARG 4 5 1 Y 1 B GLY 0 ? B GLY 1 6 1 Y 1 B ALA 1 ? B ALA 2 7 1 Y 1 B GLY 2 ? B GLY 3 # _pdbx_audit_support.funding_organization 'National Institutes of Health/National Heart, Lung, and Blood Institute' _pdbx_audit_support.country 'United States' _pdbx_audit_support.grant_number HL086865 _pdbx_audit_support.ordinal 1 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 '4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID' EPE 4 'DI(HYDROXYETHYL)ETHER' PEG 5 3,6,9,12,15,18,21-HEPTAOXATRICOSANE-1,23-DIOL PE8 6 water HOH #